SMILES
stringlengths 17
123
| Deep SMILES
stringlengths 15
129
| SELFIES
stringlengths 71
378
| SAFE
stringlengths 23
156
|
|---|---|---|---|
C=C[C@]1(C(=O)N2CCO[C@@H](c3nncn3C)C2)CCNC1
|
C=C[C@]C=O)NCCO[C@@H]cnncn5C))))))C6)))))))CCNC5
|
[C][=C][C@][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch1][=Branch2][C][=N][N][=C][N][Ring1][Branch1][C][C][Ring1][N][C][C][N][C][Ring2][Ring1][Ring1]
|
C=C[C@]15CCNC1.N14CCO[C@@H]6C1.c16nncn1C.C45=O
|
Cn1cnnc1[C@@H]1CN(C(=O)[C@]2(CN)CCNC2)CCO1
|
Cncnnc5[C@@H]CNC=O)[C@]CN))CCNC5))))))CCO6
|
[C][N][C][=N][N][=C][Ring1][Branch1][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C@][Branch1][Ring1][C][N][C][C][N][C][Ring1][#Branch1][C][C][O][Ring1][#C]
|
[C@@H]16CN3CCO1.Cn1cnnc16.[C@@]145CCNC1.C34=O.C5N
|
CC(C)[C@]1(C(=O)N2CCO[C@H](c3nncn3C)C2)CCNC1
|
CCC)[C@]C=O)NCCO[C@H]cnncn5C))))))C6)))))))CCNC5
|
[C][C][Branch1][C][C][C@][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch1][=Branch2][C][=N][N][=C][N][Ring1][Branch1][C][C][Ring1][N][C][C][N][C][Ring2][Ring1][Ring1]
|
N14CCO[C@H]7C1.[C@]156CCNC1.c17nncn1C.CC6C.C45=O
|
CCn1cnnc1[C@H]1CN(C(=O)[C@@]2(C(F)(F)F)CCN(C)C2)CCO1
|
CCncnnc5[C@H]CNC=O)[C@@]CF)F)F))CCNC)C5))))))CCO6
|
[C][C][N][C][=N][N][=C][Ring1][Branch1][C@H1][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C@@][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][N][Branch1][C][C][C][Ring1][#Branch2][C][C][O][Ring2][Ring1][C]
|
[C@H]17CN3CCO1.[C@]146CCN(C)C1.n15cnnc17.C6(F)(F)F.C34=O.CC5
|
Cn1cnnc1[C@@H]1CN(C(=O)[C@@H]2CNC(C)(C)C2)CCO1
|
Cncnnc5[C@@H]CNC=O)[C@@H]CNCC)C)C5))))))CCO6
|
[C][N][C][=N][N][=C][Ring1][Branch1][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C][N][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][C][C][O][Ring1][#C]
|
[C@@H]15CN3CCO1.[C@@H]14CNC(C)(C)C1.Cn1cnnc15.C34=O
|
CN1CC[C@@](NC(=O)OC(C)(C)C)(C(=O)N2CCO[C@H](c3nncn3C)C2)C1
|
CNCC[C@@]NC=O)OCC)C)C)))))C=O)NCCO[C@H]cnncn5C))))))C6)))))))C5
|
[C][N][C][C][C@@][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch1][=Branch2][C][=N][N][=C][N][Ring1][Branch1][C][C][Ring1][N][C][Ring2][Ring1][O]
|
CN1CC[C@@]89C1.N16CCO[C@H]%10C1.c1%10nncn1C.C7(C)(C)C.C45=O.C69=O.N58.O47
|
CCn1cnnc1[C@@H]1CN(C(=O)[C@@]2(CF)CCN(C(=O)OC(C)(C)C)C2)CCO1
|
CCncnnc5[C@@H]CNC=O)[C@@]CF))CCNC=O)OCC)C)C))))C5))))))CCO6
|
[C][C][N][C][=N][N][=C][Ring1][Branch1][C@@H1][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][F][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=C][C][C][O][Ring2][Ring1][=Branch1]
|
[C@@H]1%10CN4CCO1.[C@]179CCN5C1.n18cnnc1%10.C6(C)(C)C.C47=O.C35=O.CC8.C9F.O36
|
CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CCO[C@H](c2nncn2C)C1
|
CO[C@@H]CNC=O)OCC)C)C))))C[C@H]5C=O)NCCO[C@H]cnncn5C))))))C6
|
[C][O][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C@H1][Ring1][N][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch1][=Branch2][C][=N][N][=C][N][Ring1][Branch1][C][C][Ring1][N]
|
[C@@H]17CN4C[C@H]18.N15CCO[C@H]9C1.c19nncn1C.C6(C)(C)C.C34=O.C58=O.CO7.O36
|
O=C(Cn1ncnn1)N[C@@H]1C[C@@H]2CN(C(=O)[C@@H]3COc4ccc(O)cc4O3)C[C@@H]21
|
O=CCnncnn5))))))N[C@@H]C[C@@H]CNC=O)[C@@H]COccccO)cc6O%10)))))))))))C[C@@H]57
|
[O][=C][Branch1][=Branch2][C][N][N][=C][N][=N][Ring1][Branch1][N][C@@H1][C][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][Ring1][O][C][C@@H1][Ring2][Ring1][C][Ring2][Ring1][Ring2]
|
[C@@H]18COc2ccc(O)cc2O1.[C@@H]17C[C@@H]2CN6C[C@@H]21.n19ncnn1.O=C5C9.C68=O.N57
|
C[C@@H](CN=c1nc(N(C)Cc2ncn(C)n2)c2c([nH]1)CCS2)n1ccnn1
|
C[C@@H]CN=cncNC)CcncnC)n5)))))))cc[nH]6)CCS5))))))))))nccnn5
|
[C][C@@H1][Branch2][Ring2][Ring1][C][N][=C][N][=C][Branch1][S][N][Branch1][C][C][C][C][N][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][=C][Branch1][Ring2][NH1][Ring1][#C][C][C][S][Ring1][=Branch1][N][C][=C][N][=N][Ring1][Branch1]
|
C[C@H]5CN=c1nc4c2c([nH]1)CCS2.c16ncn(C)n1.n15ccnn1.N34C.C36
|
Cc1nc(CN(C)c2nc(=NCCn3cc(CO)nn3)[nH]c3c2SCC3)n[nH]1
|
CcncCNC)cnc=NCCnccCO))nn5))))))))[nH]cc6SCC5)))))))))))n[nH]5
|
