SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCSc1ccc(C(=O)N(C)[C@@H]2CCC[C@H](NC(=O)Cc3csnc3C)C2)cn1
|
CCSccccC=O)NC)[C@@H]CCC[C@H]NC=O)Cccsnc5C)))))))))C6))))))))cn6
|
[C][C][S][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][=C][S][N][=C][Ring1][Branch1][C][C][Ring1][S][C][=N][Ring2][Ring1][#Branch2]
|
c1%11ccc9cn1.[C@@H]17CCC[C@H]8C1.c1%10csnc1C.C5(=O)C%10.C49=O.N47C.CC6.S6%11.N58
|
CN1C(=O)CSC1=CC(=O)N1CC[C@H]2CCN(C(=O)c3ccn(C)c3)C[C@@H]2C1
|
CNC=O)CSC5=CC=O)NCC[C@H]CCNC=O)cccnC)c5))))))C[C@@H]6C%10
|
[C][N][C][=Branch1][C][=O][C][S][C][Ring1][=Branch1][=C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][C][=Ring1][=Branch1][C][C@@H1][Ring1][=C][C][Ring2][Ring1][C]
|
N14CC[C@H]2CCN5C[C@@H]2C1.CN1C(=O)CSC1=CC4=O.c16ccn(C)c1.C56=O
|
CSCC[C@H](O)C(=O)NC[C@@H]1COCCN1C(=O)c1cnc2c(c1)COC2
|
CSCC[C@H]O)C=O)NC[C@@H]COCCN6C=O)ccnccc6)COC5
|
[C][S][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][O][C][Ring1][=Branch1]
|
c17cnc2c(c1)COC2.C6C[C@H](O)C3=O.[C@@H]18COCCN14.C47=O.CS6.N35.C58
|
CCCC[C@@H](CC)NC(=O)c1cnc(CNC(=O)CN2CCC[C@@H]2C)nc1
|
CCCC[C@@H]CC))NC=O)ccncCNC=O)CNCCC[C@@H]5C))))))))))nc6
|
[C][C][C][C][C@@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][S][C][N][C][=Branch1][C][=O][C][N][C][C][C][C@@H1][Ring1][Branch1][C][N][=C][Ring1][P]
|
CCCC[C@H]5CC.c18cnc9nc1.N17CCC[C@@H]1C.C4(=O)C7.C38=O.N35.C69.N46
|
CC(=O)N1CCC[C@@H]1C(=O)NCC1(C)CCN(C(=O)CC[C@H]2CC2(Cl)Cl)CC1
|
CC=O)NCCC[C@@H]5C=O)NCCC)CCNC=O)CC[C@H]CC3Cl)Cl)))))))CC6
|
[C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C@H1][C][C][Ring1][Ring1][Branch1][C][Cl][Cl][C][C][Ring1][S]
|
C18(C)CCN5CC1.N13CCC[C@@H]17.C5(=O)CC9.[C@H]19CC1(Cl)Cl.CC3=O.C47=O.N46.C68
|
COCC[C@H](CNC(=O)CCC(C)C)NC(=O)c1cnn(CCO)c1C(C)C
|
COCC[C@H]CNC=O)CCCC)C)))))))NC=O)ccnnCCO)))c5CC)C
|
[C][O][C][C][C@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][Ring2][C][C][O][C][=Ring1][Branch2][C][Branch1][C][C][C]
|
C2(=O)CCC(C)C.c17cnn8c19.C4C[C@@H]5C6.C37=O.C8CO.C9(C)C.CO4.N26.N35
|
CC(C)C(F)(F)CC(=O)N[C@@H]1CCCC[C@@H]1NC(=O)c1cn(C)nc1C(C)(C)C
|
CCC)CF)F)CC=O)N[C@@H]CCCC[C@@H]6NC=O)ccnC)nc5CC)C)C
|
[C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C]
|
CC(C)C(F)(F)CC2=O.[C@@H]14CCCC[C@@H]15.c16cn(C)nc17.C7(C)(C)C.C36=O.N24.N35
|
CC(=O)c1cn(CC(=O)NCC2(CNC(=O)[C@H](C)CC(N)=O)CCC2)nn1
|
CC=O)ccnCC=O)NCCCNC=O)[C@H]C)CCN)=O)))))))CCC4))))))))nn5
|
[C][C][=Branch1][C][=O][C][=C][N][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][Branch1][C][N][=O][C][C][C][Ring1][=C][N][=N][Ring2][Ring1][Branch2]
|
C4(=O)[C@H](C)CC(N)=O.c17cn8nn1.C19%10CCC1.C8C3=O.CC7=O.N35.C59.C6%10.N46
|
C[C@H]1CCCc2c(C(=O)N3CC[C@H](NC(=O)c4cccc[n+]4[O-])C3(C)C)cnn21
|
C[C@H]CCCccC=O)NCC[C@H]NC=O)ccccc[n+]6[O-])))))))))C5C)C)))))))cnn59
|
[C][C@H1][C][C][C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=N+1][Ring1][=Branch1][O-1][C][Ring1][#C][Branch1][C][C][C][C][=N][N][Ring2][Ring1][Branch2][Ring2][Ring1][N]
|
C[C@H]1CCCc2c9cnn21.N15CC[C@H]7C1(C)C.c18cccc[n+]1[O-].C59=O.C68=O.N67
|
C=C(Cl)C[C@@H](NC(=O)CCCC)C(=O)N[C@H](CC)CCCC
|
C=CCl)C[C@@H]NC=O)CCCC))))))C=O)N[C@H]CC))CCCC
|
[C][=C][Branch1][C][Cl][C][C@@H1][Branch1][#Branch2][N][C][=Branch1][C][=O][C][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][C][C][C]
|
C=C(Cl)C[C@@H]3C2=O.[C@@H]4(CC)CCCC.C1(=O)CCCC.N13.N24
|
C[C@@H]1CC[C@@H](CNC(=O)C#CC2CCCCC2)CN1C(=O)CCC(C)(C)N(C)C
|
C[C@@H]CC[C@@H]CNC=O)C#CCCCCCC6)))))))))))CN6C=O)CCCC)C)NC)C
|
[C][C@@H1][C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][#C][C][C][C][C][C][C][Ring1][=Branch1][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][N][Branch1][C][C][C]
