SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
O=C(/C=C/c1ccc2occc2c1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccsc1
|
O=C/C=C/ccccoccc5c9)))))))))))N[C@@H]C[C@H]CC[C@@H]6N5C=O)cccsc5
|
[O][=C][Branch1][S][/C][=C][/C][=C][C][=C][O][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][N][C@@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1]
|
C=7c1ccc2occc2c1.[C@@H]15C[C@H]2CC[C@@H]1N24.c16ccsc1.O=C3C=7.C46=O.N35
|
COC[C@@H](OC)C(=O)N[C@H]1CC[C@@H](NC(=O)c2cnc(C)nc2)CC1
|
COC[C@@H]OC))C=O)N[C@H]CC[C@@H]NC=O)ccncC)nc6))))))))CC6
|
[C][O][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C][C][Ring1][S]
|
[C@H]17CC[C@@H]8CC1.c19cnc(C)nc1.C5[C@@H]6C3=O.C49=O.CO5.O6C.N37.N48
|
O=C([C@H]1CCN(C2CC2)C1=O)N1CC2(C1)CN(C(=O)C1(F)CCCC1)C[C@H]2CO
|
O=C[C@H]CCNCCC3)))C5=O))))))NCCC4)CNC=O)CF)CCCC5))))))C[C@H]5CO
|
[O][=C][Branch1][S][C@H1][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][Branch2][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][C][F][C][C][C][C][Ring1][=Branch1][C][C@H1][Ring1][=C][C][O]
|
N13CC2(C1)CN4C[C@H]27.[C@H]15CCN8C1=O.C16(F)CCCC1.O=C35.C18CC1.C46=O.C7O
|
Cc1ncc(CC(=O)NCC(=O)NC[C@H]2CCOC[C@H]2C)s1
|
CcnccCC=O)NCC=O)NC[C@H]CCOC[C@H]6C))))))))))))))s5
|
[C][C][=N][C][=C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][C][O][C][C@H1][Ring1][=Branch1][C][S][Ring2][Ring1][Branch1]
|
[C@H]18CCOC[C@H]1C.Cc1ncc7s1.C7C3=O.C5C4=O.N35.N46.C68
|
CO[C@@H](CNC(=O)Cc1ccnnc1)Cn1cc(C[C@H](C)O)nn1
|
CO[C@@H]CNC=O)Ccccnnc6))))))))))CnccC[C@H]C)O)))nn5
|
[C][O][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][=C][C][=N][N][=C][Ring1][=Branch1][C][N][C][=C][Branch1][#Branch1][C][C@H1][Branch1][C][C][O][N][=N][Ring1][=Branch2]
|
c17ccnnc1.n15cc6nn1.[C@H]3(C4)C5.C2(=O)C7.C6[C@H](C)O.CO3.N24
|
CN(CCCCNC(=O)c1cnn(C2CCCCC2)c1)C(=O)c1ccc[n+]([O-])c1
|
CNCCCCNC=O)ccnnCCCCCC6))))))c5)))))))))))C=O)cccc[n+][O-])c6
|
[C][N][Branch2][Ring1][O][C][C][C][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][=Ring1][O][C][=Branch1][C][=O][C][=C][C][=C][N+1][Branch1][C][O-1][=C][Ring1][#Branch1]
|
c18ccc[n+]([O-])c1.c17cnn9c1.C19CCCCC1.C5CCC6.CN45.C37=O.C48=O.N36
|
CC[C@@H](CC(=O)N[C@H](CCNC(=O)c1cnc(O)c2cccnc12)C(C)C)OC
|
CC[C@@H]CC=O)N[C@H]CCNC=O)ccncO)ccccnc%106))))))))))))))CC)C))))))OC
|
[C][C][C@@H1][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][=Branch2][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][C][=C][C][=C][N][=C][Ring1][O][Ring1][=Branch1][C][Branch1][C][C][C][O][C]
|
c18cnc(O)c2cccnc12.CC[C@H]5CC3=O.[C@@H]6(CC7)C(C)C.C48=O.N36.N47.O5C
|
Cc1nccc(C(=O)N[C@H]2CCCN(C(=O)c3cc(O)cc(N)c3Cl)[C@@H]2C)c1C
|
CcncccC=O)N[C@H]CCCNC=O)cccO)ccN)c6Cl))))))))[C@@H]6C)))))))))c6C
|
[C][C][=N][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][N][=C][Ring1][Branch2][Cl][C@@H1][Ring1][P][C][=C][Ring2][Ring1][O][C]
|
c18cc(O)cc(N)c1Cl.Cc1nccc7c1C.[C@H]16CCCN5[C@@H]1C.C47=O.C58=O.N46
|
C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1C[C@H](NC(=O)CC2(C)CC(F)(F)C2)[C@@H](O)C1
|
C[C@@H]Ccccccn6)))))))C=O)N[C@@H]C[C@H]NC=O)CCC)CCF)F)C4)))))))[C@@H]O)C5
|
[C][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C@@H1][Branch1][C][O][C][Ring1][P]
|
[C@@H]15C[C@H]6[C@@H](O)C1.C18(C)CC(F)(F)C1.C[C@@H](C7)C3=O.c17ccccn1.C4(=O)C8.N35.N46
|
C[C@@H]1CN(C)C[C@H]1C(=O)NC(C)(C)CNC(=O)C12CC(C)(C1)O[C@@H]2C
|
C[C@@H]CNC)C[C@H]5C=O)NCC)C)CNC=O)CCCC)C4)O[C@@H]5C
|
[C][C@@H1][C][N][Branch1][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][Ring2][C][Ring1][Branch1][O][C@@H1][Ring1][#Branch1][C]
|
C128CC(C)(C1)O[C@@H]2C.C[C@@H]1CN(C)C[C@H]17.C5(C)(C)C6.C37=O.C48=O.N35.N46
|
O=C(NCCCN1CCCC1=O)[C@@H]1CCCN1C(=O)COc1ccccc1F
|
O=CNCCCNCCCC5=O))))))))))[C@@H]CCCN5C=O)COcccccc6F
|
[O][=C][Branch1][=N][N][C][C][C][N][C][C][C][C][Ring1][Branch1][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F]
|
c15ccccc1F.N18CCCC1=O.[C@@H]17CCCN13.C6CC8.C3(=O)C4.O=C27.N26.O45
|
Cc1sccc1C(=O)N1CC[C@H](CO)[C@H](NC(=O)[C@H]2CC[C@@H](N=[N+]=[N-])CC2)CC1
|
Ccsccc5C=O)NCC[C@H]CO))[C@H]NC=O)[C@H]CC[C@@H]N=[N+]=[N-])))CC6))))))))CC7
|
[C][C][S][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][Ring1][C][O][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][C@@H1][Branch1][Ring2][N][=N+1][=N-1][C][C][Ring1][=Branch2][C][C][Ring2][Ring1][Branch1]
|
N13CC[C@@H]5[C@@H]8CC1.[C@H]16CC[C@@H](N=[N+]=[N-])CC1.Cc1sccc17.C37=O.C46=O.C8O.N45
|