[C][C][=N][C][Branch2][Ring2][Ring1][C][N][Branch1][C][C][C][=N][C][=Branch1][#C][=N][C][C][N][C][=C][Branch1][Ring1][C][O][N][=N][Ring1][#Branch1][NH1][C][=C][Ring1][S][S][C][C][Ring1][Branch1][=N][NH1][Ring2][Ring1][O]
|
c15nc(=NCC6)[nH]c2c1SCC2.Cc1nc7n[nH]1.n16cc8nn1.N45C.C47.C8O
|
Cc1cc(C(=O)N[C@@H]2C[C@H](CNC(=O)CC[C@H]3CCCOC3)C[C@H]2O)c(C)n1C
|
CcccC=O)N[C@@H]C[C@H]CNC=O)CC[C@H]CCCOC6)))))))))))C[C@H]5O))))))))cC)n5C
|
[C][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][C@H1][Ring1][P][O][=C][Branch1][C][C][N][Ring2][Ring1][O][C]
|
Cc1cc8c(C)n1C.[C@@H]17C[C@H]9C[C@H]1O.[C@H]1%10CCCOC1.C5(=O)CC%10.C48=O.N47.C69.N56
|
Cc1cn(C)cc1C(=O)N[C@@H]1CC[C@](F)(CNC(=O)CC[C@H]2CCCOC2)C1
|
CccnC)cc5C=O)N[C@@H]CC[C@]F)CNC=O)CC[C@H]CCCOC6)))))))))))C5
|
[C][C][=C][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C@][Branch1][C][F][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
Cc1cn(C)cc17.[C@@H]16CC[C@@]8(F)C1.[C@H]19CCCOC1.C4(=O)CC9.C37=O.N36.C58.N45
|
Cc1[nH]c(C)c(C(=O)N[C@@H]2C[C@H](CNC(=O)CC[C@H]3CCCOC3)C[C@H]2O)c1C
|
Cc[nH]cC)cC=O)N[C@@H]C[C@H]CNC=O)CC[C@H]CCCOC6)))))))))))C[C@H]5O))))))))c5C
|
[C][C][NH1][C][Branch1][C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][C@H1][Ring1][P][O][C][=Ring2][Ring1][O][C]
|
Cc1[nH]c(C)c8c1C.[C@@H]17C[C@H]9C[C@H]1O.[C@H]1%10CCCOC1.C5(=O)CC%10.C48=O.N47.C69.N56
|
N#Cc1cc(C(=O)N[C@@H]2C[C@H](CNC(=O)CC[C@@H]3CCCOC3)C[C@H]2O)c[nH]1
|
N#CcccC=O)N[C@@H]C[C@H]CNC=O)CC[C@@H]CCCOC6)))))))))))C[C@H]5O))))))))c[nH]5
|
[N][#C][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][C@H1][Ring1][P][O][=C][NH1][Ring2][Ring1][#Branch2]
|
N#Cc1cc8c[nH]1.[C@@H]17C[C@H]9C[C@H]1O.[C@@H]1%10CCCOC1.C5(=O)CC%10.C48=O.N47.C69.N56
|
Cc1cc(C(=O)N[C@@H]2CC[C@H](CNC(=O)CC[C@H]3CCCOC3)C2)c(C)n1C
|
CcccC=O)N[C@@H]CC[C@H]CNC=O)CC[C@H]CCCOC6)))))))))))C5)))))))cC)n5C
|
[C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][P][=C][Branch1][C][C][N][Ring2][Ring1][#Branch2][C]
|
Cc1cc8c(C)n1C.[C@@H]17CC[C@H]9C1.[C@H]1%10CCCOC1.C5(=O)CC%10.C48=O.N47.C69.N56
|
COC(=O)c1[nH]ccc1C(=O)N[C@@H]1CC[C@H](CNC(=O)CC[C@H]2CCCOC2)C1
|
COC=O)c[nH]ccc5C=O)N[C@@H]CC[C@H]CNC=O)CC[C@H]CCCOC6)))))))))))C5
|
[C][O][C][=Branch1][C][=O][C][NH1][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][P]
|
c18[nH]ccc19.[C@@H]17CC[C@H]%10C1.[C@H]1%11CCCOC1.C5(=O)CC%11.C38=O.C49=O.CO3.N47.C6%10.N56
|
CN(Cc1ccc(Cn2ccnc2)cc1)C(=O)N[C@H]1CCCc2nc(O)ccc21
|
CNCccccCnccnc5))))))cc6)))))))C=O)N[C@H]CCCcncO)ccc6%10
|
[C][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][Ring1][N][C][=Branch1][C][=O][N][C@H1][C][C][C][C][=N][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][Ring1][O]
|
N4[C@H]1CCCc2nc(O)ccc21.c17ccc8cc1.n16ccnc1.CN35.C34=O.C57.C68
|
FC(F)(F)CN1CC(Nc2nccc(=N[C@H]3CCOC4(CCCC4)C3)[nH]2)C1
|
FCF)F)CNCCNcnccc=N[C@H]CCOCCCCC5))))C6)))))))[nH]6)))))))C4
|
[F][C][Branch1][C][F][Branch1][C][F][C][N][C][C][Branch2][Ring1][=C][N][C][=N][C][=C][C][=Branch2][Ring1][C][=N][C@H1][C][C][O][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Ring1][#Branch2][NH1][Ring1][P][C][Ring2][Ring1][=Branch1]
|
c16nccc(=N[C@H]2CCOC3(CCCC3)C2)[nH]1.FC(F)(F)C5.N15CC7C1.N67
|
CN1CC(Nc2nccc(=N[C@@H]3CCOC4(CCCC4)C3)[nH]2)C1
|
CNCCNcnccc=N[C@@H]CCOCCCCC5))))C6)))))))[nH]6)))))))C4
|
[C][N][C][C][Branch2][Ring1][=C][N][C][=N][C][=C][C][=Branch2][Ring1][C][=N][C@@H1][C][C][O][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Ring1][#Branch2][NH1][Ring1][P][C][Ring2][Ring1][=Branch1]
|
c15nccc(=N[C@@H]2CCOC3(CCCC3)C2)[nH]1.CN1CC6C1.N56
|
CCCN(C1CCCCC1)[C@@H](C(=O)Nc1ccccc1Cl)c1cnc2sccn12
|
CCCNCCCCCC6))))))[C@@H]C=O)Ncccccc6Cl)))))))))ccncsccn85
|
[C][C][C][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=C][N][=C][S][C][=C][N][Ring1][Branch2][Ring1][Branch1]
|
c18cnc2sccn12.c16ccccc1Cl.C17CCCCC1.[C@@H]58C3=O.CCC4.N457.N36
|
Cc1ccccc1NC(=O)[C@H](c1c(Cl)nc2sccn12)N(C)[C@@H]1CCC[C@@H](C)C1
|
Ccccccc6NC=O)[C@H]ccCl)ncsccn85))))))))NC)[C@@H]CCC[C@@H]C)C6