|
C3(=O)C#CC1CCCCC1.C[C@@H]1CC[C@@H]7CN14.C4(=O)CCC6(C)C.N6(C)C.C57.N35
|
C[C@@H]1C[C@H]1CCCC(=O)NC1(C(=O)N2CC[C@H]3CC[C@@H](C2)S3)CCC1
|
C[C@@H]C[C@H]3CCCC=O)NCC=O)NCC[C@H]CC[C@@H]C8)S5)))))))))CCC4
|
[C][C@@H1][C][C@H1][Ring1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch2][S][Ring1][=Branch1][C][C][C][Ring1][#C]
|
N15CC[C@H]2CC[C@@H](C1)S2.C8CCC4=O.C167CCC1.C[C@@H]1C[C@H]18.C57=O.N46
|
CC[C@@H]1CN(C(=O)C[C@H]2CN(C(=O)c3cnc[nH]3)CCO2)CCO1
|
CC[C@@H]CNC=O)C[C@H]CNC=O)ccnc[nH]5))))))CCO6))))))))CCO6
|
[C][C][C@@H1][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][NH1][Ring1][Branch1][C][C][O][Ring1][=N][C][C][O][Ring2][Ring1][=Branch1]
|
[C@@H]17CN4CCO1.[C@H]18CN5CCO1.c16cnc[nH]1.C4(=O)C8.C56=O.CC7
|
CCCOCCC(=O)N[C@H](CNC(=O)CCCN1C(=O)CCC1=O)CC(F)(F)F
|
CCCOCCC=O)N[C@H]CNC=O)CCCNC=O)CCC5=O))))))))))))CCF)F)F
|
[C][C][C][O][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][C][N][C][=Branch1][C][=O][C][C][C][Ring1][=Branch1][=O][C][C][Branch1][C][F][Branch1][C][F][F]
|
[C@@H]6(C7)CC(F)(F)F.N18C(=O)CCC1=O.C3(=O)CCC8.C5CC2=O.CCC4.O45.N26.N37
|
Cc1nc(C(=O)N[C@@H]2CN(C(=O)CCC(=O)OC(C)(C)C)CC[C@@H]2F)co1
|
CcncC=O)N[C@@H]CNC=O)CCC=O)OCC)C)C)))))))CC[C@@H]6F)))))))))co5
|
[C][C][=N][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][C@@H1][Ring1][P][F][=C][O][Ring2][Ring1][#Branch2]
|
[C@@H]17CN5CC[C@@H]1F.C5(=O)CCC3=O.Cc1nc8co1.C6(C)(C)C.C48=O.N47.O36
|
C[C@@H](NC=O)C(=O)N1CC[C@@H](c2cn(-c3ccc(Cl)cc3Cl)nn2)C1
|
C[C@@H]NC=O)))C=O)NCC[C@@H]ccn-ccccCl)cc6Cl)))))))nn5)))))C5
|
[C][C@@H1][Branch1][Ring2][N][C][=O][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][=Branch1][C][=C][N][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][N][=N][Ring1][=N][C][Ring2][Ring1][C]
|
c16ccc(Cl)cc1Cl.N14CC[C@@H]7C1.c17cn6nn1.C[C@@H]5C4=O.N5C=O
|
CN(CC(C)(C)C(=O)N(C)Cc1cncs1)C(=O)c1cnsn1
|
CNCCC)C)C=O)NC)Cccncs5))))))))))C=O)ccnsn5
|
[C][N][Branch2][Ring1][=Branch2][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][N][=C][S][Ring1][Branch1][C][=Branch1][C][=O][C][C][=N][S][N][=Ring1][Branch1]
|
C4C(C)(C)C2=O.c17cncs1.c16cnsn1.CN34.N25C.C36=O.C57
|
CCC(C)(C)[C@H](N=c1ccn(C2COC2)[nH]1)c1nnnn1-c1cccc(Cl)c1C
|
CCCC)C)[C@H]N=cccnCCOC4))))[nH]5))))))cnnnn5-cccccCl)c6C
|
[C][C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][P][N][=C][C][=C][N][Branch1][#Branch1][C][C][O][C][Ring1][Ring2][NH1][Ring1][=Branch2][C][=N][N][=N][N][Ring1][Branch1][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C]
|
CCC(C)(C)[C@@H]3N=c1ccn4[nH]1.c15cccc(Cl)c1C.c13nnnn15.C14COC1
|
C#CCCCOCC(=O)NC[C@]1(C2CC2)CCN(C(=O)C2SCCCS2)C1
|
C#CCCCOCC=O)NC[C@]CCC3)))CCNC=O)CSCCCS6)))))))C5
|
[C][#C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][S][C][C][C][S][Ring1][=Branch1][C][Ring1][S]
|
[C@@]19(C2CC2)CCN4C1.C18SCCCS1.C#CCCC5.C6C3=O.C48=O.O56.N37.C79
|
CP(C)(=O)c1cccc(C(=O)N2CCC3(CC2)C[C@H]3NC(=O)[C@H](F)CC2CC2)n1
|
CPC)=O)cccccC=O)NCCCCC6))C[C@H]3NC=O)[C@H]F)CCCC3))))))))))))))n6
|
[C][P][Branch1][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][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][F][C][C][C][C][Ring1][Ring1][=N][Ring2][Ring1][=Branch2]
|
CP(C)(=O)c1cccc7n1.N14CCC2(CC1)C[C@H]26.C5(=O)[C@H](F)C8.C47=O.C18CC1.N56
|
Cc1nc(CC(=O)N2CC=C[C@@H]2CNC(=O)c2ccnn2CCN(C)C)c(C)s1
|
CcncCC=O)NCC=C[C@@H]5CNC=O)cccnn5CCNC)C)))))))))))))))))))cC)s5
|
[C][C][=N][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][=C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][N][Branch1][C][C][C][=C][Branch1][C][C][S][Ring2][Ring1][N]
|
Cc1nc%10c(C)s1.N13CC=C[C@@H]19.c17ccnn18.C%10C3=O.C47=O.C8C6.N6(C)C.C59.N45