Cc1nc(C=CC(=O)N2CC[C@](F)(CNC(=O)[C@@H](C3CC3)N(C)C)C2)cs1
|
CcncC=CC=O)NCC[C@]F)CNC=O)[C@@H]CCC3)))NC)C))))))C5))))))))cs5
|
[C][C][=N][C][Branch2][Ring2][#Branch1][C][=C][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][F][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][C][Ring1][P][=C][S][Ring2][Ring1][#Branch2]
|
Cc1nc(C=8)cs1.N14CC[C@@]9(F)C1.C5(=O)[C@H]7%10.C=8C4=O.C1%10CC1.N7(C)C.C69.N56
|
CCC[C@H](O)C(=O)N1C[C@H]2C(CNC(=O)c3ccccc3SC(F)F)[C@@H]2C1
|
CCC[C@H]O)C=O)NC[C@H]CCNC=O)cccccc6SCF)F))))))))))))[C@@H]3C6
|
[C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@H1][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][Branch1][C][F][F][C@@H1][Ring1][P][C][Ring2][Ring1][Ring2]
|
CCC[C@H](O)C4=O.N14C[C@H]2C8[C@@H]2C1.c17ccccc19.S9C(F)F.C57=O.C68.N56
|
C#CCN(CCOC)C(=O)NC1[C@@H](C)CC[C@@H]1C
|
C#CCNCCOC))))C=O)NC[C@@H]C)CC[C@@H]5C
|
[C][#C][C][N][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C][C@@H1][Ring1][=Branch1][C]
|
C17[C@@H](C)CC[C@@H]1C.C#CC5.N256.C6C4.C23=O.O4C.N37
|
C[C@@H]1C[C@@H](CNC(=O)[C@H](F)OC(F)(F)F)CN(C(=O)CC2CC(F)(F)C2)C1
|
C[C@@H]C[C@@H]CNC=O)[C@H]F)OCF)F)F)))))))CNC=O)CCCCF)F)C4))))))C6
|
[C][C@@H1][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][O][C][Branch1][C][F][Branch1][C][F][F][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
C[C@@H]1C[C@@H]7CN4C1.C18CC(F)(F)C1.C3(=O)[C@@H]5F.O5C(F)(F)F.C4(=O)C8.C67.N36
|
CCCCN(CCOC)C(=O)CCCCCCNC(=O)c1nnsc1N
|
CCCCNCCOC))))C=O)CCCCCCNC=O)cnnsc5N
|
[C][C][C][C][N][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][N][=N][S][C][=Ring1][Branch1][N]
|
C2(=O)CCCCCC7.c18nnsc1N.CCCC5.N256.C6C4.C38=O.O4C.N37
|
C[C@@]1(CNC(=O)C[C@H]2C[C@@H]3C[C@@H]3C2)CCN(C(=O)Cn2ncccc2=O)C1
|
C[C@@]CNC=O)C[C@H]C[C@@H]C[C@@H]3C6))))))))))CCNC=O)Cnncccc6=O)))))))))C5
|
[C][C@@][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][N][=C][C][=C][C][Ring1][=Branch1][=O][C][Ring2][Ring1][#Branch2]
|
C[C@@]18CCN5C1.n17ncccc1=O.[C@H]19C[C@@H]2C[C@@H]2C1.C4(=O)C9.C5(=O)C7.C68.N46
|
Cc1cnc(CC(=O)NC[C@H]2C[C@@H]2NC(=O)C(C)(C)c2ccc(Cl)cc2Cl)o1
|
CccncCC=O)NC[C@H]C[C@@H]3NC=O)CC)C)ccccCl)cc6Cl)))))))))))))))))o5
|
[C][C][=C][N][=C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][O][Ring2][Ring1][O]
|
c19ccc(Cl)cc1Cl.Cc1cnc7o1.C4(=O)C9(C)C.C7C3=O.[C@H]18C[C@@H]16.N35.C58.N46
|
CC[C@@H]1CN(Cc2ccccc2P(c2ccccc2)c2ccccc2)CC(=O)N1
|
CC[C@@H]CNCcccccc6Pcccccc6))))))cccccc6))))))))))))))CC=O)N6
|
[C][C][C@@H1][C][N][Branch2][Ring1][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][P][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring2][Ring1][O]
|
c15ccccc1P(c1ccccc1)c1ccccc1.[C@@H]14CN3CC(=O)N1.CC4.C35
|
CC1(C)CN(C(=O)C2OCCO2)CC[C@@H]1NC(=O)c1csc2cc(Cl)ccc12
|
CCC)CNC=O)COCCO5))))))CC[C@@H]6NC=O)ccscccCl)ccc96
|
[C][C][Branch1][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][O][C][C][O][Ring1][Branch1][C][C][C@@H1][Ring1][=C][N][C][=Branch1][C][=O][C][=C][S][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1]
|
c17csc2cc(Cl)ccc12.CC1(C)CN3CC[C@@H]15.C16OCCO1.C36=O.C47=O.N45
|
C[C@@H]1COC[C@H](C(=O)N2CCCC[C@@H](C(=O)N[C@@H](CO)CCO)C2)O1
|
C[C@@H]COC[C@H]C=O)NCCCC[C@@H]C=O)N[C@@H]CO))CCO))))))C7))))))))O6
|
[C][C@@H1][C][O][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Branch1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][C][O][C][Ring1][S][O][Ring2][Ring1][Branch2]
|
N13CCCC[C@@H]7C1.C[C@@H]1COC[C@H]6O1.[C@H]5(CO)CCO.C36=O.C47=O.N45
|
COCC(=O)N[C@@H]1C[C@H]2CN(C(=O)c3cc4sccc4cn3)C[C@H]21
|
COCC=O)N[C@@H]C[C@H]CNC=O)cccsccc5cn9))))))))))C[C@H]57
|
[C][O][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][S][C][=C][C][=Ring1][Branch1][C][=N][Ring1][=Branch2][C][C@H1][Ring1][S][Ring2][Ring1][C]
|
c19cc2sccc2cn1.[C@@H]18C[C@H]2CN6C[C@H]21.C7C5=O.C69=O.CO7.N58
|
CN(C(=O)CCn1cc(C#N)c(O)nc1=O)[C@H]1CCN(C(=O)C2=CCSC2)C1
|
CNC=O)CCnccC#N))cO)nc6=O))))))))))[C@H]CCNC=O)C=CCSC5))))))C5
|
[C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][Ring1][C][#N][C][Branch1][C][O][=N][C][Ring1][=Branch2][=O][C@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][S][C][Ring1][Branch1][C][Ring1][N]
|
n16cc(C#N)c(O)nc1=O.C4(=O)C1=CCSC1.[C@H]15CCN4C1.C3(=O)CC6.CN35
|
CCn1cc(Br)c(C(=O)N2C[C@@H](C)[C@H](NC(=O)c3ccc4ccnn4c3)C2)n1
|
CCnccBr)cC=O)NC[C@@H]C)[C@H]NC=O)ccccccnn5c9)))))))))))C5))))))n5
|
[C][C][N][C][=C][Branch1][C][Br][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=N][N][Ring1][Branch1][C][=Ring1][=Branch2][C][Ring2][Ring1][C][=N][Ring2][Ring1][#Branch2]
