SMILES
stringlengths 6
120
| Deep SMILES
stringlengths 6
124
| SELFIES
stringlengths 18
409
| SAFE
stringlengths 9
126
|
|---|---|---|---|
CCCC[C@H](CNC(=O)c1nc(OC)c(C)s1)NC(=O)[C@@H]1CCN(C)[C@@H]1C
|
CCCC[C@H]CNC=O)cncOC))cC)s5))))))))NC=O)[C@@H]CCNC)[C@@H]5C
|
[C][C][C][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=N][C][Branch1][Ring1][O][C][=C][Branch1][C][C][S][Ring1][Branch2][N][C][=Branch1][C][=O][C@@H1][C][C][N][Branch1][C][C][C@@H1][Ring1][=Branch1][C]
|
CCCCC5C6.c17nc4c(C)s1.C18CCN(C)C1C.C27=O.C38=O.N26.O4C.N35
|
CC[C@H]1CN(C(=O)CCC(F)(F)F)CCN1C(=O)c1ncc(C#N)cc1Cl
|
CC[C@H]CNC=O)CCCF)F)F)))))CCN6C=O)cnccC#N))cc6Cl
|
[C][C][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][=N][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][Cl]
|
c14ncc(C#N)cc1Cl.C15CN2CCN13.C2(=O)CCC(F)(F)F.C34=O.CC5
|
CC[C@@H]1[C@@H](NC(=O)c2cnn(C)c2)CCN1C(=O)[C@@H]1CCCC12CCC2
|
CC[C@@H][C@@H]NC=O)ccnnC)c5)))))))CCN5C=O)[C@@H]CCCC5CCC4
|
[C][C][C@@H1][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][N][Ring1][=C][C][=Branch1][C][=O][C@@H1][C][C][C][C][Ring1][Branch1][C][C][C][Ring1][Ring2]
|
C16CCCC12CCC2.C18C5CCN14.c17cnn(C)c1.C37=O.C46=O.CC8.N35
|
C=CCSCC(=O)NC[C@](C)(NC(=O)c1cc(COC)oc1C)C1CC1
|
C=CCSCC=O)NC[C@]C)NC=O)cccCOC)))oc5C))))))))CCC3
|
[C][=C][C][S][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][Branch1][Ring2][C][O][C][O][C][=Ring1][Branch2][C][C][C][C][Ring1][Ring1]
|
c1%10cc%11oc1C.C6C73C.C9C2=O.C=CC8.C4%10=O.C13CC1.S89.N26.N47.C5%11.O5C
|
CC1(C)C[C@H](NC(=O)[C@H]2CCc3ccccc32)CN(C(=O)C2COCCOC2)C1
|
CCC)C[C@H]NC=O)[C@H]CCcccccc69)))))))))))CNC=O)CCOCCOC7))))))))C6
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][O][C][C][O][C][Ring1][#Branch1][C][Ring2][Ring1][N]
|
C4(=O)C1CCc2ccccc21.CC1(C)CC6CN5C1.C17COCCOC1.C57=O.N46
|
Cc1nc2n(c1CC(=O)NC1(CS(C)(=O)=O)COC1)CCCC2
|
Ccncnc5CC=O)NCCSC)=O)=O)))COC4))))))))CCCC6
|
[C][C][N][=C][N][Branch2][Ring1][O][C][=Ring1][Branch1][C][C][=Branch1][C][=O][N][C][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][O][C][Ring1][=Branch2][C][C][C][C][Ring2][Ring1][Ring2]
|
Cc1nc2n(c15)CCCC2.C146COC1.C6S(C)(=O)=O.C5C3=O.N34
|
Cc1cc(Br)cc(C2(C(=O)Oc3ccc(OC4CCC4)cc3)CC2)c1
|
CcccBr)ccCC=O)OccccOCCCC4)))))cc6))))))))CC3)))c6
|
[C][C][=C][C][Branch1][C][Br][=C][C][Branch2][Ring1][#C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch2][O][C][C][C][C][Ring1][Ring2][C][=C][Ring1][O][C][C][Ring1][P][=C][Ring2][Ring1][Branch2]
|
Cc1cc%10cc(Br)c1.c17ccc8cc1.C19%10CC1.C16CCC1.C59=O.O57.O68
|
O=C(Cc1cccc(F)c1)N[C@@H]1CN(C(=O)c2cnoc2)CCc2ccccc21
|
O=CCcccccF)c6)))))))N[C@@H]CNC=O)ccnoc5))))))CCcccccc6%11
|
[O][=C][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=N][O][C][=Ring1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][C]
|
N3C1CN4CCc2ccccc21.c16cccc(F)c1.c15cnoc1.O=C3C6.C45=O
|
CCN(C(=O)c1cc(C(N)=O)cn1C)[C@@H]1CCCN(C(=O)CCC(C)C)C1
|
CCNC=O)cccCN)=O))cn5C)))))))[C@@H]CCCNC=O)CCCC)C)))))C6
|
[C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][N][Ring1][Branch2][C][C@@H1][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][C][Ring1][=N]
|
c16cc7cn1C.C15CCCN3C1.C3(=O)CCC(C)C.N245.C26=O.C7(N)=O.CC4
|
Cc1nc(NC(=O)[C@H]2CSCCN2Cc2c(C)[nH]c3ccccc23)cnc1Cl
|
CcncNC=O)[C@H]CSCCN6CccC)[nH]cccccc96))))))))))))))))))cnc6Cl
|
[C][C][=N][C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C@H1][C][S][C][C][N][Ring1][=Branch1][C][C][=C][Branch1][C][C][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][=C][N][=C][Ring2][Ring1][#Branch2][Cl]
|
c18c(C)[nH]c2ccccc12.Cc1nc6cnc1Cl.C17CSCCN15.C47=O.N46.C58
|
O=C(NCC[C@@H]1CN(C(=O)[C@@H](O)C2CCCCC2)CCO1)c1csc2cncn12
|
O=CNCC[C@@H]CNC=O)[C@@H]O)CCCCCC6))))))))CCO6)))))))))ccsccncn85
|
[O][=C][Branch2][Ring1][=C][N][C][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][C][C][C][Ring1][=Branch1][C][C][O][Ring1][S][C][=C][S][C][=C][N][=C][N][Ring1][Branch2][Ring1][Branch1]
|
c16csc2cncn12.C17CN4CCO1.C18CCCCC1.C4(=O)C8O.O=C36.C5C7.N35
|
CCc1cc(C(=O)N2CCN(C(=O)CC3(C)OCCO3)C[C@H]2CO)on1
|
CCcccC=O)NCCNC=O)CCC)OCCO5)))))))C[C@H]6CO)))))))))on5
|
[C][C][C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][Branch1][C][C][O][C][C][O][Ring1][=Branch1][C][C@H1][Ring1][#C][C][O][O][N][=Ring2][Ring1][Branch2]
|
N14CCN5CC18.c19cc6on1.C17(C)OCCO1.C5(=O)C7.C46=O.CC9.C8O
|
C#CCCCC(=O)N1CCN(C(=O)C(C)=Cc2cccnc2)[C@@H](c2cn[nH]c2)C1
|
C#CCCCC=O)NCCNC=O)CC)=Cccccnc6)))))))))[C@@H]ccn[nH]c5)))))C6