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][S][C][=C][Branch1][C][Cl][N][=C][S][C][=C][N][Ring1][=Branch2][Ring1][Branch1][N][Branch1][C][C][C@@H1][C][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch1]
|
c17c(Cl)nc2sccn12.Cc1ccccc15.[C@@H]16CCC[C@@H](C)C1.C3(=O)[C@@H]47.N46C.N35
|
CCc1ccccc1NC(=O)[C@H](c1cnc2sccn12)N(C)[C@H]1CCC[C@H](C)C1
|
CCcccccc6NC=O)[C@H]ccncsccn85))))))))NC)[C@H]CCC[C@H]C)C6
|
[C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][=C][N][=C][S][C][=C][N][Ring1][Branch2][Ring1][Branch1][N][Branch1][C][C][C@H1][C][C][C][C@H1][Branch1][C][C][C][Ring1][#Branch1]
|
c17cnc2sccn12.c18ccccc15.[C@H]16CCC[C@H](C)C1.C3(=O)[C@@H]47.N46C.CC8.N35
|
CCC1CCC(N(C)[C@H](C(=O)Nc2ccccc2C)c2cnc3sccn23)CC1
|
CCCCCCNC)[C@H]C=O)Ncccccc6C)))))))))ccncsccn85))))))))))CC6
|
[C][C][C][C][C][C][Branch2][Ring2][C][N][Branch1][C][C][C@H1][Branch1][#C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][N][=C][S][C][=C][N][Ring1][Branch2][Ring1][Branch1][C][C][Ring2][Ring1][O]
|
c18cnc2sccn12.C19CCC7CC1.c16ccccc1C.[C@H]58C4=O.N57C.CC9.N46
|
C[C@@H]1CCC[C@H](N(C)[C@@H](C(=O)Nc2ccc(Cl)cc2F)c2cnc3sccn23)C1
|
C[C@@H]CCC[C@H]NC)[C@@H]C=O)NccccCl)cc6F)))))))))ccncsccn85))))))))))C6
|
[C][C@@H1][C][C][C][C@H1][Branch2][Ring2][=Branch1][N][Branch1][C][C][C@@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][F][C][=C][N][=C][S][C][=C][N][Ring1][Branch2][Ring1][Branch1][C][Ring2][Ring1][N]
|
c16ccc(Cl)cc1F.c18cnc2sccn12.C[C@@H]1CCC[C@H]7C1.[C@@H]58C4=O.N57C.N46
|
CCc1ccccc1NC(=O)[C@H](c1cnc2sccn12)N(C)C1(C)CCCCC1
|
CCcccccc6NC=O)[C@H]ccncsccn85))))))))NC)CC)CCCCC6
|
[C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][=C][N][=C][S][C][=C][N][Ring1][Branch2][Ring1][Branch1][N][Branch1][C][C][C][Branch1][C][C][C][C][C][C][C][Ring1][#Branch1]
|
c17cnc2sccn12.c18ccccc16.C15(C)CCCCC1.C3(=O)[C@@H]47.N45C.CC8.N36
|
CSCCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
CSCCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][S][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C41C#N.C7CC5=O.C68=O.CS7
|
CN1CCC[C@H]2[C@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C(N)=O
|
CNCCC[C@H][C@H]6CCN5C=O)CCCC4CC6C6C64CN)=O
|
[C][N][C][C][C][C@H1][C@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][Branch1][C][N][=O]
|
CN1CCC[C@H]2[C@H]1CCN25.C126C3C4C1C1C2C3C417.C56=O.C7(N)=O
|
CSCCCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CSCCCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][S][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C41C.C7CCC5=O.C68=O.CS7
|
C[C@H](C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41CO)S(C)(=O)=O
|
C[C@H]C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CO)))))))))))))))))))))SC)=O)=O
|
[C][C@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O][S][Branch1][C][C][=Branch1][C][=O][=O]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C418.C[C@H](C5=O)S(C)(=O)=O.C67=O.C8O
|
CN(C)C[C@H](O)CC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CNC)C[C@H]O)CC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][N][Branch1][C][C][C][C@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C41C.C7[C@H](O)CC5=O.CN7C.C68=O
|
CC(C)(C)/C=C/C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CCC)C)/C=C/C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][C][Branch1][C][C][Branch1][C][C][/C][=C][/C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C.CC(C)(C)C=8.C=8C5=O.C67=O
|
CC12C3C4C1C1C2C3C41C(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)CNS(N)(=O)=O
|
CCCCC4CC6C6C64C=O)NCC[C@H][C@@H]5CCCN6C=O)CNSN)=O)=O
|
[C][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][N][S][Branch1][C][N][=Branch1][C][=O][=O]
|
N15CC[C@H]2[C@@H]1CCCN26.CC12C3C4C1C1C2C3C418.N7S(N)(=O)=O.C6(=O)C7.C58=O
|
C#CCOCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
C#CCOCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][#C][C][O][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C129C3C4C1C1C2C3C41C.C8C5=O.C#CC7.C69=O.O78
|
CC[C@@H](C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N)[C@@H](C)O
|