|
c19ccc2ccnn2c1.n1%10cc(Br)c8n1.N15C[C@@H]7[C@H](C)C1.C58=O.C69=O.CC%10.N67
|
Cc1ccc2c(C(=O)N(CCN(C)C(=O)[C@@H](C)CO)C(C)C)c[nH]c2c1
|
CcccccC=O)NCCNC)C=O)[C@@H]C)CO)))))))CC)C))))c[nH]c5c9
|
[C][C][=C][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][Branch1][P][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][O][C][Branch1][C][C][C][=C][NH1][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][=Branch2]
|
Cc1ccc2c8c[nH]c2c1.C4(=O)[C@@H](C)CO.C38=O.N357.C5C6.N46C.C7(C)C
|
Cn1nncc1CC(=O)N[C@@]1(C)CCCN(C(=O)C2CCC3(CC2)CC(O)C3)C1
|
Cnnncc5CC=O)N[C@@]C)CCCNC=O)CCCCCC6))CCO)C4))))))))C6
|
[C][N][N][=N][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@@][Branch1][C][C][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][C][O][C][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
C17CCC2(CC1)CC(O)C2.[C@]16(C)CCCN5C1.Cn1nncc18.C8C4=O.C57=O.N46
|
COc1cccc(NC(=O)[C@H]2CCCCN(C(=O)C[C@H]3CCOC3(C)C)C2)c1
|
COcccccNC=O)[C@H]CCCCNC=O)C[C@H]CCOC5C)C))))))))C7)))))))))c6
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@H1][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C@H1][C][C][O][C][Ring1][Branch1][Branch1][C][C][C][C][Ring1][P][=C][Ring2][Ring1][#Branch2]
|
[C@H]18CCCCN5C1.c16cccc7c1.[C@H]19CCOC1(C)C.C5(=O)C9.C48=O.CO6.N47
|
Cc1ccccc1C(C)(C)CNC(=O)NCC[C@H]1CNC(=O)C1
|
Ccccccc6CC)C)CNC=O)NCC[C@H]CNC=O)C5
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][N][C][C][C@H1][C][N][C][=Branch1][C][=O][C][Ring1][=Branch1]
|
Cc1ccccc17.[C@H]16CNC(=O)C1.C7(C)(C)C4.C23=O.C5C6.N24.N35
|
COC[C@@H]1CN(C(=O)[C@H](F)[C@@H](C)CNC(=O)Cc2cccc(C#N)c2)C1(C)C
|
COC[C@@H]CNC=O)[C@H]F)[C@@H]C)CNC=O)CcccccC#N))c6)))))))))))))C4C)C
|
[C][O][C][C@@H1][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@H1][Branch1][C][F][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C][Ring2][Ring1][#Branch1][Branch1][C][C][C]
|
C3(=O)[C@H](F)[C@@H](C)C6.c18cccc(C#N)c1.[C@@H]17CN3C1(C)C.C4(=O)C8.CO5.C57.N46
|
COc1cc(C(=O)N2CCCC[C@H](NC(=O)c3coc(C)c3)C2)cc([N+](=O)[O-])c1
|
COcccC=O)NCCCC[C@H]NC=O)ccocC)c5)))))))C7))))))))cc[N+]=O)[O-]))c6
|
[C][O][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][Ring1][S][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring2][Ring1][O]
|
c16cc8cc([N+](=O)[O-])c1.N14CCCC[C@H]7C1.c19coc(C)c1.C48=O.C59=O.CO6.N57
|
C[C@@H]1C[C@H](C(=O)NCc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)CC(=O)N1
|
C[C@@H]C[C@H]C=O)NCcccccc6)CCCN6C=O)OCC)C)C))))))))))))))))CC=O)N6
|
[C][C@@H1][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][Ring2][Ring1][N]
|
c1%10ccc2c(c1)CCCN26.C[C@@H]1C[C@H]9CC(=O)N1.C7(C)(C)C.C59=O.C46=O.N58.C8%10.O47
|
COC(=O)[C@@H]1CC[C@@H]1C(=O)N1CCN(C(=O)c2cc(CO)on2)C[C@@H](O)C1
|
COC=O)[C@@H]CC[C@@H]4C=O)NCCNC=O)cccCO))on5))))))C[C@@H]O)C7
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][Branch1][Ring1][C][O][O][N][=Ring1][#Branch1][C][C@@H1][Branch1][C][O][C][Ring1][P]
|
N14CCN5C[C@@H](O)C1.c16cc9on1.[C@@H]17CC[C@@H]18.C37=O.C48=O.C56=O.CO3.C9O
|
CCO[C@@H](CN(Cc1ccc(C)o1)C[C@@H]1CCCO1)C1CCOCC1
|
CCO[C@@H]CNCccccC)o5))))))C[C@@H]CCCO5))))))))CCCOCC6
|
[C][C][O][C@@H1][Branch2][Ring1][Branch2][C][N][Branch1][N][C][C][=C][C][=C][Branch1][C][C][O][Ring1][=Branch1][C][C@@H1][C][C][C][O][Ring1][Branch1][C][C][C][O][C][C][Ring1][=Branch1]
|
c18ccc(C)o1.C19CCOCC1.[C@@H]17CCCO1.[C@@H]39C4.N456.CC2.O23.C58.C67
|
COC(=O)[C@@H]1C[C@@H](C)N1C(=O)[C@H]1CC12CC(NC(=O)C1(OC(C)=O)CC1)C2
|
COC=O)[C@@H]C[C@@H]C)N4C=O)[C@H]CC3CCNC=O)COCC)=O)))CC3)))))C4
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][C][Ring1][#Branch1][C][Ring1][=C]
|
[C@H]1%10CC12CC8C2.[C@@H]19C[C@@H](C)N15.C17%11CC1.C39=O.C5%10=O.C6%11=O.C4(C)=O.CO3.N68.O47
|
COCCN(Cc1ccnn1C)C(=O)NCc1c(C)sc(C)c1Br
|
COCCNCcccnn5C)))))))C=O)NCccC)scC)c5Br
|
[C][O][C][C][N][Branch1][#Branch2][C][C][=C][C][=N][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][=C][Branch1][C][C][S][C][Branch1][C][C][=C][Ring1][#Branch1][Br]
|
c19c(C)sc(C)c1Br.c18ccnn1C.C4C5.N256.C23=O.CO4.C68.N37.C79
|
C[C@H](C(=O)N[C@@H]1CN(C(=O)c2nocc2C2CC2)CC12CCC2)N1CCOCC1
|
C[C@H]C=O)N[C@@H]CNC=O)cnocc5CCC3)))))))))CC5CCC4))))))))))NCCOCC6
|
[C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][O][C][=C][Ring1][Branch1][C][C][C][Ring1][Ring1][C][C][Ring1][#C][C][C][C][Ring1][Ring2][N][C][C][O][C][C][Ring1][=Branch1]
|