|
[C][#C][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][C][C][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][C@@H1][Branch1][Branch2][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring2][Ring1][=Branch1]
|
N13CCN4C6C1.C#CCCCC3=O.C=5c1cccnc1.C4(=O)C=5C.c16cn[nH]c1
|
Cn1cnnc1CC(=O)N1CCO[C@H](CCNC(=O)[C@@]2(C)CCCCO2)C1
|
Cncnnc5CC=O)NCCO[C@H]CCNC=O)[C@@]C)CCCCO6))))))))))C6
|
[C][N][C][=N][N][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][C]
|
N13CCOC7C1.C16(C)CCCCO1.Cn1cnnc18.C8C3=O.C7C5.C46=O.N45
|
C[C@@H](Oc1ccccc1)C(=O)NC[C@H](C1CC1)N(C)C(=O)c1coc(O)n1
|
C[C@@H]Occcccc6)))))))C=O)NC[C@H]CCC3)))NC)C=O)ccocO)n5
|
[C][C@@H1][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][O][=N][Ring1][=Branch1]
|
c15ccccc1.c18coc(O)n1.CC4C2=O.C6C79.C19CC1.N37C.C38=O.O45.N26
|
CCOC(=O)c1cc(NC(=O)C23CCC(C(=O)NCC4CC4)(CC2)CC3)on1
|
CCOC=O)cccNC=O)CCCCC=O)NCCCC3))))))CC6))CC6))))))))on5
|
[C][C][O][C][=Branch1][C][=O][C][C][=C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][C][C][C][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][Branch1][Branch1][C][C][Ring1][=N][C][C][Ring1][#C][O][N][=Ring2][Ring1][#Branch1]
|
C12%13CCC%14(CC1)CC2.c1%12cc%11on1.C5%12=O.C7%13=O.C8%14=O.C16CC1.CC9.O59.N7%11.N8%10.C%106
|
CCc1csc(S(=O)(=O)NC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)n1
|
CCccscS=O)=O)NC[C@@]CO))C[C@H]3ccccF)cc6))))))))))))n5
|
[C][C][C][=C][S][C][Branch2][Ring1][=C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@@][Branch1][Ring1][C][O][C][C@H1][Ring1][Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring2][Ring1][=Branch1]
|
c15csc(S4(=O)=O)n1.c18ccc(F)cc1.C167CC18.CC5.N34.C36.C7O
|
COCC=CC(=O)N1CC[C@@H](C2CC2)[C@H]1C(=O)NC1(c2ncc(C)o2)CC1
|
COCC=CC=O)NCC[C@@H]CCC3)))[C@H]5C=O)NCcnccC)o5)))))CC3
|
[C][O][C][C][=C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][Branch1][O][C][=N][C][=C][Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch2]
|
N13CCC(C2CC2)C17.c19ncc(C)o1.C=8C3=O.C169CC1.C5C=8.C47=O.CO5.N46
|
CCN(C[C@H](C)NC(=O)CNC(=O)CC(C)(C)C)C(=O)c1cnc(OC)c(C)c1
|
CCNC[C@H]C)NC=O)CNC=O)CCC)C)C))))))))))C=O)ccncOC))cC)c6
|
[C][C][N][Branch2][Ring1][#Branch2][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring1][O][C][C][Branch1][C][C][=C][Ring1][=Branch2]
|
c1%10cnc5c(C)c1.C3(=O)CC(C)(C)C.C7C8C.C2(=O)C9.N467.C4%10=O.CC6.N28.N39.O5C
|
C[C@H](CCNc1cc(C(F)(F)F)cc(Cl)n1)c1cn[nH]c1
|
C[C@H]CCNcccCF)F)F))ccCl)n6)))))))))ccn[nH]c5
|
[C][C@H1][Branch2][Ring1][=Branch2][C][C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][Branch1][C][Cl][=N][Ring1][O][C][C][=N][NH1][C][=Ring1][Branch1]
|
c13cc5cc(Cl)n1.CC4CC2.c14cn[nH]c1.C5(F)(F)F.N23
|
CC=C[C@@H](O)C(=O)N[C@]1(CNC(=O)c2ccc(OC(F)(F)F)cc2C)CCOC1
|
CC=C[C@@H]O)C=O)N[C@]CNC=O)ccccOCF)F)F)))cc6C))))))))))CCOC5
|
[C][C][=C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][C][C][O][C][Ring2][Ring1][Branch1]
|
c18ccc5cc1C.C=9C(O)C3=O.C16%10CCOC1.O5C(F)(F)F.C48=O.CC=9.N36.C7%10.N47
|
COC[C@H]1C[C@@H]1C(=O)N1CCC2=C(C=C(F)C=C2C(=O)O)C1
|
COC[C@H]C[C@@H]3C=O)NCCC=CC=CF)C=C6C=O)O))))))C6
|
[C][O][C][C@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][=C][Branch1][#C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Ring1][=C]
|
N13CCc2c6cc(F)cc2C1.C17CC15.C35=O.C6(=O)O.CO4.C47
|
CCn1c(C(=O)NC[C@@H]2C[C@H](CNC(=O)CC(C)(C)CC)CO2)cnc1O
|
CCncC=O)NC[C@@H]C[C@H]CNC=O)CCC)C)CC)))))))CO5))))))))cnc5O
|
[C][C][N][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][O][Ring1][#C][=C][N][=C][Ring2][Ring1][Branch2][O]
|
C4(=O)CC(C)(C)CC.n18c7cnc1O.C19CC%10CO1.C37=O.CC8.N35.C59.C6%10.N46
|
CCc1ncc(C(=O)NC[C@@H](CC)NC(=O)[C@H]2C[C@](F)(CO)C2)[nH]1
|
CCcnccC=O)NC[C@@H]CC))NC=O)[C@H]C[C@]F)CO))C4))))))))))[nH]5
|
[C][C][C][=N][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][C][C@][Branch1][C][F][Branch1][Ring1][C][O][C][Ring1][#Branch1][NH1][Ring2][Ring1][=Branch1]
|
c19ncc7[nH]1.C18CC%10(F)C1.C5C6CC.C37=O.C48=O.CC9.N35.N46.C%10O
|
CCc1cc(N)ccc1C(=O)N[C@H](CCN(C)C(=O)[C@@H]1CCCSC1)C(C)C
|
CCcccN)ccc6C=O)N[C@H]CCNC)C=O)[C@@H]CCCSC6))))))))))CC)C
|
[C][C][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C][S][C][Ring1][=Branch1][C][Branch1][C][C][C]
|
c18cc(N)ccc17.C4(CC5)C(C)C.C16CCCSC1.C27=O.N35C.C36=O.CC8.N24
|
Cc1cccc(N)c1C(=O)NC[C@@H]1CC[C@H](NC(=O)c2ccoc2)C1
|
CcccccN)c6C=O)NC[C@@H]CC[C@H]NC=O)cccoc5)))))))C5
|