|
C[C@H]1OC(=O)N[C@H]1C(=O)NCC(=O)NC1(C)CC(O)(CO)C1
|
C[C@H]OC=O)N[C@H]5C=O)NCC=O)NCC)CCO)CO))C4
|
[C][C@H1][O][C][=Branch1][C][=O][N][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Branch1][C][O][Branch1][Ring1][C][O][C][Ring1][Branch2]
|
C[C@H]1OC(=O)N[C@H]16.C15(C)CC7(O)C1.C4C3=O.C26=O.N24.N35.C7O
|
COCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C)c(O)c(C)c1)CC2
|
COCC=O)Ncnccs5)C[C@@H]NC=O)cccC)cO)cC)c6))))))))CC6
|
[C][O][C][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][=Branch2][C][C][Ring2][Ring1][Ring1]
|
c16nc2c(s1)C[C@@H]7CC2.c18cc(C)c(O)c(C)c1.C5C3=O.C48=O.CO5.N36.N47
|
CCCCC(=O)NC[C@@H]1CC2(CCN(C(=O)c3ccnc(Cl)c3Cl)CC2)CO1
|
CCCCC=O)NC[C@@H]CCCCNC=O)cccncCl)c6Cl))))))))CC6)))))CO5
|
[C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch2][Ring1][#Branch2][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][C][Ring1][S][C][O][Ring2][Ring1][Ring2]
|
[C@@H]18CC2(CCN5CC2)CO1.c17ccnc(Cl)c1Cl.CCCCC4=O.C57=O.N46.C68
|
CC[C@@H](CC(=O)N1CC2(CC)CC1(CNC(=O)CN(CC)CC)C2)C(F)F
|
CC[C@@H]CC=O)NCCCC))CC5CNC=O)CNCC))CC)))))))C4))))))))CF)F
|
[C][C][C@@H1][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][C][C][C][Ring1][#Branch1][Branch1][#C][C][N][C][=Branch1][C][=O][C][N][Branch1][Ring1][C][C][C][C][C][Ring1][S][C][Branch1][C][F][F]
|
CC[C@@H](CC3=O)C(F)F.N13CC2%10CC19C2.C4(=O)C6.N678.C%10C.C59.N45.C7C.C8C
|
CN(C(=O)c1cccc2nccn12)C1CN(C(=O)CC[C@@H]2C[C@H]2CC2CC2)C1
|
CNC=O)cccccnccn95))))))))))CCNC=O)CC[C@@H]C[C@H]3CCCC3))))))))))C4
|
[C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=N][C][=C][N][Ring1][=Branch2][Ring1][Branch1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][C][C][C][Ring1][Ring1][C][Ring1][#C]
|
c16cccc2nccn12.C15CN4C1.C4(=O)CC7.[C@@H]17C[C@H]18.CN35.C36=O.C19CC1.C89
|
O=C(COc1cncc(Br)c1)NCC1(F)CN(C(=O)[C@@H]2CC[C@@H](O)C2)C1
|
O=CCOccnccBr)c6))))))))NCCF)CNC=O)[C@@H]CC[C@@H]O)C5))))))C4
|
[O][=C][Branch1][=C][C][O][C][=C][N][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][N][C][C][Branch1][C][F][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Branch1][C][O][C][Ring1][=Branch1][C][Ring1][=N]
|
c16cncc(Br)c1.C19(F)CN4C1.[C@@H]18CC[C@@H](O)C1.O=C3C5.C48=O.O56.N37.C79
|
COc1nc(C(=O)N2CCC[C@H](CCNC(=O)[C@H]3CCC(=O)O3)C2)sc1C
|
COcncC=O)NCCC[C@H]CCNC=O)[C@H]CCC=O)O5)))))))))C6)))))))sc5C
|
[C][O][C][N][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][=Branch1][C][=O][O][Ring1][=Branch1][C][Ring1][P][S][C][=Ring2][Ring1][Branch2][C]
|
c16nc9sc1C.N14CCC[C@H]%10C1.[C@H]18CCC(=O)O1.C49=O.C%10C7.C58=O.CO6.N57
|
CC(=CC(=O)N(C)[C@@H](C)CN(C)C(=O)c1cccc(C2CCOCC2)c1)C(F)F
|
CC=CC=O)NC)[C@@H]C)CNC)C=O)cccccCCCOCC6))))))c6)))))))))))))CF)F
|
[C][C][=Branch2][Ring2][=Branch2][=C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][=C][Ring1][N][C][Branch1][C][F][F]
|
c17cccc9c1.C19CCOCC1.CC=8C(F)F.C=8C3=O.[C@H]5(C)C6.N35C.N46C.C47=O
|
Cc1nc(C(=O)N2CC[C@H](O)[C@@H]2C(=O)N2CC(C3=NOCC3)C2)c(C)s1
|
CcncC=O)NCC[C@H]O)[C@@H]5C=O)NCCC=NOCC5)))))C4)))))))))))cC)s5
|
[C][C][=N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][O][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][C][=N][O][C][C][Ring1][Branch1][C][Ring1][=Branch2][=C][Branch1][C][C][S][Ring2][Ring1][=Branch2]
|
N15CC(C2=NOCC2)C1.Cc1nc7c(C)s1.N14CC[C@H](O)[C@@H]16.C47=O.C56=O
|
CC(=O)OC(C)(C)C(=O)N1CC[C@@](C)(CCNC(=O)CCCCCF)C1
|
CC=O)OCC)C)C=O)NCC[C@@]C)CCNC=O)CCCCCF))))))))))C5
|
[C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch1][=C][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][F][C][Ring1][P]
|
C4(=O)CCCCCF.N13CC[C@]7(C)C1.C5(C)(C)C3=O.CC2=O.C7C6.O25.N46