[C@@H]16CN4CC12CCC2.c17nocc18.N15CCOCC1.C[C@@H]5C3=O.C47=O.C18CC1.N36
|
CCCC[C@@H](C)CCC(=O)NCCC(C)(C)CNC(=O)[C@]1(C)CCCS1
|
CCCC[C@@H]C)CCC=O)NCCCC)C)CNC=O)[C@]C)CCCS5
|
[C][C][C][C][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][S][Ring1][=Branch1]
|
CCCC[C@@H](C)CCC2=O.C4CC(C)(C)C5.[C@@]16(C)CCCS1.C36=O.N24.N35
|
C[C@H]1CC[C@H]1C(=O)N1CCN(S(=O)(=O)C2CN(C(=O)C(N)=O)C2)CC1
|
C[C@H]CC[C@H]4C=O)NCCNS=O)=O)CCNC=O)CN)=O)))C4)))))CC6
|
[C][C@H1][C][C][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][N][=O][C][Ring1][=Branch2][C][C][Ring2][Ring1][C]
|
S5(=O)(=O)C1CN4C1.N13CCN5CC1.C[C@H]1CC[C@H]16.C4(=O)C(N)=O.C36=O
|
CCOc1ccnc(N2C[C@H](O)C[C@H]2C(=O)Nc2ccc(CC#N)cc2)n1
|
CCOcccncNC[C@H]O)C[C@H]5C=O)NccccCC#N)))cc6)))))))))))))n6
|
[C][C][O][C][=C][C][=N][C][Branch2][Ring1][=N][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][Ring2][C][C][#N][C][=C][Ring1][=Branch2][=N][Ring2][Ring1][Branch2]
|
c15ccnc6n1.N16C[C@H](O)C[C@H]18.c17ccc9cc1.C38=O.C9C#N.CC4.O45.N37
|
C[C@](CO)(NC(=O)C/C=C/CNC(=O)c1c[nH]c(=O)cn1)C(F)(F)F
|
C[C@]CO))NC=O)C/C=C/CNC=O)cc[nH]c=O)cn6))))))))))))))CF)F)F
|
[C][C@][Branch1][Ring1][C][O][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][/C][=C][/C][N][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=O][C][=N][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
C[C@@]4(CO)C(F)(F)F.c16c[nH]c(=O)cn1.C2(=O)CC=7.C=7C5.C36=O.N24.N35
|
CC[C@@H](CNC(=O)c1ccno1)NC(=O)CCCCN1CCCC1
|
CC[C@@H]CNC=O)cccno5))))))))NC=O)CCCCNCCCC5
|
[C][C][C@@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][=C][C][=N][O][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][C][N][C][C][C][C][Ring1][Branch1]
|
C3(=O)CCCC6.CC[C@H]4C5.c17ccno1.N16CCCC1.C27=O.N25.N34
|
C#CC[C@@](C)(CC)C(=O)NCCCN(CC)C(=O)C[C@](C)(O)CCC
|
C#CC[C@@]C)CC))C=O)NCCCNCC))C=O)C[C@]C)O)CCC
|
[C][#C][C][C@@][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][C@][Branch1][C][C][Branch1][C][O][C][C][C]
|
C#CC[C@@](C)(CC)C1=O.C2(=O)C[C@](C)(O)CCC.C3CC4.N245.N13.C5C
|
CC1(NC(=O)[C@@H]2COCC(C)(C)O2)CCN(C(=O)[C@@H]2CCC(=O)NC2)CC1
|
CCNC=O)[C@@H]COCCC)C)O6))))))))CCNC=O)[C@@H]CCC=O)NC6)))))))CC6
|
[C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][C][O][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][C][C][Ring2][Ring1][#Branch2]
|
CC15CCN4CC1.[C@@H]16COCC(C)(C)O1.[C@@H]17CCC(=O)NC1.C36=O.C47=O.N35
|
CCOCCN(CCOCC)C(=O)Nc1cc(N2CCOCC2)ccc1[N+](=O)[O-]
|
CCOCCNCCOCC)))))C=O)NcccNCCOCC6))))))ccc6[N+]=O)[O-]
|
[C][C][O][C][C][N][Branch1][=Branch1][C][C][O][C][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=C][C][=C][Ring1][N][N+1][=Branch1][C][=O][O-1]
|
c1%12cc4ccc1[N+](=O)[O-].N14CCOCC1.C7C%10.N3%10%11.C%11C8.C35=O.CC6.O67.O89.C9C.N5%12
|
CN(C(=O)CCOCc1ccccc1)[C@H](CNC(=O)C=Cc1cccs1)C1CC1
|
CNC=O)CCOCcccccc6)))))))))))[C@H]CNC=O)C=Cccccs5))))))))))CCC3
|
[C][N][Branch1][P][C][=Branch1][C][=O][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][S][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
c1%10ccccc1.C=8c1cccs1.C2(=O)CC4.[C@H]69C7.C3(=O)C=8.CN26.C19CC1.O45.C5%10.N37
|
CCN(C(=O)c1cc2sc(C)cc2s1)[C@H](C)CNC(=O)CCCc1ccccc1
|
CCNC=O)cccscC)cc5s8)))))))))[C@H]C)CNC=O)CCCcccccc6
|
[C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][S][C][Branch1][C][C][=C][C][=Ring1][=Branch1][S][Ring1][=Branch2][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
c18cc2sc(C)cc2s1.C4(=O)CCC9.c19ccccc1.[C@@H]6(C)C7.N356.C38=O.CC5.N47
|
Cc1c(C(=O)NCCOCCNC(=O)c2coc(Cl)n2)nn(C)c1C1CC1
|
CccC=O)NCCOCCNC=O)ccocCl)n5))))))))))))))nnC)c5CCC3
|
[C][C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][O][C][C][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][Cl][=N][Ring1][=Branch1][=N][N][Branch1][C][C][C][=Ring2][Ring1][#Branch1][C][C][C][Ring1][Ring1]
|
Cc1c9nn(C)c1%11.c1%10coc(Cl)n1.C39=O.C7C5.C6C8.C4%10=O.C1%11CC1.N37.O56.N48
|
Cn1ccc(C(=O)N2CC[C@@H]3C[C@H](CNC(=O)C45CC4C5)CC[C@@H]3C2)n1
|
CncccC=O)NCC[C@@H]C[C@H]CNC=O)CCC3C4)))))))CC[C@@H]6C%10)))))))))))n5
|
[C][N][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C@@H1][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][Ring1][Ring2][C][C][C@@H1][Ring1][=C][C][Ring2][Ring1][C][=N][Ring2][Ring1][=Branch2]
|
N16CC[C@@H]2C[C@H]%11CC[C@@H]2C1.Cn1ccc9n1.C12%10CC1C2.C69=O.C7%10=O.C8%11.N78
|
CC(C)[C@@H](CCNC(=O)C1=CCCOC1)NC(=O)CCn1cccn1
|
CCC)[C@@H]CCNC=O)C=CCCOC6))))))))))NC=O)CCncccn5
|
