SMILES
stringlengths 6
120
| Deep SMILES
stringlengths 6
124
| SELFIES
stringlengths 18
409
| SAFE
stringlengths 9
126
|
|---|---|---|---|
Cc1cccc(C2(C(=O)N3C[C@@H](NC(=O)C(N)=O)CC4(CC4)C3)CC2)c1
|
CcccccCC=O)NC[C@@H]NC=O)CN)=O))))CCCC3))C6)))))))CC3)))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Branch2][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][O][N][C][=Branch1][C][=O][C][Branch1][C][N][=O][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=C][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][=Branch2]
|
N15CC7CC2(CC2)C1.Cc1cccc9c1.C6(=O)C(N)=O.C189CC1.C58=O.N67
|
CCC[C@@H](OCC)C(=O)NC[C@H](CC(F)(F)F)NC(=O)[C@H](C)Cc1cccnc1
|
CCC[C@@H]OCC)))C=O)NC[C@H]CCF)F)F)))NC=O)[C@H]C)Cccccnc6
|
[C][C][C][C@@H1][Branch1][Ring2][O][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
C6C7CC(F)(F)F.CCCC4C2=O.C3(=O)C(C)C8.c18cccnc1.O45.C5C.N26.N37
|
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2cccc3[nH]cc(Cl)c23)C1
|
Cccc[nH]c5C=O)NC[C@H]CCNC=O)ccccc[nH]ccCl)c95))))))))))C5
|
[C][C][C][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][NH1][C][=C][Branch1][C][Cl][C][Ring1][#Branch2][=Ring1][=Branch1][C][Ring1][P]
|
c18cccc2[nH]cc(Cl)c12.Cc1cc[nH]c17.C19CCN5C1.C47=O.C58=O.N46.C69
|
COCCC1(NC(=O)c2nc(O)sc2C)CCN(C(=O)c2cnc(Cl)s2)CC1
|
COCCCNC=O)cncO)sc5C))))))))CCNC=O)ccncCl)s5))))))CC6
|
[C][O][C][C][C][Branch1][P][N][C][=Branch1][C][=O][C][N][=C][Branch1][C][O][S][C][=Ring1][=Branch1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Cl][S][Ring1][=Branch1][C][C][Ring2][Ring1][Branch2]
|
C169CCN4CC1.c17nc(O)sc1C.c18cnc(Cl)s1.C5C9.C37=O.C48=O.CO5.N36
|
CC(C)(C)OC(=O)[C@@H]1CCCC[C@H]1C(=O)OCC(=O)NCCCc1ccccc1
|
CCC)C)OC=O)[C@@H]CCCC[C@H]6C=O)OCC=O)NCCCcccccc6
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C18CCCCC19.c1%10ccccc1.CC5(C)C.C6C4=O.C7CC%10.C28=O.C39=O.O25.O36.N47
|
CC(=O)N1CCCC[C@@H]1C(=O)N[C@@](C)(CNC(=O)c1cnc(C)s1)C1CC1
|
CC=O)NCCCC[C@@H]6C=O)N[C@@]C)CNC=O)ccncC)s5))))))))CCC3
|
[C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@][Branch1][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][S][Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
N12CCCCC17.c18cnc(C)s1.C59(C)C6.CC2=O.C37=O.C48=O.C19CC1.N35.N46
|
C[C@H]1C[C@@H](CCNC(=O)C#CC2(C)CC2)CCN1C(=O)Cc1ccc(Cl)nc1
|
C[C@H]C[C@@H]CCNC=O)C#CCC)CC3)))))))))CCN6C=O)CccccCl)nc6
|
[C][C@H1][C][C@@H1][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][C][C][Ring1][Ring2][C][C][N][Ring1][P][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1]
|
CC1CC6CCN14.C3(=O)C#CC1(C)CC1.c17ccc(Cl)nc1.C4(=O)C7.C6C5.N35
|
CCCn1cc(C(=O)N2CC[C@](CNC(=O)c3cnccn3)(COC)C2)nn1
|
CCCnccC=O)NCC[C@]CNC=O)ccnccn6)))))))))COC)))C5))))))nn5
|
[C][C][C][N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1][Branch1][Ring2][C][O][C][C][Ring2][Ring1][C][N][=N][Ring2][Ring1][=Branch2]
|
N14CCC%11%12C1.n1%10cc8nn1.c19cnccn1.CCC%10.C48=O.C59=O.C7%11.N57.C6%12.O6C
|
COc1ccc2cnc(N3CCC34CCN(C(=O)c3conc3C)CC4)nc2c1
|
COcccccncNCCC4CCNC=O)cconc5C)))))))CC6)))))))))nc6c%10
|
[C][O][C][=C][C][=C][C][=N][C][Branch2][Ring1][N][N][C][C][C][Ring1][Ring2][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][O][N][=C][Ring1][Branch1][C][C][C][Ring1][=C][=N][C][Ring2][Ring1][#Branch1][=C][Ring2][Ring1][O]
|
c16ccc2cnc7nc2c1.N17CCC12CCN5CC2.c18conc1C.C58=O.CO6
|
C[C@H](Cc1cnn(C)c1)C(=O)N[C@@](C)(CO)CNC(=O)C=Cc1nccs1
|
C[C@H]CccnnC)c5))))))C=O)N[C@@]C)CO))CNC=O)C=Ccnccs5
|
[C][C@H1][Branch1][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C@@][Branch1][C][C][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][S][Ring1][Branch1]
|
CC(C7)C2=O.c17cnn(C)c1.C4(C)(C5)CO.C=6c1nccs1.C3(=O)C=6.N24.N35
|
Cc1cc(CC(=O)N2CC[C@H](NC(=O)c3ncccc3O)C2)cc(O)n1
|
CcccCC=O)NCC[C@H]NC=O)cncccc6O)))))))))C5)))))))ccO)n6
|
[C][C][=C][C][Branch2][Ring1][=N][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][#C][=C][C][Branch1][C][O][=N][Ring2][Ring1][=Branch2]
|
Cc1cc8cc(O)n1.c17ncccc1O.N14CCC6C1.C8C4=O.C57=O.N56
|
COc1nccc(C(=O)N2CCO[C@@H](CNC(=O)c3cccc(I)c3C)C2)c1Cl
|
COcncccC=O)NCCO[C@@H]CNC=O)cccccI)c6C))))))))))C6)))))))c6Cl
|
[C][O][C][=N][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][I][=C][Ring1][#Branch1][C][C][Ring2][Ring1][C][=C][Ring2][Ring1][#Branch2][Cl]
|
c16nccc8c1Cl.c19cccc(I)c1C.N14CCOC%10C1.C48=O.C59=O.CO6.C7%10.N57
|
C[C@H]1CCCC[C@@]1(C)C(=O)NCC1(O)CCN(C(=O)C(C)(C)C(F)F)CC1