CC[C@@H]C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N)))))))))))))))))))))[C@@H]C)O
|
[C][C][C@@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N][C@@H1][Branch1][C][C][O]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C#N.CC[C@@H](C5=O)[C@@H](C)O.C67=O
|
CN(C)CCCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41CO
|
CNC)CCCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CO
|
[C][N][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C419.C7CCC5=O.CN7C.C68=O.C9O
|
CC[C@H](F)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
CC[C@H]F)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C#N.CC[C@H](F)C5=O.C67=O
|
C=C(Cl)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
C=CCl)CCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][=C][Branch1][C][Cl][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C.C=C(Cl)CCC5=O.C67=O
|
CO[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C(N)=O
|
CO[C@H]C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CN)=O
|
[C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][Branch1][C][N][=O]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C419.[C@@H]7(C)C5=O.C68=O.C9(N)=O.CO7
|
CCN(C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41CO
|
CCNC)CCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CO
|
[C][C][N][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O]
|
N15CCC[C@H]2[C@@H]1CCN26.C129C3C4C1C1C2C3C41%10.C8CC5=O.N78C.C69=O.CC7.C%10O
|
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41CN
|
CNCCC[C@@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CN
|
[C][N][C][C][C][C@@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][N]
|
CN1CCC[C@@H]2[C@@H]1CCN25.C126C3C4C1C1C2C3C417.C56=O.C7N
|
O=C(N1CC[C@H]2[C@@H]1CCCN2CCO)C12C3C4C1C1C2C3C41CO
|
O=CNCC[C@H][C@@H]5CCCN6CCO))))))))))))CCCC4CC6C6C64CO
|
[O][=C][Branch1][P][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][C][O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O]
|
N15CC[C@H]2[C@@H]1CCCN26.C127C3C4C1C1C2C3C418.O=C57.C6CO.C8O
|
CC12C3C4C1C1C2C3C41C(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H](F)OC(F)(F)F
|
CCCCC4CC6C6C64C=O)NCC[C@H][C@@H]5CCCN6C=O)[C@@H]F)OCF)F)F
|
[C][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][F][O][C][Branch1][C][F][Branch1][C][F][F]
|
N15CC[C@H]2[C@@H]1CCCN26.CC12C3C4C1C1C2C3C418.C6(=O)[C@H]7F.O7C(F)(F)F.C58=O
|
COCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C(N)=O
|
COCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CN)=O
|
[C][O][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][Branch1][C][N][=O]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C419.C7C5=O.C68=O.C9(N)=O.CO7
|
C=CCCO[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
C=CCCO[C@H]C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][=C][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C129C3C4C1C1C2C3C41C.[C@@H]8(C)C5=O.C=CCC7.C69=O.O78
|
CC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C.CC5=O.C67=O
|
CC[C@H](O)[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
CC[C@H]O)[C@H]C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C#N.CC[C@H](O)[C@H](C)C5=O.C67=O
|
CCCC=CC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C5C3C1C5C42
|
CCCC=CC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCCC4C6C4C68
|
[C][C][C][C][=C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][C][Ring1][=Branch1][C][Ring1][Ring2][C][Ring1][=Branch1][Ring1][Branch2]
|
N16CCC[C@H]2[C@@H]1CCN27.C128C3C4C5C3C1C5C42.CCCC=9.C=9C6=O.C78=O
|
CC[C@@H](CCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C)OC
|
CC[C@@H]CCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C))))))))))))))))))))))OC
|
[C][C][C@@H1][Branch2][Ring2][O][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C41C.CC[C@H]7CCC5=O.C68=O.O7C
|
C=CC[C@H](C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C)C(C)C
|
C=CC[C@H]C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C))))))))))))))))))))CC)C
|