[C][C][Branch1][C][C][C@@H1][Branch1][S][C][C][N][C][=Branch1][C][=O][C][=C][C][C][O][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][N][C][=C][C][=N][Ring1][Branch1]
|
C2(=O)C1=CCCOC1.CC(C)[C@H]4CC5.C3(=O)CC6.n16cccn1.N25.N34
|
COCCCCCC(=O)N[C@H](Cc1ccccn1)C(=O)O
|
COCCCCCC=O)N[C@H]Ccccccn6)))))))C=O)O
|
[C][O][C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][O]
|
C3CCCCC2=O.[C@@H]4(C5)C(=O)O.c15ccccn1.CO3.N24
|
C[C@@H]1CC[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)CN1C(=O)C1=CCCC1
|
C[C@@H]CC[C@@H]NC=O)ccccCC)F)F))nc6))))))))CN6C=O)C=CCCC5
|
[C][C@@H1][C][C][C@@H1][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][F][F][N][=C][Ring1][#Branch2][C][N][Ring2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Branch1]
|
C[C@@H]1CC[C@@H]5CN14.c16ccc7nc1.C4(=O)C1=CCCC1.C7(C)(F)F.C36=O.N35
|
C[C@@H](CNC(=O)[C@@H](C)CC(F)F)NC(=O)c1cc(C(F)F)ccn1
|
C[C@@H]CNC=O)[C@@H]C)CCF)F)))))))NC=O)cccCF)F))ccn6
|
[C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][Branch1][C][F][F][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=C][C][=N][Ring1][=Branch2]
|
C2(=O)[C@@H](C)CC(F)F.c16cc7ccn1.C[C@H]4C5.C36=O.C7(F)F.N25.N34
|
COCC(C)(C)C(=O)N[C@H]1C[C@@H](OCC(=O)N[C@H]2CC[C@@H](N=[N+]=[N-])CC2)C1
|
COCCC)C)C=O)N[C@H]C[C@@H]OCC=O)N[C@H]CC[C@@H]N=[N+]=[N-])))CC6))))))))))C4
|
[C][O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Branch1][O][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch1][Ring2][N][=N+1][=N-1][C][C][Ring1][=Branch2][C][Ring2][Ring1][C]
|
[C@H]19CC[C@@H](N=[N+]=[N-])CC1.C5C(C)(C)C3=O.[C@H]18C[C@@H]7C1.C6C4=O.CO5.N38.O67.N49
|
Cc1coc(C(=O)N2CC[C@@H]3C[C@]32C(=O)N[C@@H]2CC(=O)NC2=O)c1
|
CccocC=O)NCC[C@@H]C[C@]36C=O)N[C@@H]CC=O)NC5=O)))))))))))))))c5
|
[C][C][=C][O][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C@][Ring1][Ring1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][=C][Ring2][Ring1][#Branch1]
|
N14CC[C@@H]2C[C@]217.[C@@H]16CC(=O)NC1=O.Cc1coc8c1.C48=O.C57=O.N56
|
C=CCC1(C(=O)NCC2(C)CC(C)C2)CN(C(=O)[C@H]2CCO[C@H]2C(C)C)C1
|
C=CCCC=O)NCCC)CCC)C4)))))))CNC=O)[C@H]CCO[C@H]5CC)C))))))))C4
|
[C][=C][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][C][Branch1][C][C][C][Ring1][=Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C][O][C@H1][Ring1][Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][Branch2]
|
C169CN4C1.C1%10(C)CC(C)C1.[C@H]17CCO[C@H]18.C=CC9.C36=O.C47=O.C8(C)C.N35.C5%10
|
Cn1ncc(C#N)c1C(=O)NCC1(NC(=O)[C@H]2COCC2(C)C)CCC1
|
CnnccC#N))c5C=O)NCCNC=O)[C@H]COCC5C)C))))))))CCC4
|
[C][N][N][=C][C][Branch1][Ring1][C][#N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][P][N][C][=Branch1][C][=O][C@H1][C][O][C][C][Ring1][Branch1][Branch1][C][C][C][C][C][C][Ring1][=C]
|
Cn1ncc(C#N)c17.[C@H]18COCC1(C)C.C169CCC1.C37=O.C48=O.N35.C59.N46
|
Cc1ccc(CCC(=O)N(C)[C@@H]2CCCCN(C(=O)C3CC(C)C3)C2)cn1
|
CccccCCC=O)NC)[C@@H]CCCCNC=O)CCCC)C4)))))C7)))))))))))cn6
|
[C][C][=C][C][=C][Branch2][Ring2][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][Ring1][Branch1][C][Ring1][=C][C][=N][Ring2][Ring1][#Branch2]
|
[C@@H]16CCCCN5C1.Cc1ccc8cn1.C8CC4=O.C17CC(C)C1.N46C.C57=O
|
CCOC(=O)C(C)(C)CC[C@H](C(=O)NCC(F)F)N1CCC[C@H]2CCNC(=O)[C@@H]21
|
CCOC=O)CC)C)CC[C@H]C=O)NCCF)F)))))NCCC[C@H]CCNC=O)[C@@H]6%10
|
[C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][F][N][C][C][C][C@H1][C][C][N][C][=Branch1][C][=O][C@@H1][Ring1][#Branch1][Ring1][O]
|
C3(=O)C(C)(C)CC[C@@H]6C4=O.N16CCC[C@H]2CCNC(=O)[C@@H]21.C7C(F)F.CC5.O35.N47
|
CCc1cccc(C(=O)N2CCN(C(=O)[C@@H](C)c3cnn(C)c3)C[C@@H]2C)n1
|
CCcccccC=O)NCCNC=O)[C@@H]C)ccnnC)c5)))))))C[C@@H]6C))))))))n6
|
[C][C][C][=C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C@@H1][Ring1][S][C][=N][Ring2][Ring1][=Branch2]
|
N14CCN5C[C@@H]1C.c17cccc6n1.c18cnn(C)c1.C5(=O)[C@H]8C.C46=O.CC7
|
C=C[C@H](C1CC1)N(C)C(=O)c1ccc(CNC(=O)C=NOC)s1
|
C=C[C@H]CCC3)))NC)C=O)ccccCNC=O)C=NOC)))))))s5
|
[C][=C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][C][N][C][=Branch1][C][=O][C][=N][O][C][S][Ring1][=N]
|
c16ccc7s1.C3(=O)C=NOC.C=C[C@@H]48.C18CC1.N24C.C26=O.C57.N35
|
COC(=O)[C@]12CCC[C@]1(C(=O)N1C[C@H]3C[C@@]3(CNC(=O)CC3CN(C)C3)C1)C2
|
COC=O)[C@]CCC[C@]5C=O)NC[C@H]C[C@@]3CNC=O)CCCNC)C4))))))))C6)))))))C6
|
[C][O][C][=Branch1][C][=O][C@][C][C][C][C@][Ring1][Branch1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][C][C@@][Ring1][Ring1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C][N][Branch1][C][C][C][Ring1][Branch1][C][Ring1][S][C][Ring2][Ring1][Branch2]