|
C[C@H]CCCC[C@@]6C)C=O)NCCO)CCNC=O)CC)C)CF)F))))CC6
|
[C][C@H1][C][C][C][C][C@@][Ring1][=Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][F][C][C][Ring1][#C]
|
CC1CCCCC15C.C16(O)CCN3CC1.C3(=O)C(C)(C)C(F)F.C25=O.N24.C46
|
CCc1ccsc1C(=O)N1CC(C)(NC(=O)C2CC3(C2)[C@@H](C(=O)OC)C3(F)F)C1
|
CCcccsc5C=O)NCCC)NC=O)CCCC4)[C@@H]C=O)OC)))C3F)F))))))))C4
|
[C][C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C@@H1][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Ring1][Branch2][Branch1][C][F][F][C][Ring2][Ring1][Ring2]
|
C19CC2(C1)C%10C2(F)F.c1%11ccsc18.N15CC7(C)C1.C58=O.C69=O.C4%10=O.CC%11.N67.O4C
|
C[C@@H](C(=O)N1CCC([C@@H](O)c2cn(C)c(=O)n(C)c2=O)CC1)c1ccc(F)cc1
|
C[C@@H]C=O)NCCC[C@@H]O)ccnC)c=O)nC)c6=O))))))))CC6)))))))ccccF)cc6
|
[C][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C@@H1][Branch1][C][O][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][=Branch2][=O][C][C][Ring2][Ring1][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
c16cn(C)c(=O)n(C)c1=O.N13CCC4CC1.c15ccc(F)cc1.CC5C3=O.C46O
|
CCCC[C@H](NC(=O)c1cn(C2CC2)nn1)C(=O)NCCCN(C)C
|
CCCC[C@H]NC=O)ccnCCC3)))nn5)))))))C=O)NCCCNC)C
|
[C][C][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][=N][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C]
|
CCCCC5C4=O.c18cn9nn1.C6CC7.C38=O.C19CC1.N7(C)C.N35.N46
|
CC(C)[C@@H](N[C@H](C)c1cccc(CN(C)C)c1)c1ccc(Cl)cc1F
|
CCC)[C@@H]N[C@H]C)cccccCNC)C)))c6))))))))ccccCl)cc6F
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring1][=Branch1][N][C@H1][Branch1][C][C][C][=C][C][=C][C][Branch1][#Branch1][C][N][Branch1][C][C][C][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][F]
|
c15ccc(Cl)cc1F.c16cccc7c1.CC(C)C25.C36C.N4(C)C.N23.C47
|
COCCNC(=O)c1cn(C[C@@H]2CN(C(=O)[C@H](C)C(F)F)CCO2)nn1
|
COCCNC=O)ccnC[C@@H]CNC=O)[C@H]C)CF)F))))CCO6)))))))nn5
|
[C][O][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch2][Ring1][=Branch2][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][F][F][C][C][O][Ring1][=N][N][=N][Ring2][Ring1][Ring1]
|
C19CN4CCO1.C4(=O)C(C)C(F)F.c17cn8nn1.C5C6.C37=O.CO5.N36.C89
|
C[C@@]1(C(=O)NC[C@H]2CCC[C@@H]2C(=O)NCc2cccc(O)n2)C[C@@H]2C[C@@H]2C1
|
C[C@@]C=O)NC[C@H]CCC[C@@H]5C=O)NCcccccO)n6)))))))))))))))))C[C@@H]C[C@@H]3C6
|
[C][C@@][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][C][O][=N][Ring1][#Branch1][C][C@@H1][C][C@@H1][Ring1][Ring1][C][Ring2][Ring1][#Branch2]
|
CC17CC2CC2C1.c19cccc(O)n1.C1%10CCCC18.C37=O.C48=O.N35.C5%10.N46.C69
|
C[C@H]1C[C@@H](Nc2ccc(C#N)nc2)CCN1C(=O)c1ncnc2sccc12
|
C[C@H]C[C@@H]NccccC#N))nc6)))))))CCN6C=O)cncncsccc95
|
[C][C@H1][C][C@@H1][Branch1][=C][N][C][=C][C][=C][Branch1][Ring1][C][#N][N][=C][Ring1][Branch2][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][=N][C][=N][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
c16ncnc2sccc12.CC1CC5CCN13.c14ccc(C#N)nc1.C36=O.N45
|
CCCCCN(C)C(=O)[C@@H](F)C1CC(NC(=O)C(C)(C)[C@@H](O)CC)C1
|
CCCCCNC)C=O)[C@@H]F)CCCNC=O)CC)C)[C@@H]O)CC))))))C4
|
[C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][C][O][C][C][C][Ring1][=C]
|
C3(=O)C(C)(C)C(O)CC.CCCCC4.C2(=O)C6F.C16CC5C1.N24C.N35
|
CCn1ccc([C@@H](C(=O)NCCCF)N2C[C@H](C)[S@@](=O)[C@H](C)C2)n1
|
CCnccc[C@@H]C=O)NCCCF))))))NC[C@H]C)[S@@]=O)[C@H]C)C6)))))))n5
|
[C][C][N][C][=C][C][Branch2][Ring1][=C][C@@H1][Branch1][#Branch2][C][=Branch1][C][=O][N][C][C][C][F][N][C][C@H1][Branch1][C][C][S@@][=Branch1][C][=O][C@H1][Branch1][C][C][C][Ring1][=Branch2][=N][Ring2][Ring1][=Branch1]
|
N14CC(C)S(=O)C(C)C1.n16ccc7n1.C47C3=O.C5CCF.CC6.N35
|
C[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1C[C@H]1NC(=O)c1[nH]c2ccc(F)cc2c1Cl
|
C[C@@H]CC=CC[C@H]6C=O)N[C@@H]C[C@H]3NC=O)c[nH]ccccF)cc6c9Cl
|
[C][C@@H1][C][C][=C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][Cl]
|
c17[nH]c2ccc(F)cc2c1Cl.CC1CC=CCC18.C15CC16.C38=O.C47=O.N35.N46
|
CCOC1(CC(=O)N2CC[C@@H](CNC(=O)C34CCC(CC3)CC4)C2)CCC1
|
CCOCCC=O)NCC[C@@H]CNC=O)CCCCCC6))CC6)))))))))C5)))))))CCC4
|
[C][C][O][C][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch2][C][Ring1][P][C][C][C][Ring2][Ring1][Branch2]
|
C12%10CCC(CC1)CC2.N15CCC%12C1.C18%11CCC1.C%11C5=O.C6%10=O.CC7.O78.C9%12.N69
|
Cc1cnnc(O)c1C(=O)N1CCC[C@H](C(=O)N2CC=C(C(C)(C)C)CC2)CC1
|
CccnncO)c6C=O)NCCC[C@H]C=O)NCC=CCC)C)C))CC6)))))))CC7
|
[C][C][=C][N][=N][C][Branch1][C][O][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring1]
|