[C][=C][C][C@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][C][Branch1][C][C][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C=CC[C@H](C5=O)C(C)C.C127C3C4C1C1C2C3C41C.C67=O
|
CNS(=O)(=O)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CNS=O)=O)CCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C41C.S7(=O)(=O)CCC5=O.C68=O.CN7
|
CCC=CC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CCC=CC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][C][C][=C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C.C=8C5=O.CCC=8.C67=O
|
C=C/C=C(\C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
C=C/C=C\C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][=C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C.C=8(C)C5=O.C=CC=8.C67=O
|
CC[C@H](C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
CC[C@H]C)CCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][C][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C#N.CC[C@H](C)CCC5=O.C67=O
|
C=C[C@@H](O)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
C=C[C@@H]O)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][=C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C#N.C=C[C@@H](O)C5=O.C67=O
|
COC(=O)C12C3C4C1C1C2C3C41C(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)CC(F)F
|
COC=O)CCCC4CC6C6C64C=O)NCC[C@H][C@@H]5CCCN6C=O)CCF)F
|
[C][O][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][Branch1][C][F][F]
|
N16CC[C@H]2[C@@H]1CCCN27.C128C3C4C1C1C2C3C419.C7(=O)CC(F)F.C58=O.C69=O.CO5
|
CC(C)S[C@@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41CO
|
CCC)S[C@@H]C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CO
|
[C][C][Branch1][C][C][S][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O]
|
N15CCC[C@H]2[C@@H]1CCN26.C129C3C4C1C1C2C3C41%10.[C@H]8(C)C5=O.CC7C.C69=O.S78.C%10O
|
CC12C3C4C1C1C2C3C41C(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)CCCC(F)(F)F
|
CCCCC4CC6C6C64C=O)NCC[C@H][C@@H]5CCCN6C=O)CCCCF)F)F
|
[C][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
N15CC[C@H]2[C@@H]1CCCN26.CC12C3C4C1C1C2C3C417.C6(=O)CCCC(F)(F)F.C57=O
|
CC(C)C[C@H](O)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41CO
|
CCC)C[C@H]O)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CO
|
[C][C][Branch1][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C418.CC(C)C[C@H](O)C5=O.C67=O.C8O
|
CS[C@@H](C)[C@@H](O)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CS[C@@H]C)[C@@H]O)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][S][C@@H1][Branch1][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
N15CCC[C@H]2[C@@H]1CCN26.C128C3C4C1C1C2C3C41C.[C@H]7(C)[C@@H](O)C5=O.C68=O.CS7
|
CC(C)COCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
CCC)COCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][C][Branch1][C][C][C][O][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C129C3C4C1C1C2C3C41C#N.CC(C)C7.C8C5=O.C69=O.O78
|
CC(C)=CC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C5C3C1C5C42
|
CCC)=CC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCCC4C6C4C68
|
[C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][C][Ring1][=Branch1][C][Ring1][Ring2][C][Ring1][=Branch1][Ring1][Branch2]
|
N16CCC[C@H]2[C@@H]1CCN27.C128C3C4C5C3C1C5C42.C=9C6=O.CC=9C.C78=O
|
NC(=O)C12C3C4C1C1C2C3C41C(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)CC(F)(F)Cl
|
NC=O)CCCC4CC6C6C64C=O)NCC[C@H][C@@H]5CCCN6C=O)CCF)F)Cl
|
[N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][Cl]
|
N15CC[C@H]2[C@@H]1CCCN26.C127C3C4C1C1C2C3C418.C6(=O)CC(F)(F)Cl.NC7=O.C58=O
|
CS(=O)(=O)CC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
CS=O)=O)CC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C#N.CS(=O)(=O)CC5=O.C67=O
|
C=CC[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C5C3C1C5C42
|
C=CC[C@H]C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCCC4C6C4C68
|
[C][=C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][C][Ring1][=Branch1][C][Ring1][Ring2][C][Ring1][=Branch1][Ring1][Branch2]
|
N16CCC[C@H]2[C@@H]1CCN27.C128C3C4C5C3C1C5C42.C=CC[C@H](C)C6=O.C78=O
|