|
[C@]128CCC[C@]19C2.N15C[C@H]2C[C@@]2%10C1.C1%11CN(C)C1.C6(=O)C%11.C48=O.C59=O.CO4.C7%10.N67
|
CCc1nccnc1C(=O)N1CCCN(C(=O)C2CCC(OC)CC2)[C@H](CO)C1
|
CCcnccnc6C=O)NCCCNC=O)CCCCOC))CC6)))))))[C@H]CO))C7
|
[C][C][C][=N][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring1][O][C][C][C][Ring1][Branch2][C@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][Ring1]
|
N13CCCN4[C@H]8C1.c19nccnc16.C17CCC5CC1.C36=O.C47=O.CC9.O5C.C8O
|
C=CC[C@H](CC(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1)NC(=O)OC(C)(C)C
|
C=CC[C@H]CC=O)NCCC[C@H]cnocCCC3)))n5)))))C6))))))))NC=O)OCC)C)C
|
[C][=C][C][C@H1][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][#C][C][=N][O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][Branch2][C][Ring1][=C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
C=CC[C@@H]8CC5=O.N15CCC[C@H]9C1.c19noc%10n1.C7(C)(C)C.C1%10CC1.C46=O.N68.O47
|
CC1=C(C(=O)NC[C@]2(C)CCN(C(=O)c3cccc(C4CC4)n3)C2)SCCO1
|
CC=CC=O)NC[C@]C)CCNC=O)cccccCCC3)))n6)))))))C5))))))))SCCO6
|
[C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][=Branch2][C][Ring1][P][S][C][C][O][Ring2][Ring1][O]
|
CC1=C(C5=O)SCCO1.[C@@]19(C)CCN6C1.c18cccc%10n1.C68=O.C1%10CC1.N57.C79
|
C=Cc1ccc(C(=O)NC[C@H]2CC[C@@H](C(=O)N[C@@H](C)CC(F)(F)F)O2)cc1
|
C=CccccC=O)NC[C@H]CC[C@@H]C=O)N[C@@H]C)CCF)F)F))))))O5))))))))cc6
|
[C][=C][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F][O][Ring1][#C][C][=C][Ring2][Ring1][=Branch2]
|
C=Cc1ccc8cc1.[C@H]6(C)CC(F)(F)F.[C@H]19CC[C@@H]7O1.C38=O.C47=O.N35.C59.N46
|
Cc1cc(F)cc([C@@H](C)C(=O)N2CC(CCO)(NC(=O)[C@@H]3CC34CC4)C2)c1
|
CcccF)cc[C@@H]C)C=O)NCCCCO)))NC=O)[C@@H]CC3CC3)))))))C4))))))c6
|
[C][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring2][Ring2][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][C][O][Branch1][#C][N][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1][C][Ring1][#C][=C][Ring2][Ring1][#Branch2]
|
Cc1cc%10cc(F)c1.N15CC79C1.[C@H]%10(C)C5=O.[C@@H]18CC12CC2.C9CO.C68=O.N67
|
C[C@H](CNC(=O)c1ccc2cc[nH]c2c1)N(C)C(=O)CC1OCc2ccccc21
|
C[C@H]CNC=O)cccccc[nH]c5c9))))))))))))NC)C=O)CCOCcccccc69
|
[C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2]
|
C4(=O)CC1OCc2ccccc21.c17ccc2cc[nH]c2c1.C[C@@H]5C6.C37=O.N45C.N36
|
CCOCCCC(=O)N1CC[C@](C)(NC(=O)C=CS(C)(=O)=O)C1
|
CCOCCCC=O)NCC[C@]C)NC=O)C=CSC)=O)=O))))))C5
|
[C][C][O][C][C][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][#C]
|
C3(=O)C=CS(C)(=O)=O.N12CC[C@@]6(C)C1.C5CCC2=O.CC4.O45.N36
|
CO[C@@H]1CCCN(C(=O)/C=C/CC2(NC(=O)c3ccc(F)s3)CCC2)CC1
|
CO[C@@H]CCCNC=O)/C=C/CCNC=O)ccccF)s5)))))))CCC4))))))))CC7
|
[C][O][C@@H1][C][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][/C][=C][/C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][S][Ring1][=Branch1][C][C][C][Ring1][=N][C][C][Ring2][Ring1][=Branch2]
|
[C@@H]16CCCN4CC1.c18ccc(F)s1.C17%10CCC1.C4(=O)C=9.C=9C%10.C58=O.CO6.N57
|
CC(=CC(=O)N1CCC2(CC1)C[C@H]2NC(=O)[C@@H](O)C1CC1)c1ccc(F)cc1F
|
CC=CC=O)NCCCCC6))C[C@H]3NC=O)[C@@H]O)CCC3))))))))))))))ccccF)cc6F
|
[C][C][=Branch2][Ring2][C][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F]
|
CC=6c1ccc(F)cc1F.N13CCC2(CC1)C[C@H]25.C4(=O)[C@H]7O.C=6C3=O.C17CC1.N45
|
CN1CCCC[C@H]1CC(=O)N[C@H]1C[C@@H](CCNC(=O)[C@@H]2Cc3ccc(F)cc32)C1
|
CNCCCC[C@H]6CC=O)N[C@H]C[C@@H]CCNC=O)[C@@H]CccccF)cc68))))))))))))C4
|
[C][N][C][C][C][C][C@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][=Branch2][C][Ring2][Ring1][C]
|
C5(=O)[C@@H]1Cc2ccc(F)cc21.CN1CCCC[C@H]18.[C@H]17C[C@@H]9C1.C8C4=O.C9C6.N47.N56
|
NC(=O)C1CC(NC(=O)N2C[C@H]3C[C@H](F)C[C@H]3C2)C1
|
NC=O)CCCNC=O)NC[C@H]C[C@H]F)C[C@H]5C8))))))))))C4
|
[N][C][=Branch1][C][=O][C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch1][C][F][C][C@H1][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][S]
|
N15C[C@H]2C[C@H](F)C[C@H]2C1.C17CC6C1.NC7=O.C45=O.N46
|
CCOc1cccc(C(=O)NC[C@@H]2C[C@@H]2NC(=O)CCc2ccsc2Cl)c1N
|
CCOcccccC=O)NC[C@@H]C[C@@H]3NC=O)CCcccsc5Cl))))))))))))))))c6N
|
[C][C][O][C][=C][C][=C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][C][=C][S][C][=Ring1][Branch1][Cl][=C][Ring2][Ring1][Branch2][N]
|
c16cccc9c1N.c1%11ccsc1Cl.C4(=O)CC%11.[C@@H]1%10C[C@@H]18.C39=O.CC5.O56.N37.C7%10.N48
|
C[C@H](C(=O)NCCCOCCN(C)C(=O)[C@H]1CCc2nccn21)N1CCOC1=O
|
C[C@H]C=O)NCCCOCCNC)C=O)[C@H]CCcnccn58))))))))))))))))))NCCOC5=O
|
[C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][O][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][C][=N][C][=C][N][Ring1][Branch1][Ring1][Branch2][N][C][C][O][C][Ring1][Branch1][=O]