N14CC=C(C(C)(C)C)CC1.Cc1cnnc(O)c16.N13CCCC5CC1.C36=O.C45=O
|
CC[C@H](C)[C@H](O)C(=O)N[C@H]1CCN(C(=O)c2cc(C3CCCC3)[nH]n2)C[C@@H]1F
|
CC[C@H]C)[C@H]O)C=O)N[C@H]CCNC=O)cccCCCCC5)))))[nH]n5))))))C[C@@H]6F
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][NH1][N][=Ring1][#Branch2][C][C@@H1][Ring2][Ring1][C][F]
|
CCC(C)C(O)C4=O.C16CCN5CC1F.c17cc8[nH]n1.C18CCCC1.C57=O.N46
|
CCN1CCN(S(=O)(=O)c2ccc(C#N)c(N[C@H]3CCC[C@@H]3C#N)c2)CC1(C)C
|
CCNCCNS=O)=O)ccccC#N))cN[C@H]CCC[C@@H]5C#N))))))))c6)))))))CC6C)C
|
[C][C][N][C][C][N][Branch2][Ring1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][O][N][C@H1][C][C][C][C@@H1][Ring1][Branch1][C][#N][=C][Ring1][S][C][C][Ring2][Ring1][=Branch2][Branch1][C][C][C]
|
S5(=O)(=O)c1ccc(C#N)c6c1.N14CCN5CC1(C)C.C17CCCC1C#N.CC4.N67
|
CCCN(CCN=C(NC1CCC1)N1CCCC1)C(C)C
|
CCCNCCN=CNCCCC4)))))NCCCC5)))))))))CC)C
|
[C][C][C][N][Branch2][Ring1][Branch1][C][C][N][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Ring2][N][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][C]
|
C3CN=C(N5)N1CCCC1.C15CCC1.CCC2.N234.C4(C)C
|
C[C@H](C1CC1)[C@@H](C(=O)NC1COC1)N1CCCO[C@@H](c2ccccc2Cl)C1
|
C[C@H]CCC3)))[C@@H]C=O)NCCOC4))))))NCCCO[C@@H]cccccc6Cl)))))))C7
|
[C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][O][C][Ring1][Ring2][N][C][C][C][O][C@@H1][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Ring1][=C]
|
N14CCCOC7C1.CC6C4C3=O.c17ccccc1Cl.C15COC1.C16CC1.N35
|
C=C[C@H](CCC)CC(=O)N1C[C@H]2C[C@@H](C(=O)N3[C@@H](C)C[C@@H]3CO)C[C@H]2C1
|
C=C[C@H]CCC)))CC=O)NC[C@H]C[C@@H]C=O)N[C@@H]C)C[C@@H]4CO)))))))C[C@H]5C8
|
[C][=C][C@H1][Branch1][Ring2][C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C@@H1][Ring1][Branch1][C][O][C][C@H1][Ring1][=C][C][Ring1][P]
|
C=CC(CCC)CC4=O.N14CC2CC6CC2C1.N15C7CC1C.C56=O.C7O
|
COC(=O)[C@@H](CN1CCc2ccccc21)N[C@H](C)c1cccc(Cl)c1F
|
COC=O)[C@@H]CNCCcccccc69))))))))))N[C@H]C)cccccCl)c6F
|
[C][O][C][=Branch1][C][=O][C@@H1][Branch1][#C][C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][N][C@H1][Branch1][C][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F]
|
N15CCc2ccccc21.c17cccc(Cl)c1F.C3(=O)C4C5.C67C.CO3.N46
|
CC(C)c1ccc(O)cc1C(=O)N[C@H]1C[C@H](F)CN(C(=O)c2nccnc2N)C1
|
CCC)ccccO)cc6C=O)N[C@H]C[C@H]F)CNC=O)cnccnc6N))))))))C6
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][C][F][C][N][Branch1][=C][C][=Branch1][C][=O][C][=N][C][=C][N][=C][Ring1][=Branch1][N][C][Ring1][S]
|
c18ccc(O)cc17.C15CC(F)CN4C1.c16nccnc1N.CC8C.C37=O.C46=O.N35
|
N=c1nc(C(=O)NCCC2(C(=O)NCCc3nccs3)CCCC2)cc[nH]1
|
N=cncC=O)NCCCC=O)NCCcnccs5)))))))))CCCC5)))))))))cc[nH]6
|
[N][=C][N][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][Branch1][#C][C][=Branch1][C][=O][N][C][C][C][=N][C][=C][S][Ring1][Branch1][C][C][C][C][Ring1][#C][C][=C][NH1][Ring2][Ring1][#Branch2]
|
N=c1nc8cc[nH]1.C19%11CCCC1.c1%10nccs1.C48=O.C6C%11.C59=O.C7C%10.N46.N57
|
CCc1ccc(C(=O)N(CCN(C)C(=O)c2cc(C)nnc2O)C(C)C)nc1
|
CCccccC=O)NCCNC)C=O)cccC)nnc6O)))))))))))CC)C))))nc6
|
[C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][N][=C][Ring1][#Branch1][O][C][Branch1][C][C][C][N][=C][Ring2][Ring1][#Branch2]
|
c19cc(C)nnc1O.c1%10ccc8nc1.C38=O.N357.C5C6.N46C.C49=O.C7(C)C.CC%10
|
C[C@H](CCNC(=O)C1(C)CSC1)NC(=O)Cc1ccc([S@@](C)=O)cc1
|
C[C@H]CCNC=O)CC)CSC4))))))))NC=O)Ccccc[S@@]C)=O))cc6
|
[C][C@H1][Branch1][P][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][S][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][=Branch1][S@@][Branch1][C][C][=O][C][=C][Ring1][=Branch2]
|
c17ccc(S(C)=O)cc1.CC4CC5.C16(C)CSC1.C3(=O)C7.C26=O.N25.N34
|
C[C@H](NC(=O)C1(Cl)CC1)[C@@H](CO)NC(=O)COCc1cccnc1
|
C[C@H]NC=O)CCl)CC3)))))[C@@H]CO))NC=O)COCccccnc6
|
[C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][Cl][C][C][Ring1][Ring2][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][O][C][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
CC6C7CO.c19cccnc1.C18(Cl)CC1.C3(=O)C4.C28=O.N26.N37.O45.C59
|
CC#CCCCC(=O)N(C)C/C=C/C(=O)NCc1nc(C)cc(C)n1
|
CC#CCCCC=O)NC)C/C=C/C=O)NCcncC)ccC)n6
|
[C][C][#C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][/C][=C][/C][=Branch1][C][=O][N][C][C][=N][C][Branch1][C][C][=C][C][Branch1][C][C][=N][Ring1][Branch2]
|
CC#CCCCC2=O.c17nc(C)cc(C)n1.C=6C3=O.N24C.C4C=6.N35.C57
|
C[C@@H]1C[C@@H](NC(=O)c2ccco2)CN1C(=O)C=CC(=O)c1cnn(C)c1
|
C[C@@H]C[C@@H]NC=O)cccco5)))))))CN5C=O)C=CC=O)ccnnC)c5
|