[C][C][=C][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][C][Ring1][=N]
|
Cc1cccc(N)c17.C19CCC6C1.c18ccoc1.C37=O.C48=O.N35.C59.N46
|
C[C@@](CO)(CNC(=O)[C@@]1(C)CCC(=O)N1)NC(=O)CSc1cccc(F)c1
|
C[C@@]CO))CNC=O)[C@@]C)CCC=O)N5))))))))NC=O)CScccccF)c6
|
[C][C@@][Branch1][Ring1][C][O][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
C17(C)CCC(=O)N1.c18cccc(F)c1.CC4(C5)CO.C3(=O)C6.C27=O.N25.N34.S68
|
C[C@@]1(C(=O)N2CCC[C@H](C(=O)NCCCCCO)CC2)COCCO1
|
C[C@@]C=O)NCCC[C@H]C=O)NCCCCCO))))))))CC7))))))))COCCO6
|
[C][C@@][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][C][O][C][C][Ring1][S][C][O][C][C][O][Ring2][Ring1][Branch2]
|
N13CCCC7CC1.CC16COCCO1.C5CCCCO.C36=O.C47=O.N45
|
COc1cc(C)c(C(=O)N[C@@H]2CC[C@H](C)N(C(=O)Cc3cccs3)C2)cn1
|
COcccC)cC=O)N[C@@H]CC[C@H]C)NC=O)Cccccs5)))))))C6))))))))cn6
|
[C][O][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][C][=C][S][Ring1][Branch1][C][Ring1][#C][C][=N][Ring2][Ring1][=Branch2]
|
c16cc(C)c8cn1.C17CCC(C)N5C1.c19cccs1.C5(=O)C9.C48=O.CO6.N47
|
C[C@H](CNC(=O)CN1CC[C@@](C)(O)C1)N(C)C(=O)CCCSC(C)(C)C
|
C[C@H]CNC=O)CNCC[C@@]C)O)C5)))))))))NC)C=O)CCCSCC)C)C
|
[C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][N][C][C][C@@][Branch1][C][C][Branch1][C][O][C][Ring1][#Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][S][C][Branch1][C][C][Branch1][C][C][C]
|
N16CCC(C)(O)C1.C3(=O)CCC7.CC4C5.C2(=O)C6.C8(C)(C)C.N34C.N25.S78
|
C[C@@H](C(=O)N1CCC[C@@H](NC(=O)[C@H]2C[C@H](Oc3ccccc3)C2)[C@H]1C)N(C)C
|
C[C@@H]C=O)NCCC[C@@H]NC=O)[C@H]C[C@H]Occcccc6)))))))C4))))))[C@H]6C))))))))NC)C
|
[C][C@@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][C][C@H1][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][C@H1][Ring2][Ring1][Ring2][C][N][Branch1][C][C][C]
|
N14CCCC9C1C.c17ccccc1.CC8C4=O.C1%10CC6C1.C5%10=O.N8(C)C.N59.O67
|
CN1CC=C(CC(=O)N[C@](C)(CNC(=O)c2cc3ncccc3o2)C2CC2)CC1
|
CNCC=CCC=O)N[C@]C)CNC=O)cccncccc6o9))))))))))))CCC3)))))))CC6
|
[C][N][C][C][=C][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C@][Branch1][C][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][N]
|
CN1CC=C(CC4=O)CC1.c18cc2ncccc2o1.C69(C)C7.C58=O.C19CC1.N46.N57
|
CC[C@@H]1CCN(C(=O)CCn2cnccc2=O)[C@@H]1CNC(=O)C1CC1
|
CC[C@@H]CCNC=O)CCncnccc6=O))))))))))[C@@H]5CNC=O)CCC3
|
[C][C][C@@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][N][C][=N][C][=C][C][Ring1][=Branch1][=O][C@@H1][Ring1][S][C][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1]
|
C19CCN3C18.n17cnccc1=O.C3(=O)CC7.C46=O.C16CC1.CC9.C58.N45
|
C[C@@](O)(C(=O)N[C@@H]1C[C@@H]2C[C@@H](NC(=O)c3cc(C(F)(F)F)n[nH]3)C[C@@H]21)C1CC1
|
C[C@@]O)C=O)N[C@@H]C[C@@H]C[C@@H]NC=O)cccCF)F)F))n[nH]5)))))))C[C@@H]57)))))))))CCC3
|
[C][C@@][Branch1][C][O][Branch2][Ring2][O][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][NH1][Ring1][=Branch2][C][C@@H1][Ring1][P][Ring2][Ring1][Ring1][C][C][C][Ring1][Ring1]
|
C16CC2CC7CC12.CC%10(O)C4=O.c18cc9n[nH]1.C9(F)(F)F.C58=O.C1%10CC1.N46.N57
|
CC(=O)c1ccncc1NC(=O)[C@@H]1CCN1Cc1cccc(C(F)(F)F)c1O
|
CC=O)cccncc6NC=O)[C@@H]CCN4CcccccCF)F)F))c6O
|
[C][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][N][Ring1][Ring2][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][O]
|
c17cccc8c1O.c16ccncc14.C15CCN13.C8(F)(F)F.CC6=O.C25=O.N24.C37
|
O=C1CCCC[C@H](C(=O)N[C@H]2CC[C@H](NC(=O)c3occ4c3CCOC4)CC2)C1
|
O=CCCCC[C@H]C=O)N[C@H]CC[C@H]NC=O)coccc5CCOC6)))))))))))CC6))))))))C7
|
[O][=C][C][C][C][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][C][O][C][Ring1][=Branch1][C][C][Ring2][Ring1][C][C][Ring2][Ring1][N]
|
c19occ2c1CCOC2.O=C1CCCCC%10C1.C17CCC8CC1.C5%10=O.C69=O.N57.N68
|
O=C(c1ccc(Cl)[nH]1)N1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn2cncc2c1
|
O=CccccCl)[nH]5)))))NC[C@@H]CC[C@H]C7)N5C=O)cccncncc5c9
|
[O][=C][Branch1][O][C][=C][C][=C][Branch1][C][Cl][NH1][Ring1][=Branch1][N][C][C@@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][N][C][=N][C][=C][Ring1][Branch1][C][=Ring1][=Branch2]
|
N13CC2CCC(C1)N24.c16ccn2cncc2c1.c15ccc(Cl)[nH]1.O=C35.C46=O
|
CO[C@H](CO)CNC(=O)CNC(=O)CNC(=O)c1ncccc1Cl
|
CO[C@H]CO))CNC=O)CNC=O)CNC=O)cncccc6Cl
|
[C][O][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][Cl]
|
c19ncccc1Cl.C5(C6)CO.C2(=O)C7.C3(=O)C8.C49=O.CO5.N26.N37.N48
|
CCN1CC[C@@H](C(=O)N[C@]23C[C@H]2[C@@H]2CC[C@H](C3)N2C(=O)C=CC(=O)NC2CC2)C1
|
CCNCC[C@@H]C=O)N[C@]C[C@H]3[C@@H]CC[C@H]C8)N5C=O)C=CC=O)NCCC3))))))))))))))))))C5
|