|
C4(=O)[C@H]1CCc2nccn21.N19CCOC1=O.C[C@@H]9C3=O.C7CC5.C6C8.N48C.N37.O56
|
O=C(NC[C@H]1CCCN(C(=O)[C@@H]2[C@@H](C3CC3)C2(F)F)C1)[C@H]1C[C@@H]1c1cccnc1
|
O=CNC[C@H]CCCNC=O)[C@@H][C@@H]CCC3)))C3F)F)))))C6))))))))[C@H]C[C@@H]3ccccnc6
|
[O][=C][Branch2][Ring2][C][N][C][C@H1][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=Branch1][Branch1][C][F][F][C][Ring1][S][C@H1][C][C@@H1][Ring1][Ring1][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
[C@@H]18[C@@H](C2CC2)C1(F)F.[C@H]19CCCN5C1.c1%10cccnc1.[C@H]17C[C@@H]1%10.O=C47.C58=O.N46.C69
|
CO[C@H](Cc1ccccc1)c1noc(CCNC(=O)[C@@H]2CCCO2)n1
|
CO[C@H]Ccccccc6)))))))cnocCCNC=O)[C@@H]CCCO5)))))))))n5
|
[C][O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][O][C][Branch1][#C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][O][Ring1][Branch1][=N][Ring1][#C]
|
c19ccccc1.c17noc8n1.[C@@H]16CCCO1.[C@H]47C9.C8C5.C36=O.CO4.N35
|
CCN(CCN=[N+]=[N-])C(=O)C[C@@]1(C)CCN1C(=O)C1CCCC1
|
CCNCCN=[N+]=[N-])))))C=O)C[C@@]C)CCN4C=O)CCCCC5
|
[C][C][N][Branch1][=Branch1][C][C][N][=N+1][=N-1][C][=Branch1][C][=O][C][C@@][Branch1][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1]
|
[C@]17(C)CCN13.C5CN=[N+]=[N-].C16CCCC1.C2(=O)C7.N245.C36=O.CC4
|
CC[C@@H]1Cc2ccccc2CN1C(=O)NCc1ncc(F)cc1Cl
|
CC[C@@H]Ccccccc6CN%10C=O)NCcnccF)cc6Cl
|
[C][C][C@@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][=N][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Cl]
|
[C@@H]16Cc2ccccc2CN13.c17ncc(F)cc1Cl.C34=O.CC6.N45.C57
|
C=CC[C@@H](CC)C(=O)N(C)CCCNC(=O)c1ccnc2[nH]c(CC3CC3)nc12
|
C=CC[C@@H]CC))C=O)NC)CCCNC=O)cccnc[nH]cCCCC3))))nc95
|
[C][=C][C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][NH1][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][=N][C][Ring1][=N][=Ring1][=Branch2]
|
c18ccnc2[nH]c9nc12.C=CC[C@@H](CC)C4=O.C6CC7.N46C.C58=O.C1%10CC1.N57.C9%10
|
CCS[C@H](C)C(=O)N1CCC12CN(C(=O)c1cnc(O)c3ccsc13)C2
|
CCS[C@H]C)C=O)NCCC4CNC=O)ccncO)cccsc95))))))))))C4
|
[C][C][S][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring2][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][C][C][=C][S][C][Ring1][#Branch2][=Ring1][Branch1][C][Ring1][S]
|
c18cnc(O)c2ccsc12.N14CCC12CN5C2.[C@@H]7(C)C4=O.C58=O.CC6.S67
|
Cc1ncccc1CC(=O)N1CC[C@](CO)(C(=O)N2CC[C@H](O)[C@@H]2C)C1
|
Ccncccc6CC=O)NCC[C@]CO))C=O)NCC[C@H]O)[C@@H]5C)))))))C5
|
[C][C][=N][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][Ring1][C][O][Branch1][S][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][O][C@@H1][Ring1][=Branch1][C][C][Ring1][S]
|
Cc1ncccc17.N13CC[C@@]56C1.N14CC[C@H](O)[C@@H]1C.C7C3=O.C45=O.C6O
|
CO[C@H](C)C(=O)NCC1CCC(NC(=O)c2c[nH]cc2C)CC1
|
CO[C@H]C)C=O)NCCCCCNC=O)cc[nH]cc5C))))))))CC6
|
[C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][NH1][C][=C][Ring1][Branch1][C][C][C][Ring1][#C]
|
C19CCC7CC1.c18c[nH]cc1C.[C@@H]5(C)C3=O.C48=O.CO5.N36.C69.N47
|
CCc1ocnc1C(=O)N[C@H](C)C[C@H](C)NC(=O)Cn1cccc(C)c1=O
|
CCcocnc5C=O)N[C@H]C)C[C@H]C)NC=O)CnccccC)c6=O
|
[C][C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][C][=C][C][=C][Branch1][C][C][C][Ring1][#Branch1][=O]
|
n17cccc(C)c1=O.c18ocnc16.[C@@H]4(C)C[C@@H]5C.C3(=O)C7.C26=O.CC8.N24.N35
|
C=CCOCC(=O)N(C)CC[C@H](NC(=O)CC12COCC(C1)C2)C(C)C
|
C=CCOCC=O)NC)CC[C@H]NC=O)CCCOCCC6)C6)))))))))CC)C
|
[C][=C][C][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][#Branch1][C][Branch1][C][C][C]
|
C7C[C@H]8C(C)C.C129COCC(C1)C2.C6C3=O.C4(=O)C9.C=CC5.N37C.O56.N48
|
CC1(NC(=O)CCc2nccs2)CC(NC(=O)C2CC3(C2)CC32CC2)C1
|
CCNC=O)CCcnccs5)))))))))CCNC=O)CCCC4)CC3CC3)))))))))C4
|
[C][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][=N][C][=C][S][Ring1][Branch1][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Ring1][Ring2][C][C][Ring1][Ring1][C][Ring2][Ring1][=Branch2]
|
C18CC2(C1)CC21CC1.CC16CC7C1.C4(=O)CC9.c19nccs1.C58=O.N46.N57
|
COC[C@@]1(C)CCN1C(=O)[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)c1cccc2c1CCC2
|
COC[C@@]C)CCN4C=O)[C@@H]C[C@@H]C[C@@H]3N6C=O)cccccc6CCC5
|
[C][O][C][C@@][Branch1][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Branch1]
|
c17cccc2c1CCC2.[C@@H]16C[C@@H]2C[C@@H]2N14.[C@]18(C)CCN13.C36=O.C47=O.CO5.C58
|
COC[C@H](C)C(=O)NC1CCC(N(C)C(=O)[C@@H]2CCCOCC2)CC1
|
COC[C@H]C)C=O)NCCCCNC)C=O)[C@@H]CCCOCC7)))))))))CC6
|
[C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C][O][C][C][Ring1][#Branch1][C][C][Ring1][P]