[C][C@@H1][C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][N][Ring1][=N][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
CC1CC5CN14.c17cnn(C)c1.c16ccco1.C4(=O)C=8.C=8C7=O.C36=O.N35
|
O=C(C=Cc1cc[nH]n1)NC[C@H](CC(F)(F)F)NC(=O)[C@@H](O)CC1CCCCC1
|
O=CC=Cccc[nH]n5)))))))NC[C@H]CCF)F)F)))NC=O)[C@@H]O)CCCCCCC6
|
[O][=C][Branch1][#Branch2][C][=C][C][C][=C][NH1][N][=Ring1][Branch1][N][C][C@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][C][C][C][C][Ring1][=Branch1]
|
C4C5CC(F)(F)F.C=6c1cc[nH]n1.C3(=O)C(O)C7.C17CCCCC1.O=C2C=6.N24.N35
|
CCNC(=O)CCNC(=O)[C@@]1(F)CCCN(C(=O)CC(Cl)Cl)C1
|
CCNC=O)CCNC=O)[C@@]F)CCCNC=O)CCCl)Cl))))C6
|
[C][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][Branch1][C][Cl][Cl][C][Ring1][=N]
|
C17(F)CCCN4C1.C4(=O)CC(Cl)Cl.C2(=O)CC6.C37=O.CC5.N25.N36
|
CC(C)C(=O)N[C@@H]1COC[C@H]1CNC(=O)C(=O)c1cc(S(N)(=O)=O)cn1C
|
CCC)C=O)N[C@@H]COC[C@H]5CNC=O)C=O)cccSN)=O)=O))cn5C
|
[C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][O][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][N][Ring1][=Branch2][C]
|
c16cc(S(N)(=O)=O)cn1C.C15COCC17.CC(C)C2=O.C3(=O)C6=O.N25.C47.N34
|
CC(C)Oc1cccc(CNC(=O)c2sccc2NCc2cc(F)ccc2Cl)c1
|
CCC)OcccccCNC=O)csccc5NCcccF)ccc6Cl)))))))))))))))))c6
|
[C][C][Branch1][C][C][O][C][=C][C][=C][C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][N][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Cl][=C][Ring2][Ring1][=Branch2]
|
c1%11cc(F)ccc1Cl.c15cccc%10c1.c19sccc18.CC4C.C39=O.O45.C6%10.N36.N78.C7%11
|
C=CCCCCCC(=O)N1CC[C@]2(CO)CN(C(=O)CCC=C(C)C)C[C@@H]2C1
|
C=CCCCCCC=O)NCC[C@]CO))CNC=O)CCC=CC)C))))))C[C@@H]5C9
|
[C][=C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][Ring1][C][O][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][Branch1][C][C][C][C][C@@H1][Ring1][#C][C][Ring2][Ring1][Ring1]
|
N13CCC26CN4CC2C1.C=CCCCCCC3=O.C4(=O)CCC=5.C=5(C)C.C6O
|
CC[C@@]1(C(=O)N2CCC(NC(=O)c3cccc(SC)c3[N+](=O)[O-])CC2)CC1(F)F
|
CC[C@@]C=O)NCCCNC=O)cccccSC))c6[N+]=O)[O-]))))))))))CC6)))))))CC3F)F
|
[C][C][C@@][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][Ring1][S][C][=C][Ring1][Branch2][N+1][=Branch1][C][=O][O-1][C][C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][=Branch2][Branch1][C][F][F]
|
c18cccc%10c1[N+](=O)[O-].N14CCC6CC1.C179CC1(F)F.C47=O.C58=O.CC9.N56.S%10C
|
CCCCC[C@@H](O)C(=O)NC1C(C)(C)CN(C(=O)[C@H]2CCCOC2)CC1(C)C
|
CCCCC[C@@H]O)C=O)NCCC)C)CNC=O)[C@H]CCCOC6)))))))CC6C)C
|
[C][C][C][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@H1][C][C][C][O][C][Ring1][=Branch1][C][C][Ring1][S][Branch1][C][C][C]
|
C15C(C)(C)CN4CC1(C)C.CCCCCC(O)C3=O.C16CCCOC1.C46=O.N35
|
COCc1ncc(C(=O)NC2(CNC(=O)CNC(=O)C3CCCCC3)CCC2)s1
|
COCcnccC=O)NCCNC=O)CNC=O)CCCCCC6))))))))))))CCC4))))))s5
|
[C][O][C][C][=N][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][=Branch1][C][C][C][Ring2][Ring1][C][S][Ring2][Ring1][#Branch2]
|
c15ncc%13s1.C1%14CCCCC1.C1%106CCC1.C7(=O)C%12.C4%13=O.C8%14=O.CO9.C95.N4%10.C%116.N7%11.N8%12
|
O=C(NNc1c(Cl)cccc1Br)N[C@H]1C[C@@H](O)C12CCOCC2
|
O=CNNccCl)cccc6Br)))))))))N[C@H]C[C@@H]O)C4CCOCC6
|
[O][=C][Branch1][#C][N][N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Br][N][C@H1][C][C@@H1][Branch1][C][O][C][Ring1][Branch1][C][C][O][C][C][Ring1][=Branch1]
|
O=C3NNc1c(Cl)cccc1Br.C14CC(O)C12CCOCC2.N34
|
C=CCC1(C(=O)N2C[C@H](NC(=O)[C@@H](C)n3ccnc3)CC3(CCC3)C2)CC=CC1
|
C=CCCC=O)NC[C@H]NC=O)[C@@H]C)nccnc5))))))))CCCCC4)))C6)))))))CC=CC5
|
[C][=C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][=C][N][=C][Ring1][Branch1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Ring1][C][C][=C][C][Ring2][Ring1][#Branch2]
|
N14CC6CC2(CCC2)C1.C179CC=CC1.C5(=O)C8C.n18ccnc1.C=CC9.C47=O.N56
|
O=C(NCC1[C@@H]2CN(C(=O)c3cc(-c4ccco4)on3)C[C@@H]12)C(F)=CC1CC1
|
O=CNCC[C@@H]CNC=O)ccc-cccco5)))))on5))))))C[C@@H]65))))))))CF)=CCCC3
|
[O][=C][Branch2][Ring2][Branch1][N][C][C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][O][N][=Ring1][#Branch2][C][C@@H1][Ring2][Ring1][C][Ring1][P][C][Branch1][C][F][=C][C][C][C][Ring1][Ring1]
|
C1%10C2CN6CC12.c18cc%11on1.O=C5C=9F.c1%11ccco1.C=9C1CC1.C68=O.N57.C7%10
|
O=C(c1coc2c1[C@@H](O)CCC2)N1CC2(CCN(C(=O)[C@@H]3C[C@H]4CC[C@H]3C4)C2)C1
|
O=Cccocc5[C@@H]O)CCC6)))))))))NCCCCNC=O)[C@@H]C[C@H]CC[C@H]6C5))))))))C5))))C4
|
[O][=C][Branch1][P][C][=C][O][C][=C][Ring1][Branch1][C@@H1][Branch1][C][O][C][C][C][Ring1][#Branch1][N][C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C@H1][C][C][C@H1][Ring1][=Branch1][C][Ring1][Branch1][C][Ring1][=C][C][Ring1][P]