[C][C][N][C][C][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C@][C][C@H1][Ring1][Ring1][C@@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][Branch2][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][Ring2][Ring1][O]
|
C128CC3CCC(C1C2)N35.N17CCC%10C1.C5(=O)C=%11.C=%11C6=O.C4%10=O.C19CC1.CC7.N48.N69
|
CCON(C(=O)c1cc2nc(Cl)ccc2s1)[C@@H](C)c1cccc(Br)c1
|
CCONC=O)cccncCl)ccc6s9))))))))))[C@@H]C)cccccBr)c6
|
[C][C][O][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][C@@H1][Branch1][C][C][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1]
|
c14cc2nc(Cl)ccc2s1.O3N(C4=O)C5C.c15cccc(Br)c1.CC3
|
CCn1ccnc1C(=O)N[C@H]1CC[C@@H](C(=O)NCc2nc(COC)no2)C1
|
CCnccnc5C=O)N[C@H]CC[C@@H]C=O)NCcncCOC)))no5))))))))C5
|
[C][C][N][C][=C][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=N][C][Branch1][Ring2][C][O][C][=N][O][Ring1][Branch2][C][Ring1][P]
|
n1%11ccnc19.C18CCC%10C1.c1%12nc4no1.C39=O.C5%10=O.CC%11.N38.N57.C7%12.C64.O6C
|
CC(C)(O)C(=O)N1CCC2(CC1)CO[C@@H](CNC(=O)C1(Cl)CC1)C2
|
CCC)O)C=O)NCCCCC6))CO[C@@H]CNC=O)CCl)CC3))))))C5
|
[C][C][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][O][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][Branch1][C][Cl][C][C][Ring1][Ring2][C][Ring1][#C]
|
N13CCC2(CC1)COC7C2.CC(C)(O)C3=O.C16(Cl)CC1.C46=O.C57.N45
|
CCc1nc(C(=O)N(CCO)C2CCN(C(=O)[C@@]3(C)CC=C(C)CC3)CC2)co1
|
CCcncC=O)NCCO)))CCCNC=O)[C@@]C)CC=CC)CC6)))))))CC6))))))))co5
|
[C][C][C][=N][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][=C][Branch1][C][C][C][C][Ring1][Branch2][C][C][Ring1][S][=C][O][Ring2][Ring1][O]
|
C19(C)CC=C(C)CC1.C17CCN5CC1.c1%10nc8co1.C48=O.N467.C6CO.C59=O.CC%10
|
CCn1ccc(C(=O)NCC[C@@H]2CCCN(Cc3cc(Cl)cnc3Br)C2)n1
|
CCncccC=O)NCC[C@@H]CCCNCcccCl)cnc6Br))))))))C6))))))))))n5
|
[C][C][N][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][N][Branch1][=C][C][C][=C][C][Branch1][C][Cl][=C][N][=C][Ring1][#Branch1][Br][C][Ring1][#C][=N][Ring2][Ring1][=Branch2]
|
c1%10cc(Cl)cnc1Br.C19CCCN6C1.n18ccc7n1.C47=O.C5C9.CC8.N45.C6%10
|
C[C@](O)(CNC(=O)Cn1ncc(C#N)c1N)CNC(=O)[C@@]12CSC[C@H]1C2
|
C[C@]O)CNC=O)CnnccC#N))c5N))))))))))CNC=O)[C@@]CSC[C@H]5C6
|
[C][C@][Branch1][C][O][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][N][N][=C][C][Branch1][Ring1][C][#N][=C][Ring1][#Branch1][N][C][N][C][=Branch1][C][=O][C@@][C][S][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1]
|
n18ncc(C#N)c1N.CC(O)(C5)C6.C127CSCC1C2.C3(=O)C8.C47=O.N35.N46
|
CC(C)CN1CCC[C@H]1C(=O)NC1CN(C(=O)[C@H](NS(=O)(=O)C2CC2)C(C)C)C1
|
CCC)CNCCC[C@H]5C=O)NCCNC=O)[C@H]NS=O)=O)CCC3)))))CC)C))))C4
|
[C][C][Branch1][C][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C@H1][Branch1][=C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][Branch1][C][C][C][C][Ring1][P]
|
C4(=O)C6C(C)C.N15CCCC19.S7(=O)(=O)C1CC1.C18CN4C1.CC(C)C5.C39=O.N38.N67
|
C[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)C[C@@H]1CNC(=O)c1cc(Br)c[nH]1
|
C[C@H]CCNC=O)cccO)ncO)n6)))))))C[C@@H]6CNC=O)cccBr)c[nH]5
|
[C][C@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][C][O][=N][Ring1][Branch2][C][C@@H1][Ring1][S][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][NH1][Ring1][=Branch1]
|
CC1CCN3CC18.c16cc(O)nc(O)n1.c17cc(Br)c[nH]1.C36=O.C47=O.C58.N45
|
CC=C(F)C(=O)N1[C@H]2CC[C@H]1CN(C(=O)c1ccc3c(F)cc(F)cc3n1)CC2
|
CC=CF)C=O)N[C@H]CC[C@H]5CNC=O)cccccF)ccF)cc6n%10)))))))))))CC8
|
[C][C][=C][Branch1][C][F][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][C][Ring1][Branch2][=N][Ring1][N][C][C][Ring2][Ring1][=Branch1]
|
c16ccc2c(F)cc(F)cc2n1.N14C2CCC1CN5CC2.C=7(F)C4=O.C56=O.CC=7
|
Cc1nc(SCC(=O)NC[C@H]2CN(C(=O)CCn3cnnn3)CCN2C)n[nH]1
|
CcncSCC=O)NC[C@H]CNC=O)CCncnnn5))))))))CCN6C))))))))))))n[nH]5
|
[C][C][=N][C][Branch2][Ring1][P][S][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][C][=N][N][=N][Ring1][Branch1][C][C][N][Ring1][#C][C][=N][NH1][Ring2][Ring1][O]
|
C19CN5CCN1C.Cc1nc%10n[nH]1.C5(=O)CC8.n18cnnn1.C7C4=O.S7%10.N46.C69
|
O=C(N[C@H]1CCC[C@@H]1CNC(=O)c1c[nH]nc1F)c1cc2c(nc1O)CCC2
|
O=CN[C@H]CCC[C@@H]5CNC=O)cc[nH]nc5F)))))))))))))))ccccnc6O)))CCC5
|
[O][=C][Branch2][Ring1][#Branch1][N][C@H1][C][C][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][F][C][=C][C][=C][Branch1][=Branch1][N][=C][Ring1][=Branch1][O][C][C][C][Ring1][Branch2]
|
c17cc2c(nc1O)CCC2.C16CCCC19.c18c[nH]nc1F.O=C37.C48=O.N36.C59.N45
|
C[C@@H](CF)NC(=O)C12CCC(NCc3ccc4cnn(C)c4c3)(CC1)CC2
|
C[C@@H]CF))NC=O)CCCCNCcccccnnC)c5c9)))))))))))CC6))CC6