|
C16CCC7CC1.[C@@H]18CCCOCC1.C5[C@H](C)C3=O.N47C.C48=O.CO5.N36
|
CC(C)(CC(=O)N1[C@H](CNC(=O)c2cccs2)C[C@@H]2C[C@@H]21)OCc1ccccc1
|
CCC)CC=O)N[C@H]CNC=O)ccccs5))))))))C[C@@H]C[C@@H]36))))))))OCcccccc6
|
[C][C][Branch1][C][C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][C@@H1][C][C@@H1][Ring1][Ring1][Ring1][#C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CC5(C)CC3=O.N13[C@H]9C[C@@H]2C[C@@H]21.c1%10ccccc1.c18cccs1.C48=O.C79.N47.O56.C6%10
|
CN(C(=O)C#C[C@@H]1CCCO1)[C@H]1CC[C@@H](NC(=O)[C@@H]2CCOC(C)(C)C2)CC1
|
CNC=O)C#C[C@@H]CCCO5))))))))[C@H]CC[C@@H]NC=O)[C@@H]CCOCC)C)C6))))))))CC6
|
[C][N][Branch1][=C][C][=Branch1][C][=O][C][#C][C@@H1][C][C][C][O][Ring1][Branch1][C@H1][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2][C][C][Ring1][P]
|
C3(=O)C#C[C@@H]1CCCO1.[C@@H]17CCOC(C)(C)C1.[C@H]15CC[C@@H]6CC1.CN35.C47=O.N46
|
C[C@](O)(CNC(=O)/C=C/c1sccc1Br)CNC(=O)C1C=CC=CC=C1
|
C[C@]O)CNC=O)/C=C/csccc5Br)))))))))))CNC=O)CC=CC=CC=C7
|
[C][C@][Branch1][C][O][Branch1][P][C][N][C][=Branch1][C][=O][/C][=C][/C][S][C][=C][C][=Ring1][Branch1][Br][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][#Branch1]
|
C=7c1sccc1Br.C16C=CC=CC=C1.C[C@](O)(C4)C5.C2(=O)C=7.C36=O.N24.N35
|
Cn1nccc1C(=O)NC[C@H]1C[C@@H](NC(=O)CC(F)(F)c2ccccc2)C1
|
Cnnccc5C=O)NC[C@H]C[C@@H]NC=O)CCF)F)cccccc6))))))))))C4
|
[C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P]
|
C4(=O)CC9(F)F.Cn1nccc17.c19ccccc1.[C@H]18C[C@@H]6C1.C37=O.N35.C58.N46
|
CCC(CC)(CNC(=O)CCN1CCOCC1)NC(=O)c1cnc(C(F)F)s1
|
CCCCC))CNC=O)CCNCCOCC6)))))))))))NC=O)ccncCF)F))s5
|
[C][C][C][Branch1][Ring1][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][N][C][C][O][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][F][F][S][Ring1][Branch2]
|
CCC4(C5)CC.N16CCOCC1.c17cnc8s1.C2(=O)CC6.C37=O.C8(F)F.N25.N34
|
CC[C@H](C(=O)NCC1(F)CN(C(=O)c2cnc3cccnn23)C1)C(C)(F)F
|
CC[C@H]C=O)NCCF)CNC=O)ccnccccnn96))))))))))C4)))))))CC)F)F
|
[C][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][N][=C][C][=C][C][=N][N][Ring1][=Branch2][Ring1][=Branch1][C][Ring1][S][C][Branch1][C][C][Branch1][C][F][F]
|
CC[C@H](C4=O)C(C)(F)F.c17cnc2cccnn12.C18(F)CN5C1.C57=O.N46.C68
|
C#C[C@@H](NC(=O)[C@@H]1C=C[C@H](NC(=O)Cc2ccco2)C1)c1ccccc1
|
C#C[C@@H]NC=O)[C@@H]C=C[C@H]NC=O)Ccccco5))))))))C5)))))))cccccc6
|
[C][#C][C@@H1][Branch2][Ring1][N][N][C][=Branch1][C][=O][C@@H1][C][=C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
[C@@H]17C=C[C@H]6C1.c19ccccc1.c18ccco1.C#C[C@@H]59.C4(=O)C8.C37=O.N35.N46
|
CC(C)[C@H](CN[C@@H](Cc1ccccc1)[C@H]1CCCO1)N(C)C
|
CCC)[C@H]CN[C@@H]Ccccccc6)))))))[C@H]CCCO5))))))))NC)C
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][=Branch1][C][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][C][C][C][O][Ring1][Branch1][N][Branch1][C][C][C]
|
CC(C)[C@@H]2C3.c16ccccc1.[C@H]15CCCO1.[C@@H]45C6.N2(C)C.N34
|
C=C1CC(N(C)C(=O)[C@H](NC(=O)CNC(=O)CC)c2ccnn2C)C1
|
C=CCCNC)C=O)[C@H]NC=O)CNC=O)CC)))))))cccnn5C)))))))))C4
|
[C][=C][C][C][Branch2][Ring1][P][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=N][N][Ring1][Branch1][C][C][Ring2][Ring1][Branch2]
|
c19ccnn1C.C=C1CC8C1.C3(=O)[C@H]69.C4(=O)C7.C5(=O)CC.N38C.N46.N57
|
C#CCNC(=O)CC(=O)N[C@@H](CNC(=O)[C@@H](O)P(C)(C)=O)c1cc(F)cc(Cl)c1
|
C#CCNC=O)CC=O)N[C@@H]CNC=O)[C@@H]O)PC)C)=O))))))cccF)ccCl)c6
|
[C][#C][C][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][P][Branch1][C][C][Branch1][C][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][Cl][=C][Ring1][Branch2]
|
C4(=O)[C@@H](O)P(C)(C)=O.c18cc(F)cc(Cl)c1.C2(=O)CC3=O.[C@@H]68C7.C#CC5.N25.N36.N47
|
CCn1ccc(CCN=c2[nH]c3cc(Cl)c(S(=O)(=O)NCC(C)(C)F)cc3s2)n1
|
CCncccCCN=c[nH]cccCl)cS=O)=O)NCCC)C)F)))))cc6s9))))))))))))n5
|
[C][C][N][C][=C][C][Branch2][Ring2][=Branch2][C][C][N][=C][NH1][C][=C][C][Branch1][C][Cl][=C][Branch2][Ring1][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][F][C][=C][Ring1][S][S][Ring2][Ring1][Ring1][=N][Ring2][Ring1][O]
|
C7CN=c1[nH]c2cc(Cl)c(S5(=O)=O)cc2s1.n16ccc7n1.C4C(C)(C)F.CC6.N45
|
COC[C@](C)(O)CC(=O)N[C@@H](CNC(=O)C1CCC(N(C)C)CC1)C(C)(C)C
|
COC[C@]C)O)CC=O)N[C@@H]CNC=O)CCCCNC)C))CC6)))))))))CC)C)C
|
[C][O][C][C@][Branch1][C][C][Branch1][C][O][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][C][Ring1][=Branch2][C][Branch1][C][C][Branch1][C][C][C]
|
C4[C@](C)(O)CC2=O.[C@H]5(C6)C(C)(C)C.C18CCC7CC1.C38=O.N7(C)C.CO4.N25.N36
|
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