|
CN(C)c1ccc(N)c(C(=O)N2CC[C@](CF)(NC(=O)c3cnc(S)nc3)C2)c1
|
CNC)ccccN)cC=O)NCC[C@]CF))NC=O)ccncS)nc6))))))))C5))))))c6
|
[C][N][Branch1][C][C][C][=C][C][=C][Branch1][C][N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][Ring1][C][F][Branch1][P][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][S][N][=C][Ring1][#Branch1][C][Ring1][P][=C][Ring2][Ring1][#Branch2]
|
c17ccc(N)c8c1.N14CC[C@@]6%10C1.c19cnc(S)nc1.CN7C.C48=O.C59=O.C%10F.N56
|
Cn1nc2c(c1C(=O)Nc1c[nH]nc1Br)CN(C(=O)c1cc(F)cnc1Cl)CC2
|
Cnnccc5C=O)Ncc[nH]nc5Br)))))))))CNC=O)cccF)cnc6Cl))))))))CC6
|
[C][N][N][=C][C][=Branch1][P][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][NH1][N][=C][Ring1][Branch1][Br][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][N][=C][Ring1][#Branch1][Cl][C][C][Ring2][Ring1][#Branch2]
|
Cn1nc2c(c16)CN4CC2.c17cc(F)cnc1Cl.c15c[nH]nc1Br.C36=O.C47=O.N35
|
C[C@@H]1CCC[C@]1(C)C(=O)NCc1nc2c(s1)CCN(C(=O)CC1CCC1)C2
|
C[C@@H]CCC[C@]5C)C=O)NCcnccs5)CCNC=O)CCCCC4))))))C6
|
[C][C@@H1][C][C][C][C@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][C][Ring1][=C]
|
c17nc2c(s1)CCN4C2.C[C@@H]1CCC[C@@]16C.C4(=O)C8.C18CCC1.C36=O.N35.C57
|
O=C(CSC[C@H]1CCCO1)NCC[C@@H]1CCCN1C(=O)CN1CCCCS1(=O)=O
|
O=CCSC[C@H]CCCO5))))))))NCC[C@@H]CCCN5C=O)CNCCCCS6=O)=O
|
[O][=C][Branch1][O][C][S][C][C@H1][C][C][C][O][Ring1][Branch1][N][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][C][C][C][C][S][Ring1][=Branch1][=Branch1][C][=O][=O]
|
N15CCCCS1(=O)=O.[C@@H]19CCCN13.[C@H]18CCCO1.O=C2C6.C3(=O)C5.C4C9.S67.C78.N24
|
CO[C@H](C(=O)N1C[C@H]2C(CNC(=O)c3sc4sccc4c3Cl)[C@@H]2C1)C1CCC1
|
CO[C@H]C=O)NC[C@H]CCNC=O)cscsccc5c8Cl))))))))))))[C@@H]3C6)))))))CCCC4
|
[C][O][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][S][C][S][C][=C][C][=Ring1][Branch1][C][=Ring1][Branch2][Cl][C@@H1][Ring1][S][C][Ring2][Ring1][Ring1][C][C][C][C][Ring1][Ring2]
|
c19sc2sccc2c1Cl.N15C[C@H]2C%11[C@@H]2C1.[C@H]7%10C5=O.C1%10CCC1.C69=O.CO7.C8%11.N68
|
O=C(NC1CC2(CCN(C(=O)CCOC3CC3)C2)C1)[C@@H]1C[C@@H]1Cc1ccccc1
|
O=CNCCCCCNC=O)CCOCCC3)))))))C5))))C4)))))[C@@H]C[C@@H]3Ccccccc6
|
[O][=C][Branch2][Ring1][#C][N][C][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][O][C][C][C][Ring1][Ring1][C][Ring1][=N][C][Ring1][S][C@@H1][C][C@@H1][Ring1][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C18CC2(CCN5C2)C1.c1%11ccccc1.C5(=O)CC6.[C@@H]19C[C@@H]1%10.O=C49.C17CC1.N48.O67.C%10%11
|
O=C1CN(C(=O)COc2cccnc2)[C@@H](C(=O)N2C[C@@H](O)CO2)CN1
|
O=CCNC=O)COccccnc6)))))))))[C@@H]C=O)NC[C@@H]O)CO5))))))CN6
|
[O][=C][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][O][Ring1][=Branch1][C][N][Ring2][Ring1][Branch2]
|
O=C1CN3[C@@H]6CN1.C6(=O)N1C[C@@H](O)CO1.c15cccnc1.C3(=O)C4.O45
|
CC(=O)N(C)[C@@H](C)C(=O)N1CCCN(C(=O)c2cc(C(C)(F)F)on2)[C@@H](CO)C1
|
CC=O)NC)[C@@H]C)C=O)NCCCNC=O)cccCC)F)F))on5))))))[C@@H]CO))C7
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][F][F][O][N][=Ring1][=Branch2][C@@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][Ring2]
|
N14CCCN5[C@@H]8C1.c17cc9on1.[C@H]6(C)C4=O.C9(C)(F)F.CC3=O.N36C.C57=O.C8O
|
C[C@@H](CN(C)C(=O)C1CCCCC1)C(=O)N1CC[C@@](C)(C#N)C1
|
C[C@@H]CNC)C=O)CCCCCC6)))))))))C=O)NCC[C@@]C)C#N))C5
|
[C][C@@H1][Branch2][Ring1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch1][Ring1][C][#N][C][Ring1][Branch2]
|
N13CC[C@@](C)(C#N)C1.C[C@@H](C4)C3=O.C15CCCCC1.N24C.C25=O
|
Cc1cc(NC(=O)[C@@H]2[C@@H]3C[C@@H]2N(Cc2cccc(OC(C)C)c2)C3)ncc1F
|
CcccNC=O)[C@@H][C@@H]C[C@@H]4NCcccccOCC)C)))c6)))))))C5))))))))ncc6F
|