|
[C][C@@H1][Branch1][Ring1][C][F][N][C][=Branch1][C][=O][C][C][C][C][Branch2][Ring1][Ring1][N][C][C][=C][C][=C][C][=N][N][Branch1][C][C][C][Ring1][=Branch1][=C][Ring1][#Branch2][Branch1][=Branch1][C][C][Ring2][Ring1][C][C][C][Ring2][Ring1][Ring2]
|
c1%10ccc2cnn(C)c2c1.C129CCC8(CC1)CC2.CC6CF.C59=O.N56.N78.C7%10
|
C[C@H](CNC(=O)OC(C)(C)C)S(=O)(=O)Nc1cccc(C2(C)OCCO2)c1
|
C[C@H]CNC=O)OCC)C)C))))))S=O)=O)NcccccCC)OCCO5)))))c6
|
[C][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][O][C][Branch1][C][C][O][C][C][O][Ring1][=Branch1][=C][Ring1][N]
|
CC(C6)S7(=O)=O.c18cccc9c1.C19(C)OCCO1.C5(C)(C)C.C34=O.N46.O35.N78
|
COc1nc(Br)cnc1NC(=O)[C@@H]1CCC[C@@H](NC(=O)c2ccc(F)cn2)C1
|
COcncBr)cnc6NC=O)[C@@H]CCC[C@@H]NC=O)ccccF)cn6))))))))C6
|
[C][O][C][=N][C][Branch1][C][Br][=C][N][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][Ring1][S]
|
c15nc(Br)cnc16.C19CCCC7C1.c18ccc(F)cn1.C39=O.C48=O.CO5.N36.N47
|
CC(C)c1ccc(SCC(=O)N(C)[C@H]2[C@@H]3CN(C(=O)Cc4cn[nH]c4)C[C@@H]32)cc1
|
CCC)ccccSCC=O)NC)[C@H][C@@H]CNC=O)Cccn[nH]c5)))))))C[C@@H]56))))))))))cc6
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][Ring1][S][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=N][NH1][C][=Ring1][Branch1][C][C@@H1][Ring1][=N][Ring1][=C][C][=C][Ring2][Ring1][#Branch2]
|
c19ccc%11cc1.C18C2CN6CC12.c1%10cn[nH]c1.C7C5=O.C6(=O)C%10.CC9C.N58C.S7%11
|
CCc1cnc(C(=O)N2CCC3(CC(C(=O)N[C@H]4CCCC[C@@H]4C#N)C3)C2)nc1
|
CCccncC=O)NCCCCCC=O)N[C@H]CCCC[C@@H]6C#N))))))))))C4)))C5))))))nc6
|
[C][C][C][=C][N][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][Branch1][S][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][#N][C][Ring1][#C][C][Ring2][Ring1][Ring1][N][=C][Ring2][Ring1][O]
|
N15CCC2(CC9C2)C1.C17CCCCC1C#N.c1%10cnc8nc1.C58=O.C69=O.CC%10.N67
|
CCc1nc(C)[nH]c1C(=O)N[C@H]1CCCC[C@@H]1NC(=O)C1CC(CC)(CC)C1
|
CCcncC)[nH]c5C=O)N[C@H]CCCC[C@@H]6NC=O)CCCCC))CC))C4
|
[C][C][C][N][=C][Branch1][C][C][NH1][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][Ring1][Branch2]
|
c18nc(C)[nH]c16.C14CCCCC15.C17CC9%10C1.C26=O.C37=O.CC8.N24.N35.C9C.C%10C
|
CCC1=NO[C@H](C(=O)NCCC2(NC(=O)c3ccc4c(=N)[nH]cnc4c3)CC2)C1
|
CCC=NO[C@H]C=O)NCCCNC=O)ccccc=N)[nH]cnc6c%10))))))))))))CC3)))))))C5
|
[C][C][C][=N][O][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][C][=N][NH1][C][=N][C][Ring1][#Branch1][=C][Ring1][O][C][C][Ring1][P][C][Ring2][Ring1][O]
|
c1%10ccc2c(=N)[nH]cnc2c1.CCC1=NOC9C1.C18%11CC1.C59=O.C7C%11.C6%10=O.N57.N68
|
CC(C)CCCOCC(=O)N(C)[C@@H](C)CN(C)C(=O)CC1(c2ccon2)CCC1
|
CCC)CCCOCC=O)NC)[C@@H]C)CNC)C=O)CCcccon5)))))CCC4
|
[C][C][Branch1][C][C][C][C][C][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch1][Branch2][C][C][=C][O][N][=Ring1][Branch1][C][C][C][Ring1][=Branch2]
|
CC(C)CCC5.C19%10CCC1.c1%10ccon1.C6C3=O.C7(C)C8.C4(=O)C9.N37C.N48C.O56
|
Cc1ccc(C(=O)NC[C@H]2C[C@H]2NC(=O)[C@@H]2c3ccccc3C(=O)N2C)c(O)n1
|
CccccC=O)NC[C@H]C[C@H]3NC=O)[C@@H]cccccc6C=O)N9C))))))))))))))))))cO)n6
|
[C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][Branch1][C][O][=N][Ring2][Ring1][N]
|
C5(=O)C1c2ccccc2C(=O)N1C.Cc1ccc8c(O)n1.C19CC17.C48=O.N46.C69.N57
|
CCn1c(C)cc2c1CCC[C@H]2NC(=O)c1cc2c(Br)nccc2[nH]1
|
CCncC)ccc5CCC[C@H]6NC=O)ccccBr)nccc6[nH]9
|
[C][C][N][C][Branch1][C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][N][=C][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2]
|
n15c(C)cc2c1CCCC2N3.c14cc2c(Br)nccc2[nH]1.C34=O.CC5
|
COc1sccc1C(=O)NC(C)(C)CNC(=O)c1ccc(OC(C)C)c(N)c1
|
COcsccc5C=O)NCC)C)CNC=O)ccccOCC)C)))cN)c6
|
[C][O][C][S][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][O][C][Branch1][C][C][C][C][Branch1][C][N][=C][Ring1][O]
|
c1%10ccc6c(N)c1.c15sccc19.C7(C)(C)C8.C29=O.C3%10=O.C4(C)C.CO5.N27.N38.O46
|
OC[C@@H]1CN(N2CCC3(Cc4ccccc4C3)C2)CCC12CCC2
|
OC[C@@H]CNNCCCCcccccc6C9))))))))C5)))))CCC6CCC4
|
[O][C][C@@H1][C][N][Branch2][Ring1][=Branch1][N][C][C][C][Branch1][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][=N][C][C][C][Ring2][Ring1][Ring1][C][C][C][Ring1][Ring2]
|
C15CN(N2CCC3(Cc4ccccc4C3)C2)CCC12CCC2.OC5
|
CCCCSCCC(=O)N[C@H]1CC[C@](F)(CNC(=O)[C@]2(C#N)CC2(C)C)C1
|
CCCCSCCC=O)N[C@H]CC[C@]F)CNC=O)[C@]C#N))CC3C)C)))))))C5
|
[C][C][C][C][S][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@][Branch1][C][F][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@][Branch1][Ring1][C][#N][C][C][Ring1][Branch1][Branch1][C][C][C][C][Ring1][P]
|