CC(=O)NCC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41CO
|
CC=O)NCC=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64CO
|
[C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][O]
|
N16CCC[C@H]2[C@@H]1CCN27.C129C3C4C1C1C2C3C41%10.C8C6=O.CC5=O.C79=O.N58.C%10O
|
CC[C@H](O)[C@@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C#N
|
CC[C@H]O)[C@@H]C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C#N
|
[C][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][#N]
|
N15CCC[C@H]2[C@@H]1CCN26.C127C3C4C1C1C2C3C41C#N.CC[C@H](O)[C@@H](C)C5=O.C67=O
|
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)C12C3C4C1C1C2C3C41C
|
CNCCC[C@@H][C@@H]6CCN5C=O)CCCC4CC6C6C64C
|
[C][N][C][C][C][C@@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C]
|
CN1CCC[C@@H]2[C@@H]1CCN25.C126C3C4C1C1C2C3C41C.C56=O
|
CC12CC(C(=O)N3C[C@H]4C[C@H](CNC(=O)COc5ccc(F)cc5)C[C@H]3C4)(C1)C2
|
CCCCC=O)NC[C@H]C[C@H]CNC=O)COccccF)cc6)))))))))))C[C@H]7C6)))))))))C4)C4
|
[C][C][C][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C@H1][Ring2][Ring1][Ring2][C][Ring2][Ring1][Ring1][Branch1][Branch1][C][Ring2][Ring1][O][C][Ring2][Ring1][N]
|
N16C[C@H]2C[C@H]%12C[C@H]1C2.c19ccc(F)cc1.CC12CC%11(C1)C2.C7(=O)C8.C6%11=O.C%10%12.N7%10.O89
|
O=C(c1ccc(Cl)s1)N1CCC[C@H]([C@H]2CCCN(C(=O)C3(C4CC4)CCC3)C2)C1
|
O=CccccCl)s5)))))NCCC[C@H][C@H]CCCNC=O)CCCC3)))CCC4)))))C6))))))C6
|
[O][=C][Branch1][O][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1][N][C][C][C][C@H1][Branch2][Ring1][=N][C@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][#Branch1][C][Ring1][#C][C][Ring2][Ring1][Branch1]
|
N15CCC[C@H]([C@H]2CCCN6C2)C1.C18(C2CC2)CCC1.c17ccc(Cl)s1.O=C57.C68=O
|
Cc1nn(C)c2nc(O)cc(C(=O)N(CCc3ccccn3)C3CC3)c12
|
CcnnC)cncO)ccC=O)NCCcccccn6))))))))CCC3)))))c96
|
[C][C][=N][N][Branch1][C][C][C][=N][C][Branch1][C][O][=C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][Branch1][O][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][Branch1]
|
Cc1nn(C)c2nc(O)cc7c12.c18ccccn1.C47=O.N456.C5C8.C16CC1
|
C[C@H](CC1CC1)C(=O)N[C@H]1C[C@H](CNC(=O)C[C@@H]2CCNC(=O)C2)C1
|
C[C@H]CCCC3))))C=O)N[C@H]C[C@H]CNC=O)C[C@@H]CCNC=O)C6))))))))))C4
|
[C][C@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring1][S]
|
[C@@H]19CCNC(=O)C1.C[C@H](C7)C3=O.[C@H]16C[C@H]8C1.C4(=O)C9.C17CC1.N36.C58.N45
|
CC[C@@H](CC(=O)N[C@H]1C[C@@H](CNC(=O)C[C@H]2CCNC(=O)C2)C1)C1CC1
|
CC[C@@H]CC=O)N[C@H]C[C@@H]CNC=O)C[C@H]CCNC=O)C6))))))))))C4)))))))CCC3
|
[C][C][C@@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring1][S][C][C][C][Ring1][Ring1]
|
CC[C@H]7CC3=O.[C@H]19CCNC(=O)C1.[C@H]16C[C@@H]8C1.C4(=O)C9.C17CC1.N36.C58.N45
|
CC(C)(CC1CC1)C(=O)NC1CC(CNC(=O)C[C@@H]2CCNC(=O)C2)C1
|
CCC)CCCC3))))C=O)NCCCCNC=O)C[C@@H]CCNC=O)C6))))))))))C4
|
[C][C][Branch1][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring1][S]
|
CC(C)(C7)C3=O.[C@@H]19CCNC(=O)C1.C16CC8C1.C4(=O)C9.C17CC1.N36.C58.N45
|
C[C@H](CC(=O)N[C@H]1C[C@@H](CNC(=O)C[C@@H]2CCNC(=O)C2)C1)C1CC1
|
C[C@H]CC=O)N[C@H]C[C@@H]CNC=O)C[C@@H]CCNC=O)C6))))))))))C4)))))))CCC3
|
[C][C@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring1][S][C][C][C][Ring1][Ring1]
|
[C@@H]19CCNC(=O)C1.C[C@@H]7CC3=O.[C@H]16C[C@@H]8C1.C4(=O)C9.C17CC1.N36.C58.N45
|
CCc1ncncc1C(=O)NCC[C@@H]1COCCN1C(=O)c1ccc[n+]([O-])c1
|
CCcncncc6C=O)NCC[C@@H]COCCN6C=O)cccc[n+][O-])c6
|
[C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][N+1][Branch1][C][O-1][=C][Ring1][#Branch1]
|
c18ncncc15.[C@@H]17COCCN13.c16ccc[n+]([O-])c1.C25=O.C4C7.C36=O.CC8.N24
|
O=C1CCC(C(=O)NC[C@@H]2COCCN2C(=O)Cc2ccn3cncc3c2)=NN1
|
O=CCCCC=O)NC[C@@H]COCCN6C=O)Ccccncncc5c9))))))))))))))))))))=NN6
|
[O][=C][C][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][=C][N][C][=N][C][=C][Ring1][Branch1][C][=Ring1][=Branch2][=N][N][Ring2][Ring1][N]
|
O=C1CCC(C4=O)=NN1.c18ccn2cncc2c1.[C@@H]17COCCN15.C5(=O)C8.N46.C67
|
O=C(COCCc1ccc(Cl)s1)NC[C@H]1CCNC(=O)C1
|
O=CCOCCccccCl)s5)))))))))NC[C@H]CCNC=O)C6
|
[O][=C][Branch1][#C][C][O][C][C][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1][N][C][C@H1][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1]