[C][C][=C][C][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][C@@H1][C@@H1][C][C@@H1][Ring1][Ring2][N][Branch2][Ring1][C][C][C][=C][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][C][C][=C][Ring1][#Branch2][C][Ring1][S][=N][C][=C][Ring2][Ring1][#Branch2][F]
|
Cc1cc8ncc1F.[C@@H]19[C@@H]2C[C@@H]1N7C2.c1%10cccc6c1.C49=O.C5(C)C.N48.C7%10.O56
|
Cc1ncc(F)c(N2CCC3(CCN(C(=O)[C@H]4[C@H](C)[C@@H]4C)CC3)CC2)n1
|
CcnccF)cNCCCCCNC=O)[C@H][C@H]C)[C@@H]3C)))))CC6)))))CC6))))))n6
|
[C][C][=N][C][=C][Branch1][C][F][C][Branch2][Ring2][Ring1][N][C][C][C][Branch2][Ring1][#Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C@H1][Branch1][C][C][C@@H1][Ring1][Ring2][C][C][C][Ring1][=N][C][C][Ring2][Ring1][C][=N][Ring2][Ring1][=Branch2]
|
N16CCC2(CCN5CC2)CC1.Cc1ncc(F)c6n1.[C@@H]17[C@@H](C)[C@H]1C.C57=O
|
Cc1nc(CNC(=O)[C@H]2[C@@H]3CN(C(=O)C4(C#N)CCCC4)C[C@@H]32)[nH]c1C
|
CcncCNC=O)[C@H][C@@H]CNC=O)CC#N))CCCC5))))))C[C@@H]56)))))))))[nH]c5C
|
[C][C][N][=C][Branch2][Ring2][C][C][N][C][=Branch1][C][=O][C@H1][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][C][C][Ring1][#Branch1][C][C@@H1][Ring1][=C][Ring1][#C][NH1][C][=Ring2][Ring1][Branch2][C]
|
Cc1nc%10[nH]c1C.[C@@H]18[C@H]2CN6C[C@@H]12.C19(C#N)CCCC1.C58=O.C69=O.C7%10.N57
|
Cc1nn(C)cc1CC(=O)N1CC[C@H]2C[C@H]1CN(C(=O)[C@H]1CC13CC3)C2
|
CcnnC)cc5CC=O)NCC[C@H]C[C@H]6CNC=O)[C@H]CC3CC3))))))C6
|
[C][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C@H1][Ring1][=Branch1][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1][C][Ring1][=N]
|
N14CC[C@H]2C[C@H]1CN5C2.Cc1nn(C)cc17.[C@H]16CC12CC2.C7C4=O.C56=O
|
CN(C(=O)C(=O)C(C)(C)C)[C@@H]1CCCN(Cc2nnc(S(C)(=O)=O)s2)CC1
|
CNC=O)C=O)CC)C)C))))[C@@H]CCCNCcnncSC)=O)=O))s5))))))CC7
|
[C][N][Branch1][P][C][=Branch1][C][=O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C@@H1][C][C][C][N][Branch2][Ring1][Ring1][C][C][=N][N][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][S][Ring1][=Branch2][C][C][Ring1][P]
|
c16nnc(S(C)(=O)=O)s1.C3(=O)C(=O)C(C)(C)C.[C@@H]15CCCN4CC1.CN35.C46
|
CC[C@H](C(=O)NC1CC2(C1)CN(C(=O)[C@H]1C=CCC1)C2)N1CCN(CCO)CC1
|
CC[C@H]C=O)NCCCC4)CNC=O)[C@H]C=CCC5))))))C4))))))))NCCNCCO)))CC6
|
[C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch1][N][C][=Branch1][C][=O][C@H1][C][=C][C][C][Ring1][Branch1][C][Ring1][N][N][C][C][N][Branch1][Ring2][C][C][O][C][C][Ring1][=Branch2]
|
C17CC2(C1)CN4C2.N15CCN6CC1.CC[C@@H]5C3=O.[C@H]18C=CCC1.C48=O.C6CO.N37
|
CC(C)CO[C@H](C)C(=O)NC1C[C@@H]2CN(C(=O)c3ccsn3)C[C@H]2C1
|
CCC)CO[C@H]C)C=O)NCC[C@@H]CNC=O)cccsn5))))))C[C@H]5C8
|
[C][C][Branch1][C][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][S][N][=Ring1][Branch1][C][C@H1][Ring1][N][C][Ring1][#C]
|
C18C[C@@H]2CN5C[C@H]2C1.[C@@H]7(C)C4=O.c19ccsn1.CC(C)C6.C59=O.O67.N48
|
CC(C)c1ccc(CCC(=O)N[C@H](CNC(=O)[C@@H]2C[C@@H]3C=C[C@H]2C3)C2CC2)cc1
|
CCC)ccccCCC=O)N[C@H]CNC=O)[C@@H]C[C@@H]C=C[C@H]6C5))))))))))CCC3))))))))cc6
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][C][=C][C@H1][Ring1][=Branch1][C][Ring1][Branch1][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch2]
|
c1%10ccc%11cc1.[C@@H]18C[C@@H]2C=C[C@H]1C2.C%11CC4=O.[C@H]69C7.CC%10C.C58=O.C19CC1.N46.N57
|
O=C1OCC2=C1[C@H](c1cc3ccccc3[nH]1)NC(=O)N2CCC1CC1
|
O=COCC=C5[C@H]cccccccc6[nH]9)))))))))NC=O)N6CCCCC3
|
[O][=C][O][C][C][=C][Ring1][Branch1][C@H1][Branch1][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][N][C][=Branch1][C][=O][N][Ring1][S][C][C][C][C][C][Ring1][Ring1]
|
O=C1OCC2=C1[C@H]6NC(=O)N24.c16cc2ccccc2[nH]1.C4C5.C15CC1
|
CC(C)[C@@H](F)C(=O)NCC(=O)N1CCN(C(=O)C[C@@H]2OCCOC2(C)C)CC1
|
CCC)[C@@H]F)C=O)NCC=O)NCCNC=O)C[C@@H]OCCOC6C)C)))))))))CC6
|
[C][C][Branch1][C][C][C@@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C@@H1][O][C][C][O][C][Ring1][=Branch1][Branch1][C][C][C][C][C][Ring1][P]