|
c18coc2c1C(O)CCC2.N15CC2(CCN6C2)C1.C17CC2CCC1C2.O=C58.C67=O
|
C[C@@H](C(=O)N(C)C[C@@H]1CCCN1C(=O)[C@H]1CCCCNC1=O)N(C)CC(F)(F)F
|
C[C@@H]C=O)NC)C[C@@H]CCCN5C=O)[C@H]CCCCNC7=O)))))))))))))))))NC)CCF)F)F
|
[C][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][C][C][N][C][Ring1][#Branch1][=O][N][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C17CCCCNC1=O.C18CCCN13.CC4C2=O.C6C(F)(F)F.N25C.C37=O.N46C.C58
|
C[C@@H]1CN(C(=O)c2c[nH]c(=N)o2)CC[C@@H]1CNC(=O)C1C2CCC1CC2
|
C[C@@H]CNC=O)cc[nH]c=N)o5))))))CC[C@@H]6CNC=O)CCCCC5CC6
|
[C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=N][O][Ring1][=Branch1][C][C][C@@H1][Ring1][=C][C][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][=Branch1]
|
CC1CN3CCC18.C17C2CCC1CC2.c16c[nH]c(=N)o1.C36=O.C47=O.C58.N45
|
O=[N+]([O-])c1ccc(-n2cc(CN[C@H]3COc4ccc(F)cc4C3)nn2)cc1
|
O=[N+][O-])cccc-nccCN[C@H]COccccF)cc6C%10))))))))))))nn5)))))cc6
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch2][Ring1][#C][N][C][=C][Branch2][Ring1][Ring2][C][N][C@H1][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][O][N][=N][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2]
|
C16COc2ccc(F)cc2C1.O=[N+]([O-])c1ccc8cc1.n18cc7nn1.C57.N56
|
CC[C@H](CC(C)C)C(=O)N1CCc2cc(CNC(=O)C3CC(C)(O)C3)ccc2C1
|
CC[C@H]CCC)C)))C=O)NCCcccCNC=O)CCCC)O)C4)))))))ccc6C%10
|
[C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][=C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][O][C][Ring1][=Branch1][=C][C][=C][Ring1][S][C][Ring2][Ring1][Ring2]
|
N14CCc2cc8ccc2C1.CCC(CC(C)C)C4=O.C17CC(C)(O)C1.C57=O.C68.N56
|
Cc1cccc(Cl)c1OCC(=O)N1CC[C@H](NC(=O)[C@H]2C[C@@H](C)CC(=O)N2)[C@@H]1C
|
CcccccCl)c6OCC=O)NCC[C@H]NC=O)[C@H]C[C@@H]C)CC=O)N6))))))))[C@@H]5C
|
[C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][O][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][Ring1][Branch2][C@@H1][Ring1][S][C]
|
Cc1cccc(Cl)c16.C18CC(C)CC(=O)N1.N13CCC7C1C.C5C3=O.C48=O.O56.N47
|
Cc1occc1CC(=O)N(C)CCOCCNC(=O)CC=C(Cl)Cl
|
Ccoccc5CC=O)NC)CCOCCNC=O)CC=CCl)Cl
|
[C][C][O][C][=C][C][=Ring1][Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][Cl][Cl]
|
C3(=O)CC=C(Cl)Cl.Cc1occc18.C8C2=O.N26C.C6C4.C5C7.O45.N37
|
Cc1n[nH]c(C)c1CC(=O)NCC[C@H]1CCCN1C(=O)CCc1cnccn1
|
Ccn[nH]cC)c5CC=O)NCC[C@H]CCCN5C=O)CCccnccn6
|
[C][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][=C][N][=C][C][=N][Ring1][=Branch1]
|
Cc1n[nH]c(C)c17.C15CCCN13.c16cnccn1.C3(=O)CC6.C7C2=O.C4C5.N24
|
CN(C(=O)CCSCC(N)=O)[C@H](CNC(=O)C1(CF)CCC1)c1ccccc1
|
CNC=O)CCSCCN)=O)))))))[C@H]CNC=O)CCF))CCC4)))))))cccccc6
|
[C][N][Branch1][=C][C][=Branch1][C][=O][C][C][S][C][C][Branch1][C][N][=O][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
c1%10ccccc1.C2(=O)CC6.C189CCC1.C7C(N)=O.C4%10C5.CN24.C38=O.S67.N35.C9F
|
C[C@@H](O)C(C)(C)C(=O)N[C@@H]1C[C@H]1CNC(=O)c1cnn(C2CCCCC2)c1
|
C[C@@H]O)CC)C)C=O)N[C@@H]C[C@H]3CNC=O)ccnnCCCCCC6))))))c5
|
[C][C@@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][=Ring1][O]
|
CC(O)C(C)(C)C3=O.c17cnn9c1.C19CCCCC1.C16CC18.C47=O.N36.C58.N45
|
O=C(N[C@H](CNC(=O)C1(CF)CC1)[C@@H]1CCOC1)c1cncc(OCC(F)F)c1
|
O=CN[C@H]CNC=O)CCF))CC3))))))[C@@H]CCOC5)))))))ccnccOCCF)F))))c6
|
[O][=C][Branch2][Ring1][O][N][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][C][Ring1][Branch1][C@@H1][C][C][O][C][Ring1][Branch1][C][=C][N][=C][C][Branch1][Branch2][O][C][C][Branch1][C][F][F][=C][Ring1][O]
|
c1%10cncc6c1.C1%11CCOC1.C7%11C8.C193CC1.C5C(F)F.O=C2%10.C49=O.N27.N48.C3F.O56
|
CC(C)C[C@H](O)[C@H](C)C(=O)N1CCN(C)[C@H](C(=O)NC23CCN(CC2)C3)C1
|
CCC)C[C@H]O)[C@H]C)C=O)NCCNC)[C@H]C=O)NCCCNCC6))C5)))))))C6
|
[C][C][Branch1][C][C][C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1][C][Ring1][P]
|
CC(C)CC(O)C(C)C4=O.N14CCN(C)C7C1.C126CCN(CC1)C2.C57=O.N56
|
COC(=O)NCC(=O)NC[C@H]1CCCC2(CCN(C(=O)C3(CCF)CC3)CC2)O1
|
COC=O)NCC=O)NC[C@H]CCCCCCNC=O)CCCF)))CC3))))CC6)))))O6
|
[C][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][Ring2][C][C][F][C][C][Ring1][=Branch1][C][C][Ring1][=C][O][Ring2][Ring1][Ring1]
|
C1%11CCCC2(CCN7CC2)O1.C8C6=O.C1%10%12CC1.C45=O.C7%10=O.C%12CF.CO4.N58.N69.C9%11
|
CCCc1[nH]ccc1C(=O)NC12CCC(CC1)N(C(=O)[C@@H]1[C@H]3CC[C@@H](C3)[C@@H]1C)C2
|
CCCc[nH]ccc5C=O)NCCCCCC6))NC=O)[C@@H][C@H]CC[C@@H]C5)[C@@H]6C))))))))C6
|