C18CCC%10(F)C1.C19(C#N)CC1(C)C.C7CC3=O.CCCC6.C49=O.S67.N38.C5%10.N45
|
CCNC(=O)CCC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3NC(=O)CCC(C)(C)OC
|
CCNC=O)CCC=O)NC[C@@H]C[C@H]C[C@H]5[C@H]8[C@H]5NC=O)CCCC)C)OC
|
[C][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][C][C@H1][Ring1][Branch1][C@H1][Ring1][Branch2][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][O][C]
|
N15CC2CC3CC2C1C39.C6(=O)CCC7(C)C.C4(=O)CCC5=O.CC8.N48.N69.O7C
|
CCCCCCC(=O)N1C[C@H]2CCC[C@@](NC(=O)CC[C@H](C)CC)(C2)C1
|
CCCCCCC=O)NC[C@H]CCC[C@@]NC=O)CC[C@H]C)CC)))))))C6)C8
|
[C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@][Branch1][=C][N][C][=Branch1][C][=O][C][C][C@H1][Branch1][C][C][C][C][Branch1][Ring2][C][Ring1][#C][C][Ring2][Ring1][C]
|
N13CC2CCCC5(C2)C1.CCCCCCC3=O.C4(=O)CCC(C)CC.N45
|
C#CC1(OCC(=O)N2CC[C@H](C)N(C(=O)c3ccc(C)cc3F)CC2)COC1
|
C#CCOCC=O)NCC[C@H]C)NC=O)ccccC)cc6F))))))))CC7))))))))))COC4
|
[C][#C][C][Branch2][Ring2][=Branch1][O][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][F][C][C][Ring2][Ring1][C][C][O][C][Ring2][Ring1][#Branch2]
|
N14CCC(C)N5CC1.c18ccc(C)cc1F.C#CC16COC1.C7C4=O.C58=O.O67
|
C[C@@H](O)CC(=O)N[C@H]1CC[C@@H](C(=O)N[C@@]2(CO)CCSC2)C1
|
C[C@@H]O)CC=O)N[C@H]CC[C@@H]C=O)N[C@@]CO))CCSC5)))))))C5
|
[C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C@@][Branch1][Ring1][C][O][C][C][S][C][Ring1][#Branch1][C][Ring1][#C]
|
CC(O)CC3=O.C16CCC7C1.C158CCSC1.C47=O.N36.N45.C8O
|
CC1(C)C[C@]2(CCN(c3nnc(-c4ccncc4)n3Cc3ccccc3)C2)CO1
|
CCC)C[C@]CCNcnnc-cccncc6))))))n5Ccccccc6))))))))))))C5))))CO5
|
[C][C][Branch1][C][C][C][C@][Branch2][Ring2][Branch1][C][C][N][Branch2][Ring1][O][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch1][C][O][Ring2][Ring1][N]
|
CC1(C)CC2(CCN5C2)CO1.c15nnc8n16.c18ccncc1.c17ccccc1.C67
|
CNC(=O)CCC(=O)N[C@H]1CCN(C(=O)CCNC(=O)OC)[C@@H]1c1ccccc1
|
CNC=O)CCC=O)N[C@H]CCNC=O)CCNC=O)OC)))))))[C@@H]5cccccc6
|
[C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][O][C][C@@H1][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C3(=O)CCC4=O.C18CCN5C19.c19ccccc1.C5(=O)CC7.C26=O.CN3.N48.N67.O2C
|
CCCC[C@H](C(=O)N[C@@H]1CC[C@H](CC(=O)N[C@H](C)c2ccnc(F)c2)C1)N(C)C
|
CCCC[C@H]C=O)N[C@@H]CC[C@H]CC=O)N[C@H]C)cccncF)c6))))))))))C5)))))))NC)C
|
[C][C][C][C][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=C][C][=N][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring2][Ring1][C][N][Branch1][C][C][C]
|
CCCCC5C3=O.c19ccnc(F)c1.C17CCC8C1.C8C4=O.C69C.N5(C)C.N37.N46
|
Cc1ccc(O)c(NC(=O)C[C@H]2CCC[C@@H](NC(=O)[C@]3(C)CCCS3)C2)c1
|
CccccO)cNC=O)C[C@H]CCC[C@@H]NC=O)[C@]C)CCCS5)))))))C6)))))))))c6
|
[C][C][=C][C][=C][Branch1][C][O][C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][C@H1][C][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][S][Ring1][=Branch1][C][Ring1][#C][=C][Ring2][Ring1][#Branch2]
|
Cc1ccc(O)c6c1.C19CCCC7C1.C18(C)CCCS1.C4(=O)C9.C58=O.N46.N57
|
Cc1cccc(CCNC(=NCCC(C)C)NC[C@]2(C)CCCC(=O)N2)n1
|
CcccccCCNC=NCCCC)C)))))NC[C@]C)CCCC=O)N6))))))))))))n6
|
[C][C][=C][C][=C][C][Branch2][Ring1][#C][C][C][N][C][=Branch1][=Branch2][=N][C][C][C][Branch1][C][C][C][N][C][C@][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][Ring1][Branch2][=N][Ring2][Ring1][#Branch2]
|
N3C(=NCCC(C)C)N4.C15(C)CCCC(=O)N1.Cc1cccc6n1.C6C3.C45
|
C=CCCO[C@@H](C)C(=O)N[C@H]1[C@@H]2CN(C(=O)c3cccc4c3CCO4)C[C@@H]21
|
C=CCCO[C@@H]C)C=O)N[C@H][C@@H]CNC=O)cccccc6CCO5))))))))))C[C@@H]56
|
[C][=C][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][O][Ring1][Branch1][C][C@@H1][Ring1][S][Ring1][P]
|
c1%10cccc2c1CCO2.C19C2CN6CC12.C8(C)C5=O.C=CCC7.C6%10=O.O78.N59
|
O=C(N[C@H]1CCSC12CN(c1nc(Cl)nc3[nH]c(O)nc13)C2)[C@H]1CC12CC(O)C2
|
O=CN[C@H]CCSC5CNcncCl)nc[nH]cO)nc95)))))))))C4)))))))))[C@H]CC3CCO)C4
|
[O][=C][Branch2][Ring2][Ring2][N][C@H1][C][C][S][C][Ring1][Branch1][C][N][Branch2][Ring1][Ring2][C][=N][C][Branch1][C][Cl][=N][C][NH1][C][Branch1][C][O][=N][C][Ring1][O][=Ring1][=Branch1][C][Ring1][#C][C@H1][C][C][Ring1][Ring1][C][C][Branch1][C][O][C][Ring1][Branch1]
|
c15nc(Cl)nc2[nH]c(O)nc12.C16CCSC12CN5C2.C17CC12CC(O)C2.O=C47.N46
|
CC1(C)C(C)(C)C1(C)C(=O)N1CCCC[C@@H]1C(=O)NCC[C@@H]1CCOC1
|
CCC)CC)C)C3C)C=O)NCCCC[C@@H]6C=O)NCC[C@@H]CCOC5
|
[C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][O][C][Ring1][Branch1]
|
CC1(C)C6(C)C1(C)C.N12CCCCC15.C17CCOC1.C26=O.C35=O.C4C7.N34
|
O=C(N[C@@H]1CCN(C(=O)c2csc(-c3ccco3)n2)[C@H](C2CC2)C1)C1CC=CC1
|