|
[C@@H]17OCCOC1(C)C.CC(C)[C@@H](F)C3=O.N14CCN5CC1.C6C4=O.C5(=O)C7.N36
|
CC[C@H](C)[C@H](C)C(=O)N1CC(=C(F)CNC(=O)C=Cc2cncn2C)C1
|
CC[C@H]C)[C@H]C)C=O)NCC=CF)CNC=O)C=Cccncn5C))))))))))))C4
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=Branch2][Ring1][Branch1][=C][Branch1][C][F][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][N][Ring1][Branch1][C][C][Ring2][Ring1][C]
|
CC[C@H](C)[C@H](C)C3=O.C=7c1cncn1C.N13CC=6C1.C=6(F)C5.C4(=O)C=7.N45
|
C#C[C@H]1CCN(C(=O)[C@H](CC)NC(=O)[C@@H](OC)C2CCC2)C1
|
C#C[C@H]CCNC=O)[C@H]CC))NC=O)[C@@H]OC))CCCC4)))))))))C5
|
[C][#C][C@H1][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][O][C][C][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Ring2]
|
C#C[C@H]1CCN3C1.C3(=O)[C@@H]6CC.C4(=O)[C@@H]57.C17CCC1.N46.O5C
|
C[C@@H]1C[C@@H]2C[C@H]2C[C@H]1C(=O)N1CCC[C@@H]1CCNC(=O)c1n[nH]cc1C(F)(F)F
|
C[C@@H]C[C@@H]C[C@H]3C[C@H]7C=O)NCCC[C@@H]5CCNC=O)cn[nH]cc5CF)F)F
|
[C][C@@H1][C][C@@H1][C][C@H1][Ring1][Ring1][C][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
C[C@@H]1C[C@@H]2C[C@H]2C[C@H]17.N13CCC[C@@H]18.c16n[nH]cc19.C9(F)(F)F.C37=O.C8C5.C46=O.N45
|
CC(C)CN1CCC([C@@H](C(=O)NC2CCCC2)N(CC2CC2)C2CCC2)CC1
|
CCC)CNCCC[C@@H]C=O)NCCCCC5)))))))NCCCC3))))CCCC4))))))CC6
|
[C][C][Branch1][C][C][C][N][C][C][C][Branch2][Ring1][#C][C@@H1][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][C][C][Ring1][Ring2][C][C][Ring2][Ring1][Branch2]
|
N14CCC9CC1.[C@H]59C3=O.C17CCCC1.CC(C)C4.C18CCC1.N568.C1%10CC1.N37.C6%10
|
Cc1nccc(C(=O)NC[C@H](C)N(C)C(=O)[C@H]2CCn3nncc3C2)n1
|
CcncccC=O)NC[C@H]C)NC)C=O)[C@H]CCnnncc5C9)))))))))))))))n6
|
[C][C][=N][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][N][N][=N][C][=C][Ring1][Branch1][C][Ring1][=Branch2][=N][Ring2][Ring1][=Branch2]
|
[C@H]19CCn2nncc2C1.Cc1nccc8n1.C6[C@@H]7C.C48=O.N57C.C59=O.N46
|
CSCC1(C(=O)N[C@H](C)CCNC(=O)C2(C)C(C)(C)C2(C)C)CCOCC1
|
CSCCC=O)N[C@H]C)CCNC=O)CC)CC)C)C3C)C)))))))))))CCOCC6
|
[C][S][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][Branch1][C][C][C][C][C][O][C][C][Ring2][Ring1][Branch2]
|
C19(C)C(C)(C)C1(C)C.C18%10CCOCC1.[C@@H]5(C)CC6.C38=O.C49=O.CS7.C7%10.N35.N46
|
COCC(=O)N1CCC2(CC1)CN(C(=O)Cc1ccc3occc3c1)[C@H]2C(C)C
|
COCC=O)NCCCCC6))CNC=O)Cccccoccc5c9)))))))))))[C@H]4CC)C
|
[C][O][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][C][=C][O][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C@H1][Ring2][Ring1][C][C][Branch1][C][C][C]
|
N14CCC2(CC1)CN5[C@H]27.c18ccc2occc2c1.C6C4=O.C5(=O)C8.C7(C)C.CO6
|
C[C@@H]1C[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)CS1
|
C[C@@H]C[C@H]NC=O)NCcccccc6[N+]=O)[O-])))))))))[C@H]CC[C@H]O)CC6)))))))))CS5
|
[C][C@@H1][C][C@H1][Branch2][Ring2][C][N][C][=Branch1][C][=O][N][Branch1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C@H1][C][C][C@H1][Branch1][C][O][C][C][Ring1][#Branch1][C][S][Ring2][Ring1][#Branch2]
|
c18ccccc1[N+](=O)[O-].[C@H]17CC[C@H](O)CC1.C[C@@H]1C[C@H]6CS1.C34=O.N457.N36.C58
|
CCc1nc(C(=O)N2CCC[C@H]2C(C)(C)C(=O)NC[C@@H]2CCC(=O)O2)cs1
|
CCcncC=O)NCCC[C@H]5CC)C)C=O)NC[C@@H]CCC=O)O5)))))))))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][=Branch1][C][=O][O][Ring1][=Branch1][=C][S][Ring2][Ring1][=Branch2]
|
c19nc6cs1.N13CCC[C@H]17.C7(C)(C)C4=O.[C@@H]18CCC(=O)O1.C36=O.CC9.N45.C58
|
C[C@H]1CC(=O)CCN1C(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1C1CC1
|
C[C@H]CC=O)CCN6C=O)[C@@H]CNCcccccc6)))))))C[C@H]5CCC3
|
[C][C@H1][C][C][=Branch1][C][=O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Ring1][N][C][C][C][Ring1][Ring1]
|
[C@@H]15CN4C[C@H]1C1CC1.C[C@H]1CC(=O)CCN13.c16ccccc1.C35=O.C46