[C][C][C][C][NH1][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch1][C@@H1][Ring1][#Branch1][C][C][Ring2][Ring1][C]
|
C126CCC(CC1)N5C2.C17C2CCC(C2)C1C.c19[nH]ccc18.CCC9.C48=O.C57=O.N46
|
CC1(OCC(=O)NCC2[C@@H]3CN(C(=O)[C@H](O)c4ccccn4)C[C@@H]23)CCC1
|
CCOCC=O)NCC[C@@H]CNC=O)[C@H]O)cccccn6))))))))C[C@@H]65)))))))))))CCC4
|
[C][C][Branch2][Ring2][Branch1][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C@@H1][Ring1][S][Ring1][#C][C][C][C][Ring2][Ring1][#Branch2]
|
C1%11C2CN6CC12.c1%10ccccn1.CC17CCC1.C6(=O)C%10O.C8C5=O.O78.N59.C9%11
|
O=C(N[C@@H]1CCC[C@@H]2CN(c3nc4cccnc4s3)C[C@@H]21)[C@]1(O)CCSC1
|
O=CN[C@@H]CCC[C@@H]CNcnccccnc6s9)))))))))C[C@@H]59))))))))))[C@]O)CCSC5
|
[O][=C][Branch2][Ring1][#C][N][C@@H1][C][C][C][C@@H1][C][N][Branch1][=C][C][=N][C][=C][C][=C][N][=C][Ring1][=Branch1][S][Ring1][=Branch2][C][C@@H1][Ring1][=C][Ring2][Ring1][C][C@][Branch1][C][O][C][C][S][C][Ring1][=Branch1]
|
C17CCCC2CN6CC12.c16nc2cccnc2s1.C18(O)CCSC1.O=C58.N57
|
COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)N=c1[nH]n(C)cc1SC
|
COcccNCCOCC)C)C6))))))ccc6NC=O)N=c[nH]nC)cc5SC
|
[C][O][C][=C][C][Branch1][#C][N][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2][=C][C][=C][Ring1][=C][N][C][=Branch1][C][=O][N][=C][NH1][N][Branch1][C][C][C][=C][Ring1][=Branch1][S][C]
|
C3(=O)N=c1[nH]n(C)cc17.c14cc5ccc16.N15CCOC(C)(C)C1.CO4.N36.S7C
|
COc1cccc(-c2cncc(F)c2C(=O)NCc2nc3ccccc3[nH]2)n1
|
COccccc-ccnccF)c6C=O)NCcncccccc6[nH]9))))))))))))))))))n6
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][=C][N][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][=N][Ring2][Ring1][#Branch2]
|
c18nc2ccccc2[nH]1.c19cncc(F)c17.c15cccc9n1.C47=O.CO5.N46.C68
|
Cc1c[nH]c(C(=O)N[C@H]2CC[C@@](C)(CNC(=O)CCCCCC(C)(C)C)C2)c1C
|
Ccc[nH]cC=O)N[C@H]CC[C@@]C)CNC=O)CCCCCCC)C)C))))))))))C5)))))))c5C
|
[C][C][=C][NH1][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@][Branch1][C][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][O][C]
|
C4(=O)CCCCCC(C)(C)C.Cc1c[nH]c7c1C.C16CCC8(C)C1.C37=O.N36.C58.N45
|
C[C@H](C(=O)NCC[C@H](O)C(=O)NCCCCC(N)=O)c1cccs1
|
C[C@H]C=O)NCC[C@H]O)C=O)NCCCCCN)=O)))))))))))))ccccs5
|
[C][C@H1][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][C][N][=O][C][=C][C][=C][S][Ring1][Branch1]
|
C4CC(O)C3=O.C5CCCC(N)=O.CC6C2=O.c16cccs1.N24.N35
|
Cc1nc(CNC(=O)CC2(NC(=O)c3coc(C(C)C)n3)CC2)n[nH]1
|
CcncCNC=O)CCNC=O)ccocCC)C))n5)))))))CC3)))))))n[nH]5
|
[C][C][=N][C][Branch2][Ring2][Ring1][C][N][C][=Branch1][C][=O][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][Ring1][Branch2][C][C][Ring1][=C][=N][NH1][Ring2][Ring1][Branch2]
|
Cc1nc9n[nH]1.c18coc%10n1.C4(=O)C%11.C17%11CC1.C58=O.C%10(C)C.C69.N46.N57
|
O=C(N[C@]1(CF)CCN(C(=O)Cc2ccsn2)C1)c1cccc(OCC(F)F)n1
|
O=CN[C@]CF))CCNC=O)Ccccsn5)))))))C5))))))cccccOCCF)F))))n6
|
[O][=C][Branch2][Ring1][O][N][C@][Branch1][Ring1][C][F][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][S][N][=Ring1][Branch1][C][Ring1][#C][C][=C][C][=C][C][Branch1][Branch2][O][C][C][Branch1][C][F][F][=N][Ring1][O]
|
C17%10CCN4C1.c18cccc6n1.c19ccsn1.C4(=O)C9.C5C(F)F.O=C38.N37.C%10F.O56
|
CSCCC(=O)N1C[C@@H](C)C[C@H]1C(=O)Nc1ccc(F)c(Cl)c1
|
CSCCC=O)NC[C@@H]C)C[C@H]5C=O)NccccF)cCl)c6
|
[C][S][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2]
|
c15ccc(F)c(Cl)c1.N12CC(C)CC16.C4CC2=O.C36=O.CS4.N35
|
C[C@@H](CNC(=O)C=CCN1CCCC1)[C@H](F)C(=O)N(C)C1CCSCC1
|
C[C@@H]CNC=O)C=CCNCCCC5)))))))))))[C@H]F)C=O)NC)CCCSCC6
|
[C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][C][N][C][C][C][C][Ring1][Branch1][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][S][C][C][Ring1][=Branch1]
|
CC(C4)C(F)C3=O.C16CCSCC1.N15CCCC1.C2(=O)C=7.C=7C5.N36C.N24
|
CCc1ccccc1NC(=O)[C@H](c1ncc(Cl)cc1Br)N1CCNC(=O)[C@@H]1CC
|
CCcccccc6NC=O)[C@H]cnccCl)cc6Br)))))))NCCNC=O)[C@@H]6CC
|
[C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Br][N][C][C][N][C][=Branch1][C][=O][C@@H1][Ring1][#Branch1][C][C]
|
c16ncc(Cl)cc1Br.N13CCNC(=O)C15.c17ccccc14.C2(=O)C36.CC7.N24.C5C
|
CN(CCNC(=O)[C@H]1CCc2cnn(C)c2C1)C(=O)c1cnc(N(C)C)cn1
|
CNCCNC=O)[C@H]CCccnnC)c5C9)))))))))))))C=O)ccncNC)C))cn6
|
[C][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][#Branch2][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=N][Ring1][=Branch2]
|
C19CCc2cnn(C)c2C1.c18cnc7cn1.CN45.C5C6.C39=O.C48=O.N7(C)C.N36
|
CN(Cc1c(Cl)cc(Cl)cc1Cl)C1CN(C(=O)Cn2nc(Cl)ccc2=O)C1
|