O=CN[C@@H]CCNC=O)ccsc-cccco5)))))n5))))))[C@H]CCC3)))C6)))))))CCC=CC5
|
[O][=C][Branch2][Ring2][=Branch2][N][C@@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][S][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][Ring1][#Branch2][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Branch1][C][C][C][=C][C][Ring1][Branch1]
|
C16CCN5C9C1.c17csc%10n1.c1%10ccco1.C18CC=CC1.O=C48.C57=O.C19CC1.N46
|
C[C@@]12CC3(O)CC(N[C@@H]4CCC[C@@H](C5CC5)C4)(C1)C[C@](C)(C3)C2
|
C[C@@]CCO)CCN[C@@H]CCC[C@@H]CCC3)))C6)))))))C6)C[C@]C)C6)C8
|
[C][C@@][C][C][Branch1][C][O][C][C][Branch1][P][N][C@@H1][C][C][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=Branch2][Branch1][Ring2][C][Ring1][P][C][C@][Branch1][C][C][Branch1][Branch1][C][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch1]
|
CC12CC36CC(C)(C1)CC(O)(C3)C2.C17CCCC(C2CC2)C1.N67
|
CCO[C@H](C(=O)NCCN(C[C@@H](C)O)C(=O)c1cccc2c1OCCC2)C(C)C
|
CCO[C@H]C=O)NCCNC[C@@H]C)O)))C=O)cccccc6OCCC6))))))))))))))))CC)C
|
[C][C][O][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C@@H1][Branch1][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][=Branch1][C][Branch1][C][C][C]
|
c1%10cccc2c1OCCC2.C6(C3=O)C(C)C.C9C(C)O.C7C8.N489.C4%10=O.CC5.O56.N37
|
CC(=O)N[C@H](C)C(=O)NC[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)C[C@@]1(O)CCOC1
|
CC=O)N[C@H]C)C=O)NC[C@@H]C[C@@H]C[C@@H]3N6C=O)C[C@@]O)CCOC5
|
[C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C@@][Branch1][C][O][C][C][O][C][Ring1][=Branch1]
|
C18CC2CC2N15.C19(O)CCOC1.C6(C)C4=O.C5(=O)C9.CC3=O.N36.N47.C78
|
CCCc1ccc(C(=O)NCc2cnn3c2CN(c2ncc(C)c(O)n2)CC3)[nH]1
|
CCCccccC=O)NCccnnc5CNcnccC)cO)n6))))))CC6))))))))))))[nH]5
|
[C][C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][=N][N][C][=Ring1][Branch1][C][N][Branch1][#C][C][=N][C][=C][Branch1][C][C][C][Branch1][C][O][=N][Ring1][Branch2][C][C][Ring1][=C][NH1][Ring2][Ring1][#Branch2]
|
c19cnn2c1CN6CC2.c16ncc(C)c(O)n1.c18ccc7[nH]1.CCC8.C47=O.N45.C59
|
Cn1ccc(C(=O)N[C@H]2C[C@H](CC(=O)N3CCC(CCO)CC3)C2)c1
|
CncccC=O)N[C@H]C[C@H]CC=O)NCCCCCO)))CC6))))))))C4))))))c5
|
[C][N][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][C][O][C][C][Ring1][=Branch2][C][Ring1][S][=C][Ring2][Ring1][Branch2]
|
N15CCC9CC1.Cn1ccc7c1.C16CC8C1.C8C5=O.C47=O.C9CO.N46
|
O=C(N[C@H]1C[C@@H]1C1CCN(C(=O)[C@H]2CCCOC2)CC1)c1ccnc2cc[nH]c12
|
O=CN[C@H]C[C@@H]3CCCNC=O)[C@H]CCCOC6)))))))CC6))))))))))cccnccc[nH]c95
|
[O][=C][Branch2][Ring1][=N][N][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@H1][C][C][C][O][C][Ring1][=Branch1][C][C][Ring1][=C][C][=C][C][=N][C][C][=C][NH1][C][Ring1][=Branch2][=Ring1][Branch1]
|
C15CC1C1CCN4CC1.c17ccnc2cc[nH]c12.C16CCCOC1.O=C37.C46=O.N35
|
Cc1nc(CCCC(=O)N2CCN(C(=O)C3CCC4(CC3)CC4)[C@@H]3CC[C@@H]32)cs1
|
CcncCCCC=O)NCCNC=O)CCCCCC6))CC3)))))))[C@@H]CC[C@@H]48))))))))))))cs5
|
[C][C][=N][C][Branch2][Ring2][#Branch2][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch1][C@@H1][C][C][C@@H1][Ring1][Ring2][Ring2][Ring1][C][=C][S][Ring2][Ring1][N]
|
N15CCN6C2CCC21.C17CCC2(CC1)CC2.Cc1nc8cs1.C8CCC5=O.C67=O
|
CC(=O)NCc1cn(Cc2ccc(C(=O)N(C)CC(F)(F)C[C@@H](O)CO)o2)nn1
|
CC=O)NCccnCccccC=O)NC)CCF)F)C[C@@H]O)CO))))))))o5))))))nn5
|
[C][C][=Branch1][C][=O][N][C][C][=C][N][Branch2][Ring2][Ring2][C][C][=C][C][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C@@H1][Branch1][C][O][C][O][O][Ring2][Ring1][C][N][=N][Ring2][Ring1][Branch2]
|
C6C(F)(F)CC(O)CO.c19cn8nn1.c1%10ccc7o1.CC3=O.C47=O.N46C.N35.C59.C8%10
|
Cc1cc(CC(=O)N2C[C@H](C)[C@H](NC(=O)C3=CCCC3)C2)cc(C)c1Br
|
CcccCC=O)NC[C@H]C)[C@H]NC=O)C=CCCC5)))))))C5)))))))ccC)c6Br
|
[C][C][=C][C][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Branch1][C][Ring1][=C][=C][C][Branch1][C][C][=C][Ring2][Ring1][Branch2][Br]
|
Cc1cc7cc(C)c1Br.N14CC6C(C)C1.C5(=O)C1=CCCC1.C7C4=O.N56
|
CC(=O)[C@@H]1C[C@H](CC(=O)N2[C@H]3CC[C@H]2CN(C(=O)C2CC2)C3)C1(C)C
|
CC=O)[C@@H]C[C@H]CC=O)N[C@H]CC[C@H]5CNC=O)CCC3))))C7))))))))))C4C)C
|
[C][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch2][Ring1][=N][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][Ring1][N][C][Ring2][Ring1][Ring2][Branch1][C][C][C]
|
N14C2CCC1CN5C2.C16CC8C1(C)C.C8C4=O.CC6=O.C57=O.C17CC1
|
C[C@@H]1C[C@@H]1C(=O)N[C@H](C)C1(C(=O)N2CC(CO)(CO)C2)CC1
|
C[C@@H]C[C@@H]3C=O)N[C@H]C)CC=O)NCCCO))CO))C4)))))CC3
|
[C][C@@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][O][Branch1][Ring1][C][O][C][Ring1][Branch2][C][C][Ring1][=N]
|