|
CCOC(C)(C)C(=O)NC[C@H]1[C@H](OC)[C@H](OC)CN1C(=O)[C@@H]1[C@H](C)[C@@H]1C
|
CCOCC)C)C=O)NC[C@H][C@H]OC))[C@H]OC))CN5C=O)[C@@H][C@H]C)[C@@H]3C
|
[C][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C@H1][Branch1][Ring1][O][C][C@H1][Branch1][Ring1][O][C][C][N][Ring1][=Branch2][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][C][C][C@@H1][Ring1][Ring2][C]
|
[C@H]1%10[C@H]6[C@H]7CN13.C5(C)(C)C2=O.[C@H]19[C@@H](C)[C@H]1C.C39=O.CC4.O45.N28.C8%10.O6C.O7C
|
C[C@@H](C(=O)NCCCN(C(=O)[C@@H](CO)N(C)C)C1CC1)c1ccc(N(C)C)cc1
|
C[C@@H]C=O)NCCCNC=O)[C@@H]CO))NC)C))))CCC3)))))))))ccccNC)C))cc6
|
[C][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][N][Branch1][C][C][C][C][C][C][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][=Branch2]
|
c19ccc7cc1.C3(=O)[C@H]6CO.C[C@H]9C2=O.C4CC5.N358.N6(C)C.C18CC1.N7(C)C.N24
|
Cc1nc(O)ccc1C(=O)N1CCc2cc(F)c(F)cc2C1
|
CcncO)ccc6C=O)NCCcccF)cF)cc6C%10
|
[C][C][=N][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][C][Ring1][N]
|
N13CCc2cc(F)c(F)cc2C1.Cc1nc(O)ccc14.C34=O
|
O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)N1CCCN(C(=O)c2cccc(F)c2)CC1
|
O=CN[C@@H]C[C@H]CC[C@@H]6O5))))))))NCCCNC=O)cccccF)c6)))))))CC7
|
[O][=C][Branch1][=N][N][C@@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][O][Ring1][Branch1][N][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][S]
|
N14CCCN5CC1.[C@@H]16C[C@H]2CC[C@@H]1O2.c17cccc(F)c1.O=C34.C57=O.N36
|
C=C[C@](C)(O)CC(=O)N1CCN(C(=O)[C@@H](F)C2CCC2)C2(CCC2)C1
|
C=C[C@]C)O)CC=O)NCCNC=O)[C@@H]F)CCCC4))))))CCCC4)))C6
|
[C][=C][C@][Branch1][C][C][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][C][C][Ring1][Ring2][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][P]
|
N13CCN4C2(CCC2)C1.C=C[C@](C)(O)CC3=O.C4(=O)[C@H]5F.C15CCC1
|
N#CCCCC(=O)N1C[C@H]2C[C@H](CNC(=O)c3ccoc3Br)C[C@H]1C2
|
N#CCCCC=O)NC[C@H]C[C@H]CNC=O)cccoc5Br)))))))))C[C@H]7C6
|
[N][#C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][Br][C][C@H1][Ring1][P][C][Ring1][S]
|
N14C[C@H]2C[C@H]8C[C@H]1C2.N#CCCCC4=O.c17ccoc1Br.C57=O.C68.N56
|
CC[C@@](C)(OC)C(=O)NC1CC2(CCN(C(=O)[C@H](C)OC3COC3)C2)C1
|
CC[C@@]C)OC))C=O)NCCCCCNC=O)[C@H]C)OCCOC4)))))))C5))))C4
|
[C][C][C@@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][C][O][C][Ring1][Ring2][C][Ring1][=C][C][Ring1][P]
|
C19CC2(CCN5C2)C1.CC[C@]6(C)C4=O.C5(=O)[C@@H]7C.C18COC1.O6C.N49.O78
|
O=C(NC[C@H]1CC2(CC2)CN1C(=O)C1CC1)[C@@H](Cc1ccccc1)n1cnnn1
|
O=CNC[C@H]CCCC3))CN5C=O)CCC3)))))))))))[C@@H]Ccccccc6)))))))ncnnn5
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C@H1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][N][=N][Ring1][Branch1]
|
[C@H]18CC2(CC2)CN14.O=C3[C@H]7C9.c19ccccc1.n17cnnn1.C46=O.C16CC1.N35.C58
|
C=C[C@](O)(C(=O)N1C[C@H](C)[C@H](NC(=O)CNC=O)C1)C(F)(F)F
|
C=C[C@]O)C=O)NC[C@H]C)[C@H]NC=O)CNC=O))))))C5))))))CF)F)F
|
[C][=C][C@][Branch1][C][O][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch1][#Branch2][N][C][=Branch1][C][=O][C][N][C][=O][C][Ring1][=N][C][Branch1][C][F][Branch1][C][F][F]
|
C=C[C@](O)(C2=O)C(F)(F)F.N12C[C@@H]5[C@@H](C)C1.C3(=O)C4.N4C=O.N35
|
Cn1nc(C(=O)N[C@@H](C(=O)NC2(C)CSC2)c2ccnn2C)cc1Cl
|
CnncC=O)N[C@@H]C=O)NCC)CSC4))))))cccnn5C)))))))))cc5Cl
|
[C][N][N][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][S][C][Ring1][Branch1][C][=C][C][=N][N][Ring1][Branch1][C][C][=C][Ring2][Ring1][#Branch1][Cl]
|
Cn1nc7cc1Cl.c18ccnn1C.[C@@H]58C4=O.C16(C)CSC1.C37=O.N35.N46
|
COc1ccc(CC(=O)N(C)[C@H](C)CN(C)C(=O)Cc2cc[nH]c2)c(Cl)c1OC
|
COccccCC=O)NC)[C@H]C)CNC)C=O)Cccc[nH]c5)))))))))))))cCl)c6OC
|