CNCccCl)ccCl)cc6Cl))))))))CCNC=O)CnncCl)ccc6=O)))))))))C4
|
[C][N][Branch1][P][C][C][=C][Branch1][C][Cl][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Cl][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][N][N][=C][Branch1][C][Cl][C][=C][C][Ring1][#Branch1][=O][C][Ring1][#C]
|
c17c(Cl)cc(Cl)cc1Cl.n16nc(Cl)ccc1=O.C15CN3C1.C3(=O)C6.CN45.C47
|
Cc1ccc(-c2n[nH]c(NC(=O)[C@@H](C)c3ccccc3Cl)n2)cc1
|
Ccccc-cn[nH]cNC=O)[C@@H]C)cccccc6Cl))))))))))n5)))))cc6
|
[C][C][=C][C][=C][Branch2][Ring1][=N][C][=N][NH1][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=N][Ring1][P][C][=C][Ring2][Ring1][#Branch1]
|
Cc1ccc7cc1.c16ccccc1Cl.c17n[nH]c5n1.C4(=O)C6C.N45
|
CCc1ccc(C(=O)N2CCc3[nH]nc(CNC(=O)[C@H](CCSC)OC)c3C2)[nH]1
|
CCccccC=O)NCCc[nH]ncCNC=O)[C@H]CCSC))))OC))))))c5C9))))))))))[nH]5
|
[C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][NH1][N][=C][Branch1][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][S][C][O][C][C][=Ring1][S][C][Ring2][Ring1][Ring2][NH1][Ring2][Ring1][O]
|
N14CCc2[nH]nc%11c2C1.C5(=O)C6CC8.c1%10ccc9[nH]1.C49=O.CC%10.C7%11.N57.S8C.O6C
|
CCOCCOCCCC(=O)NC1CCN(C(=O)[C@H](O)C2CC2)CC1
|
CCOCCOCCCC=O)NCCCNC=O)[C@H]O)CCC3)))))CC6
|
[C][C][O][C][C][O][C][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][Ring1][Ring1][C][C][Ring1][=N]
|
C19CCN4CC1.C8CCC3=O.C4(=O)C%10O.C6C7.C1%10CC1.CC5.O56.O78.N39
|
CC[C@@H](C)Oc1ccccc1C(=O)N[C@@H]1C[C@@H]1CNC(=O)C1CCC2(CC1)CC2
|
CC[C@@H]C)Occcccc6C=O)N[C@@H]C[C@@H]3CNC=O)CCCCCC6))CC3
|
[C][C][C@@H1][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch1]
|
C19CCC2(CC1)CC2.c16ccccc1%10.CCC5C.C18CC1%11.C3%10=O.C49=O.O56.N38.C7%11.N47
|
CCOc1n[nH]cc1C(=O)N1CC(COC)(NC(=O)[C@H](SC)C(C)C)C1
|
CCOcn[nH]cc5C=O)NCCCOC)))NC=O)[C@H]SC))CC)C)))))C4
|
[C][C][O][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][O][C][Branch1][S][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][S][C][C][Branch1][C][C][C][C][Ring1][S]
|
C3(=O)C8C(C)C.c16n[nH]cc19.N12CC7%10C1.C29=O.CC4.O46.C5%10.O5C.N37.S8C
|
CC[C@]1(NC(=O)CNS(=O)(=O)NC)CCCN(C(=O)C(C)(C)OC(C)C)C1
|
CC[C@]NC=O)CNS=O)=O)NC)))))))CCCNC=O)CC)C)OCC)C)))))C6
|
[C][C][C@][Branch1][P][N][C][=Branch1][C][=O][C][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][O][C][Branch1][C][C][C][C][Ring2][Ring1][=Branch2]
|
C168CCCN3C1.N7S(=O)(=O)NC.C3(=O)C4(C)C.C2(=O)C7.C5(C)C.CC8.N26.O45
|
COC[C@](C)(O)C(=O)N[C@@H](CNC(=O)C1CC2(CCC2)C1)c1ccc(F)cc1F
|
COC[C@]C)O)C=O)N[C@@H]CNC=O)CCCCCC4)))C4)))))))ccccF)cc6F
|
[C][O][C][C@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F]
|
c19ccc(F)cc1F.C5C(C)(O)C3=O.C18CC2(CCC2)C1.C69C7.C48=O.CO5.N36.N47
|
O=C1OCC2=C1CCN(C(=O)C1CCN(c3ccnc(Cl)n3)CC1)C2
|
O=COCC=C5CCNC=O)CCCNcccncCl)n6))))))CC6)))))))C6
|
[O][=C][O][C][C][=C][Ring1][Branch1][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][C][C][N][Branch1][N][C][=C][C][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][Ring1][=N][C][Ring2][Ring1][Branch1]
|
O=C1OCC2=C1CCN4C2.C16CCN5CC1.c15ccnc(Cl)n1.C46=O
|
C=C[C@@H]1C[C@H]1C(=O)N1CCCN(CCNC(=O)C2(C)CC=CC2)CC1
|
C=C[C@@H]C[C@H]3C=O)NCCCNCCNC=O)CC)CC=CC5)))))))))CC7
|
[C][=C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=C][C][Ring1][=Branch1][C][C][Ring2][Ring1][C]
|
N13CCCN5CC1.C18(C)CC=CC1.C=CC1CC17.C37=O.C5C6.C48=O.N46
|
Nc1ccc(C(=O)NC2(CCNC(=O)C=Cc3cccs3)CC2)c(Cl)c1
|
NccccC=O)NCCCNC=O)C=Cccccs5)))))))))))CC3)))))cCl)c6
|
[N][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][Branch1][P][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][#C][C][Branch1][C][Cl][=C][Ring2][Ring1][=Branch2]
|
Nc1ccc8c(Cl)c1.C=9c1cccs1.C16%10CC1.C5(=O)C=9.C48=O.C%10C7.N46.N57
|
CCC[C@H](CC)C(=O)N1CCC(C[C@H](C)NC(=O)CNS(=O)(=O)CC)CC1
|
CCC[C@H]CC))C=O)NCCCC[C@H]C)NC=O)CNS=O)=O)CC)))))))))CC6
|
[C][C][C][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][C][Ring2][Ring1][Ring1]
|
CCCC(CC)C2=O.N12CCC7CC1.S6(=O)(=O)CC.C7C4C.C3(=O)C5.N34.N56
|
C[C@@H]1C[C@@H](C)[C@H](C(=O)NC[C@H]2CCCN(C(=O)C3(n4cncn4)CC3)C2)O1
|
C[C@@H]C[C@@H]C)[C@H]C=O)NC[C@H]CCCNC=O)Cncncn5)))))CC3))))C6)))))))))O5
|
[C][C@@H1][C][C@@H1][Branch1][C][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@H1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][Branch2][N][C][=N][C][=N][Ring1][Branch1][C][C][Ring1][Branch2][C][Ring1][S][O][Ring2][Ring1][#Branch2]
|
CC1CC(C)C8O1.C1%10CCCN6C1.n1%11cncn1.C19%11CC1.C58=O.C69=O.N57.C7%10
|