N14CC9%10C1.CC1CC16.C178CC1.C36=O.C58C.C47=O.N35.C9O.C%10O
|
C[C@@H](C(=O)O)n1cc(C[C@H](O)C(=O)NCCn2cncn2)nn1
|
C[C@@H]C=O)O))nccC[C@H]O)C=O)NCCncncn5)))))))))))nn5
|
[C][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][=C][Branch2][Ring1][Ring2][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][N][C][=N][C][=N][Ring1][Branch1][N][=N][Ring2][Ring1][C]
|
n15cc7nn1.C7C(O)C3=O.CC5C(=O)O.n16cncn1.C4C6.N34
|
Cc1c(C(=O)N2CC(C[C@@H](C)NC(=O)[C@H]3COc4ccc(Cl)cc43)C2)ncn1C
|
CccC=O)NCCC[C@@H]C)NC=O)[C@H]COccccCl)cc69)))))))))))))C4)))))ncn5C
|
[C][C][=C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Ring1][#Branch2][C][Ring2][Ring1][Ring2][N][=C][N][Ring2][Ring1][O][C]
|
C6(=O)C1COc2ccc(Cl)cc21.Cc1c8ncn1C.N15CC9C1.C9C7C.C58=O.N67
|
CCc1cccc(C(=O)N[C@@]23CCC[C@@H](CN(C(=O)C(C)=C4CCCC4)C2)C3)n1
|
CCcccccC=O)N[C@@]CCC[C@@H]CNC=O)CC)=CCCCC5)))))))C8)))C6))))))))n6
|
[C][C][C][=C][C][=C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C@@][C][C][C][C@@H1][Branch2][Ring1][#Branch1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][C][=C][C][C][C][C][Ring1][Branch1][C][Ring1][P][C][Ring2][Ring1][C][=N][Ring2][Ring1][O]
|
C127CCCC(CN6C1)C2.c1%10cccc8n1.C6(=O)C=9C.C1=9CCCC1.C58=O.CC%10.N57
|
COCC1(NC(=O)COC2(C)CCC2)CN(C(=O)[C@H](C)c2nc(C)cs2)C1
|
COCCNC=O)COCC)CCC4))))))))CNC=O)[C@H]C)cncC)cs5)))))))C4
|
[C][O][C][C][Branch1][P][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][Ring1][Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=N][C][Branch1][C][C][=C][S][Ring1][=Branch1][C][Ring2][Ring1][Branch2]
|
C18%10CN4C1.c19nc(C)cs1.C17(C)CCC1.C4(=O)C9C.C3(=O)C6.CO5.C5%10.N38.O67
|
CCOC(=O)CCCNC(=O)[C@H]([C@@H](C)C1CCC1)N1CCCCCC1(C)C
|
CCOC=O)CCCNC=O)[C@H][C@@H]C)CCCC4)))))NCCCCCC7C)C
|
[C][C][O][C][=Branch1][C][=O][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][O][C@@H1][Branch1][C][C][C][C][C][C][Ring1][Ring2][N][C][C][C][C][C][C][Ring1][#Branch1][Branch1][C][C][C]
|
N16CCCCCC1(C)C.C3(=O)C6C7C.C2(=O)CCC5.C17CCC1.CC4.O24.N35
|
COC1(C(=O)N2CCC[C@@](C)(CNC(=O)C(=O)NC3CC3)C2)CCC(C)CC1
|
COCC=O)NCCC[C@@]C)CNC=O)C=O)NCCC3))))))))C6)))))))CCCC)CC6
|
[C][O][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][Ring1][P][C][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch2]
|
C17%10CCC(C)CC1.N14CCCC%11(C)C1.C5(=O)C6=O.C4%10=O.C19CC1.CO7.C8%11.N58.N69
|
CC1=CCCN(c2nc3c(c(=NCCO[C@H]4CCOC4)[nH]2)CSC3)C1
|
CC=CCCNcnccc=NCCO[C@H]CCOC5)))))))))[nH]6))CSC5)))))))C6
|
[C][C][=C][C][C][N][Branch2][Ring1][=C][C][=N][C][=C][Branch2][Ring1][C][C][=Branch1][N][=N][C][C][O][C@H1][C][C][O][C][Ring1][Branch1][NH1][Ring1][#C][C][S][C][Ring1][S][C][Ring2][Ring1][Branch2]
|
c17nc2c(c(=NCC5)[nH]1)CSC2.CC1=CCCN7C1.C16CCOC1.O56
|
CCCOc1ccc(C(=O)N(C)[C@@H]2CCCCN(C(=O)C=CCF)C2)cc1
|
CCCOccccC=O)NC)[C@@H]CCCCNC=O)C=CCF)))))C7)))))))))cc6
|
[C][C][C][O][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C][C][N][Branch1][=Branch2][C][=Branch1][C][=O][C][=C][C][F][C][Ring1][=N][C][=C][Ring2][Ring1][#Branch1]
|
C17CCCCN4C1.c16ccc8cc1.C4(=O)C=9.CCC5.C38=O.N37C.C=9CF.O56
|
Cc1ccnnc1C(=O)NCCOCCOCc1cn(Cc2ccccn2)nn1
|
Ccccnnc6C=O)NCCOCCOCccnCcccccn6)))))))nn5
|
[C][C][=C][C][=N][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][O][C][C][O][C][C][=C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][N][=N][Ring1][N]
|
Cc1ccnnc1%10.c1%12cn%11nn1.c14ccccn1.C3%10=O.C9C5.C6C7.N39.O56.O78.C8%12.C%114
|
CC(=O)CCCC(=O)N1CC[C@H]1C(=O)NCCCc1ccco1
|
CC=O)CCCC=O)NCC[C@H]4C=O)NCCCcccco5
|
[C][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C][=C][C][=C][O][Ring1][Branch1]
|
CC(=O)CCCC2=O.N12CCC15.c16ccco1.C4CC6.C35=O.N34
|
CNC(=O)[C@@H](C)CN(C)C(=O)C1(C2CC2)CN(C(=O)C2=CCOCC2)C1
|
CNC=O)[C@@H]C)CNC)C=O)CCCC3)))CNC=O)C=CCOCC6)))))))C4
|
[C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][O][C][C][Ring1][=Branch1][C][Ring1][#C]
|
C17(C2CC2)CN5C1.C5(=O)C1=CCOCC1.C3(=O)C(C)C6.N46C.C47=O.CN3
|
CC[C@H](NC(=O)[C@]1(C)CCCN1C(=O)[C@H]1COCC[C@@H]1C)C(N)=O
|
CC[C@H]NC=O)[C@]C)CCCN5C=O)[C@H]COCC[C@@H]6C)))))))))))))))CN)=O
|
[C][C][C@H1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][O][C][C][C@@H1][Ring1][=Branch1][C][C][Branch1][C][N][=O]
|
C15(C)CCCN13.C16COCCC1C.CCC4C(N)=O.C25=O.C36=O.N24
|
C=CCCC(=O)N[C@H](C)CCN(C)C(=O)CCc1ccco1
|
C=CCCC=O)N[C@H]C)CCNC)C=O)CCcccco5
|
[C][=C][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][O][Ring1][Branch1]
|
C=CCCC2=O.C4(C)CC5.C3(=O)CC6.c16ccco1.N35C.N24
|