|
[C@H]17CCNC(=O)C1.c16ccc(Cl)s1.O=C2C3.C4C6.O34.N25.C57
|
O=C1NCCCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc3c(O)n[nH]c3c2)C1
|
O=CNCCCC[C@@H]7C=O)NC[C@H]CCNC=O)cccccO)n[nH]c5c9))))))))))C5
|
[O][=C][N][C][C][C][C][C@@H1][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][Branch1][C][O][=N][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][Ring1][P]
|
c18ccc2c(O)n[nH]c2c1.O=C1NCCCC[C@@H]17.[C@H]19CCN5C1.C47=O.C58=O.N46.C69
|
CN1C[C@H]2OCCN(C(=O)[C@@H]3CCC[C@H]3CNC(=O)CN3CCNC3=O)[C@H]2C1
|
CNC[C@H]OCCNC=O)[C@@H]CCC[C@H]5CNC=O)CNCCNC5=O))))))))))))))))[C@H]6C9
|
[C][N][C][C@H1][O][C][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][N][C][C][N][C][Ring1][Branch1][=O][C@H1][Ring2][Ring1][Branch2][C][Ring2][Ring1][O]
|
CN1C[C@H]2OCCN4[C@H]2C1.[C@@H]17CCC[C@H]19.N18CCNC1=O.C5(=O)C8.C47=O.C69.N56
|
Cc1cc(CCC(=O)N[C@@H]2C[C@@H]3C[C@H]2N(C(=O)c2c(C)cc[nH]c2=N)C3)no1
|
CcccCCC=O)N[C@@H]C[C@@H]C[C@H]5NC=O)ccC)cc[nH]c6=N))))))))C5)))))))))))no5
|
[C][C][=C][C][Branch2][Ring2][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][C][C@H1][Ring1][Branch1][N][Branch1][P][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][NH1][C][Ring1][#Branch1][=N][C][Ring1][#C][=N][O][Ring2][Ring1][O]
|
[C@@H]16C[C@@H]2C[C@H]1N5C2.c17c(C)cc[nH]c1=N.Cc1cc8no1.C8CC4=O.C57=O.N46
|
CC1=CC[C@H](C(=O)NCCCN(CC2CCCC2)C(=O)c2cncs2)CC1
|
CC=CC[C@H]C=O)NCCCNCCCCCC5))))))C=O)ccncs5))))))))))))CC6
|
[C][C][=C][C][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][S][Ring1][Branch1][C][C][Ring2][Ring1][#Branch2]
|
CC1=CC[C@H]9CC1.C1%10CCCC1.c18cncs1.C5CC6.C39=O.N467.C48=O.N35.C7%10
|
COc1ncc(C(=O)N(CCCNC(=O)[C@@H]2CC=C(C)CC2)CC2CCCC2)s1
|
COcnccC=O)NCCCNC=O)[C@@H]CC=CC)CC6)))))))))))CCCCCC5))))))))s5
|
[C][O][C][=N][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][Branch2][Ring1][Ring2][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][=C][Branch1][C][C][C][C][Ring1][#Branch1][C][C][C][C][C][C][Ring1][Branch1][S][Ring2][Ring1][O]
|
[C@@H]1%10CC=C(C)CC1.c15ncc9s1.C1%11CCCC1.C6CC7.C39=O.N368.C4%10=O.CO5.N47.C8%11
|
COc1ncc(C(=O)N(CCCNC(=O)[C@]2(C)CC=CCC2)CC2CCCC2)s1
|
COcnccC=O)NCCCNC=O)[C@]C)CC=CCC6)))))))))))CCCCCC5))))))))s5
|
[C][O][C][=N][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][Branch2][Ring1][Ring2][C][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][=C][C][C][Ring1][#Branch1][C][C][C][C][C][C][Ring1][Branch1][S][Ring2][Ring1][O]
|
[C@@]1%10(C)CC=CCC1.c15ncc9s1.C1%11CCCC1.C6CC7.C39=O.N368.C4%10=O.CO5.N47.C8%11
|
O=C(N[C@H]1CCCc2c[nH]nc21)[C@@H]1[C@H]2CC[C@H](C2)N1C(=O)[C@@H]1C[C@H]2CCC[C@H]2C1
|
O=CN[C@H]CCCcc[nH]nc59))))))))))[C@@H][C@H]CC[C@H]C5)N6C=O)[C@@H]C[C@H]CCC[C@H]5C8
|
[O][=C][Branch1][#C][N][C@H1][C][C][C][C][=C][NH1][N][=C][Ring1][Branch1][Ring1][=Branch2][C@@H1][C@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][Branch1][N][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][C@H1][C][C][C][C@H1][Ring1][Branch1][C][Ring1][Branch2]
|
N3[C@H]1CCCc2c[nH]nc21.[C@@H]15[C@H]2CC[C@H](C2)N14.[C@@H]16C[C@H]2CCC[C@H]2C1.O=C35.C46=O
|
C[C@H](C(=O)N1CC[C@H]2[C@@H](C1)NC(=O)CN2C(=O)c1coc(C2CC2)n1)N1CCC1
|
C[C@H]C=O)NCC[C@H][C@@H]C6)NC=O)CN6C=O)ccocCCC3)))n5))))))))))))))))NCCC4
|
[C][C@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][Branch2][N][C][C][C][Ring1][Ring2]
|
N13CC[C@H]2[C@@H](C1)NC(=O)CN24.c16coc7n1.C[C@@H]5C3=O.N15CCC1.C46=O.C17CC1
|
O=C(NC[C@H]1CCCN1C(=O)c1c[nH]nc1[C@H]1CCCO1)c1cc(C2CC2)[nH]n1
|
O=CNC[C@H]CCCN5C=O)cc[nH]nc5[C@H]CCCO5))))))))))))))))))cccCCC3)))[nH]n5
|
[O][=C][Branch2][Ring1][N][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C@H1][C][C][C][O][Ring1][Branch1][C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][NH1][N][=Ring1][Branch2]
|
[C@H]18CCCN14.c17c[nH]nc19.c16cc%10[nH]n1.[C@H]19CCCO1.O=C36.C47=O.C1%10CC1.N35.C58
|
CN(Cc1ccn(-c2ccccc2)n1)c1cc(NC[C@@H]2C=CCC2)ncn1
|
CNCcccn-cccccc6))))))n5))))))cccNC[C@@H]C=CCC5)))))))ncn6
|