Cc1ccc(C(=O)Nc2ncc(C3=CC[C@@H](O)CC3)cc2C)cc1[N+](=O)[O-]
|
CccccC=O)NcnccC=CC[C@@H]O)CC6))))))cc6C)))))))))cc6[N+]=O)[O-]
|
[C][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][N][C][=C][C][C@@H1][Branch1][C][O][C][C][Ring1][#Branch1][C][=C][Ring1][=N][C][C][=C][Ring2][Ring1][#Branch1][N+1][=Branch1][C][=O][O-1]
|
c15ncc(C2=CCC(O)CC2)cc1C.Cc1ccc6cc1[N+](=O)[O-].C46=O.N45
|
Cc1cc(Cl)ncc1CC(=O)N[C@@H]1CN(C(=O)[C@@]2(C)COC(=O)C2)CC(C)(C)C1
|
CcccCl)ncc6CC=O)N[C@@H]CNC=O)[C@@]C)COC=O)C5))))))CCC)C)C6
|
[C][C][=C][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@][Branch1][C][C][C][O][C][=Branch1][C][=O][C][Ring1][#Branch1][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][P]
|
C15CN4CC(C)(C)C1.Cc1cc(Cl)ncc17.C16(C)COC(=O)C1.C7C3=O.C46=O.N35
|
C[C@@H]1C[C@H](CNC(=O)[C@H]2C[C@](O)(CCC(C)(C)C)C2)CN1C(=O)CSC(F)F
|
C[C@@H]C[C@H]CNC=O)[C@H]C[C@]O)CCCC)C)C))))C4)))))))CN5C=O)CSCF)F
|
[C][C@@H1][C][C@H1][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C@H1][C][C@][Branch1][C][O][Branch1][O][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][O][C][N][Ring2][Ring1][Ring2][C][=Branch1][C][=O][C][S][C][Branch1][C][F][F]
|
CC1CC8CN14.C17CC9(O)C1.C9CC(C)(C)C.C4(=O)C6.S6C(F)F.C37=O.C58.N35
|
C[C@@H]1CC(F)(F)CN1C(=O)[C@@]1(NC(=O)CCCOC(C)(C)C)CC1(C)C
|
C[C@@H]CCF)F)CN5C=O)[C@@]NC=O)CCCOCC)C)C))))))))CC3C)C
|
[C][C@@H1][C][C][Branch1][C][F][Branch1][C][F][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@@][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=C][Branch1][C][C][C]
|
CC1CC(F)(F)CN12.C167CC1(C)C.C3(=O)CCC4.C5(C)(C)C.C27=O.N36.O45
|
CN(C)C(=O)CCC(=O)N(C)C[C@H]1CN(C(=O)CSc2n[nH]c(O)n2)CC12CC2
|
CNC)C=O)CCC=O)NC)C[C@H]CNC=O)CScn[nH]cO)n5))))))))CC5CC3
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][S][C][=N][NH1][C][Branch1][C][O][=N][Ring1][=Branch1][C][C][Ring1][#C][C][C][Ring1][Ring1]
|
C18CN5CC12CC2.C3(=O)CCC4=O.c19n[nH]c(O)n1.C5(=O)C7.CN3C.N46C.C68.S79
|
CN(CC1CCCCC1)N1CCC[C@H]1c1nnc2n1CCCCC2
|
CNCCCCCCC6)))))))NCCC[C@H]5cnncn5CCCCC7
|
[C][N][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][N][C][C][C][C@H1][Ring1][Branch1][C][=N][N][=C][N][Ring1][Branch1][C][C][C][C][C][Ring1][#Branch1]
|
c14nnc2n1CCCCC2.CN(C3)N1CCCC14.C13CCCCC1
|
C=CCc1cccc(C[C@@H](NC(=O)CCOCC(F)F)C(=O)O)c1
|
C=CCcccccC[C@@H]NC=O)CCOCCF)F))))))))C=O)O))))c6
|
[C][=C][C][C][=C][C][=C][C][Branch2][Ring1][Branch2][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][O][C][C][Branch1][C][F][F][C][=Branch1][C][=O][O][=C][Ring2][Ring1][Branch1]
|
c16cccc7c1.C7C5C(=O)O.C2(=O)CC3.C4C(F)F.C=CC6.N25.O34
|
CC(C)Oc1ccc(Br)cc1CN1CC[C@@H](NC(=O)[C@H]2CCCO2)[C@@H](F)C1
|
CCC)OccccBr)cc6CNCC[C@@H]NC=O)[C@H]CCCO5)))))))[C@@H]F)C6
|
[C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][N][C][C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][C][C][O][Ring1][Branch1][C@@H1][Branch1][C][F][C][Ring1][#C]
|
c15ccc(Br)cc19.N16CCC7C(F)C1.C18CCCO1.CC4C.C38=O.O45.C69.N37
|
CC(C)C[C@H]1C[C@@H]1C(=O)N1CCC[C@H](C(=O)N[C@@H]2C[C@H](O)[C@H](O)C2)C1
|
CCC)C[C@H]C[C@@H]3C=O)NCCC[C@H]C=O)N[C@@H]C[C@H]O)[C@H]O)C5)))))))C6
|
[C][C][Branch1][C][C][C][C@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][Ring1][#Branch1][C][Ring1][S]
|
N13CCCC7C1.C15CC(O)C(O)C1.CC(C)C8.C18CC16.C36=O.C47=O.N45
|
Cc1scc(C(=O)NC[C@@H](C)NC(=O)C2(CCF)CCC2)c1C
|
CcsccC=O)NC[C@@H]C)NC=O)CCCF)))CCC4))))))))))c5C
|
[C][C][S][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][Ring2][C][C][F][C][C][C][Ring1][#Branch1][C][=Ring2][Ring1][Branch1][C]
|
Cc1scc8c1C.C179CCC1.C5C6C.C38=O.C47=O.C9CF.N35.N46
|
CCC(C)(C)OCC(=O)N[C@H]1C[C@@](F)(CNC(=O)[C@@]2(C)CCCCNC2=O)C1
|
CCCC)C)OCC=O)N[C@H]C[C@@]F)CNC=O)[C@@]C)CCCCNC7=O)))))))))))C4
|
[C][C][C][Branch1][C][C][Branch1][C][C][O][C][C][=Branch1][C][=O][N][C@H1][C][C@@][Branch1][C][F][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][C][N][C][Ring1][Branch2][=O][C][Ring2][Ring1][C]
|
C19(C)CCCCNC1=O.C18CC%10(F)C1.CCC5(C)C.C6C3=O.C49=O.O56.N38.C7%10.N47
|
CCn1nc(C)c(C(=O)N2C[C@@H](NC(=O)CSCCOC)[C@H](OC)C2)c1C
|
CCnncC)cC=O)NC[C@@H]NC=O)CSCCOC))))))))[C@H]OC))C5))))))c5C
|
[C][C][N][N][=C][Branch1][C][C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][N][N][C][=Branch1][C][=O][C][S][C][C][O][C][C@H1][Branch1][Ring1][O][C][C][Ring1][S][=C][Ring2][Ring1][Branch2][C]
|
n1%11nc(C)c%10c1C.N13CC6C9C1.C4(=O)C7.C3%10=O.C8C5.CC%11.N49.S78.O5C.O6C
|