[C][N][Branch2][Ring1][Ring1][C][C][C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=Ring1][O][C][=C][C][Branch1][#Branch2][N][C][C@@H1][C][=C][C][C][Ring1][Branch1][=N][C][=N][Ring1][=N]
|
c15cc6ncn1.c17ccn9n1.c19ccccc1.[C@@H]18C=CCC1.CN35.C37.N46.C48
|
C[C@H]1N(C(=O)Nc2ccccc2OC2CCN(C)CC2)CCC1(C)C
|
C[C@H]NC=O)Ncccccc6OCCCNC)CC6)))))))))))))))CCC5C)C
|
[C][C@H1][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][C][C][Ring2][Ring1][=Branch1][Branch1][C][C][C]
|
C[C@H]1N3CCC1(C)C.c17ccccc16.C15CCN(C)CC1.C34=O.N47.O56
|
CNC[C@@H]1CCN(C(=O)Nc2cc(Cl)ccc2OC2CCN(C)CC2)C1
|
CNC[C@@H]CCNC=O)NcccCl)ccc6OCCCNC)CC6)))))))))))))))C5
|
[C][N][C][C@@H1][C][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][#Branch1]
|
c18cc(Cl)ccc16.C15CCN(C)CC1.[C@@H]19CCN3C1.C34=O.CN7.C79.N48.O56
|
CC[C@@H]1[C@H](CO)CCN1C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1
|
CC[C@@H][C@H]CO))CCN5C=O)NcccCl)ccc6OCCCNC)CC6
|
[C][C][C@@H1][C@H1][Branch1][Ring1][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1]
|
c16cc(Cl)ccc15.[C@@H]17[C@H]8CCN12.C14CCN(C)CC1.C23=O.CC7.C8O.N36.O45
|
CN1CCC(Oc2ccc(Cl)cc2NC(=O)N2CC[C@@](O)(C(F)(F)F)C2)CC1
|
CNCCCOccccCl)cc6NC=O)NCC[C@@]O)CF)F)F))C5))))))))))))))CC6
|
[C][N][C][C][C][Branch2][Ring2][=Branch1][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][O][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][#Branch2][C][C][Ring2][Ring1][O]
|
c16ccc(Cl)cc17.CN1CCC5CC1.N14CC[C@]8(O)C1.C8(F)(F)F.C34=O.O56.N37
|
CN1CCC(Oc2ccc(Cl)cc2NC(=O)N2CCC[C@@H]2CS(C)(=O)=O)CC1
|
CNCCCOccccCl)cc6NC=O)NCCC[C@@H]5CSC)=O)=O)))))))))))))))))CC6
|
[C][N][C][C][C][Branch2][Ring2][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring2][Ring1][O]
|
c16ccc(Cl)cc17.CN1CCC5CC1.N14CCC[C@@H]18.C8S(C)(=O)=O.C34=O.O56.N37
|
CN1CCC(Oc2ccc(Cl)cc2NC(=O)N2CC(F)(F)C[C@@H]2CC(N)=O)CC1
|
CNCCCOccccCl)cc6NC=O)NCCF)F)C[C@@H]5CCN)=O)))))))))))))))))CC6
|
[C][N][C][C][C][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][C@@H1][Ring1][#Branch1][C][C][Branch1][C][N][=O][C][C][Ring2][Ring1][N]
|
c16ccc(Cl)cc17.N14CC(F)(F)C[C@@H]18.CN1CCC5CC1.C8C(N)=O.C34=O.O56.N37
|
C[C@@H]1[C@H](CO)CCN1C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1
|
C[C@@H][C@H]CO))CCN5C=O)NcccCl)ccc6OCCCNC)CC6
|
[C][C@@H1][C@H1][Branch1][Ring1][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1]
|
c16cc(Cl)ccc15.C[C@@H]1[C@H]7CCN12.C14CCN(C)CC1.C23=O.C7O.N36.O45
|
CN1CCC(Oc2ccc(Cl)cc2NC(=O)N2C[C@H](S(C)(=O)=O)CC2(C)C)CC1
|
CNCCCOccccCl)cc6NC=O)NC[C@H]SC)=O)=O))CC5C)C)))))))))))))))CC6
|
[C][N][C][C][C][Branch2][Ring2][#Branch1][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][C][C@H1][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][=Branch2][Branch1][C][C][C][C][C][Ring2][Ring1][N]
|
N14C[C@H](S(C)(=O)=O)CC1(C)C.c16ccc(Cl)cc17.CN1CCC5CC1.C34=O.O56.N37
|
CN1CCC(Oc2ccc(Cl)cc2NC(=O)N2CC[C@](C)(CO)C2)CC1
|
CNCCCOccccCl)cc6NC=O)NCC[C@]C)CO))C5))))))))))))))CC6
|
[C][N][C][C][C][Branch2][Ring1][S][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][Branch1][Ring1][C][O][C][Ring1][Branch2][C][C][Ring2][Ring1][=Branch2]
|
c16ccc(Cl)cc17.CN1CCC5CC1.N14CC[C@@]8(C)C1.C34=O.O56.N37.C8O
|
CCO[C@H]1CCN(C(=O)Nc2ccccc2OC2CCN(C)CC2)C1
|
CCO[C@H]CCNC=O)Ncccccc6OCCCNC)CC6)))))))))))))))C5
|
[C][C][O][C@H1][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][=Branch1]
|
c19ccccc18.C17CCN(C)CC1.[C@H]16CCN3C1.C34=O.CC5.O56.N49.O78
|
COC[C@H]1CCN(C(=O)Nc2cc(Cl)ccc2OC2CCN(C)CC2)C1
|
COC[C@H]CCNC=O)NcccCl)ccc6OCCCNC)CC6)))))))))))))))C5
|
[C][O][C][C@H1][C][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][#Branch1]
|
c18cc(Cl)ccc17.C16CCN(C)CC1.[C@H]19CCN3C1.C34=O.CO5.C59.N48.O67
|
CO[C@@H]1C[C@@H](CN)N(C(=O)Nc2cc(Cl)ccc2OC2CCN(C)CC2)C1
|
CO[C@@H]C[C@@H]CN))NC=O)NcccCl)ccc6OCCCNC)CC6)))))))))))))))C5
|
[C][O][C@@H1][C][C@@H1][Branch1][Ring1][C][N][N][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][=Branch2]
|
c18cc(Cl)ccc17.[C@@H]15C[C@@H]9N3C1.C16CCN(C)CC1.C34=O.CO5.C9N.N48.O67
|
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