[C][O][C][=C][C][=C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][NH1][C][=Ring1][Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][=Branch2][O][C]
|
c15ccc9c(Cl)c16.c1%10cc[nH]c1.C9C3=O.[C@@H]7(C)C8.C4(=O)C%10.N37C.N48C.CO5.O6C
|
Cc1[nH]cc(C(=O)N[C@H](C)[C@@H](NC(=O)C2=CCS(=O)(=O)C2)C(C)C)c(=O)c1Cl
|
Cc[nH]ccC=O)N[C@H]C)[C@@H]NC=O)C=CCS=O)=O)C5)))))))CC)C))))))c=O)c6Cl
|
[C][C][NH1][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=Ring2][Ring1][#Branch2][Cl]
|
Cc1[nH]cc7c(=O)c1Cl.C4(=O)C1=CCS(=O)(=O)C1.[C@@H]5(C)[C@@H]6C(C)C.C37=O.N35.N46
|
CC(C)(C)OC(=O)NCC[C@@H](F)CNC(=O)c1ccc(N)c(OC(F)(F)F)c1
|
CCC)C)OC=O)NCC[C@@H]F)CNC=O)ccccN)cOCF)F)F)))c6
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][F][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][N]
|
c19ccc(N)c6c1.C7C[C@@H](F)C8.O6C(F)(F)F.CC5(C)C.C23=O.C49=O.O25.N37.N48
|
CC(C)=CCC(=O)N[C@@H]1C[C@@H]1CNC(=O)C1=CNS(=O)(=O)N=C1C
|
CCC)=CCC=O)N[C@@H]C[C@@H]3CNC=O)C=CNS=O)=O)N=C6C
|
[C][C][Branch1][C][C][=C][C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][N][S][=Branch1][C][=O][=Branch1][C][=O][N][=C][Ring1][Branch2][C]
|
C3(=O)C1=CNS(=O)(=O)N=C1C.C=6CC2=O.[C@@H]15C[C@@H]17.CC=6C.N25.C47.N34
|
CC(C)(F)CCC(=O)N1C[C@@H](O)C[C@@H](NC(=O)c2cnc3c(c2)NC(=O)CN3)C1
|
CCC)F)CCC=O)NC[C@@H]O)C[C@@H]NC=O)ccnccc6)NC=O)CN6)))))))))))C6
|
[C][C][Branch1][C][C][Branch1][C][F][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C@@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][Ring1][Branch2][C][Ring2][Ring1][Branch1]
|
c17cnc2c(c1)NC(=O)CN2.CC(C)(F)CCC4=O.N14C[C@H]6C[C@H](O)C1.C57=O.N56
|
CCN1CCN(S(=O)(=O)c2cccc(N[C@@H](C)[C@H]3CCCOCC3)c2)CC1
|
CCNCCNS=O)=O)cccccN[C@@H]C)[C@H]CCCOCC7)))))))))c6)))))))CC6
|
[C][C][N][C][C][N][Branch2][Ring1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#C][N][C@@H1][Branch1][C][C][C@H1][C][C][C][O][C][C][Ring1][#Branch1][=C][Ring1][S][C][C][Ring2][Ring1][=Branch2]
|
S6(=O)(=O)c1cccc7c1.N14CCN6CC1.[C@H]18CCCOCC1.[C@@H]58C.CC4.N57
|
CCCCC[C@H](F)C(=O)NC1(C(=O)N(C)Cc2nncn2C)CCCCC1
|
CCCCC[C@H]F)C=O)NCC=O)NC)Ccnncn5C)))))))))CCCCC6
|
[C][C][C][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=N][N][=C][N][Ring1][Branch1][C][C][C][C][C][C][Ring1][P]
|
CCCCC[C@H](F)C3=O.C157CCCCC1.c18nncn1C.C47=O.N46C.N35.C68
|
COC(=Cc1ccccc1)C(=O)N1CC(C)(NC(=O)CN(C)S(=O)(=O)N(C)C)C1
|
COC=Ccccccc6)))))))C=O)NCCC)NC=O)CNC)S=O)=O)NC)C)))))))C4
|
[C][O][C][=Branch1][#Branch2][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][C][Ring1][P]
|
N5(C)S(=O)(=O)N(C)C.C=6c1ccccc1.COC=6C2=O.N12CC4(C)C1.C3(=O)C5.N34
|
CN(CCNC(=O)c1cc(O)c2ccsc2c1)C(=O)[C@@H]1C(F)(F)C12CC2
|
CNCCNC=O)cccO)cccsc5c9)))))))))))))C=O)[C@@H]CF)F)C3CC3
|
[C][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=C][S][C][Ring1][Branch1][=C][Ring1][#Branch2][C][=Branch1][C][=O][C@@H1][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch1][C][C][Ring1][Ring1]
|
c18cc(O)c2ccsc2c1.[C@@H]17C(F)(F)C12CC2.CN45.C5C6.C38=O.C47=O.N36
|
CCCC1(C(=O)NCC[C@]2(C)CCN(C(=O)c3ccccc3[S@@+]([O-])CC)C2)CC1
|
CCCCC=O)NCC[C@]C)CCNC=O)cccccc6[S@@+][O-])CC))))))))))C5)))))))))CC3
|
[C][C][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S@@+1][Branch1][C][O-1][C][C][C][Ring2][Ring1][C][C][C][Ring2][Ring1][#Branch2]
|
c18ccccc1[S@@+]([O-])CC.[C@@]1%10(C)CCN5C1.C179CC1.CCC9.C47=O.C6C%10.C58=O.N46
|
CN(CC(F)(F)CO)C(=O)[C@H]1CC12CCN(C(=O)C[C@@H]1CCOC1)CC2
|
CNCCF)F)CO))))C=O)[C@H]CC3CCNC=O)C[C@@H]CCOC5)))))))CC6
|
[C][N][Branch1][O][C][C][Branch1][C][F][Branch1][C][F][C][O][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C@@H1][C][C][O][C][Ring1][Branch1][C][C][Ring1][=C]
|
[C@H]16CC12CCN4CC2.C5C(F)(F)CO.[C@@H]17CCOC1.C4(=O)C7.CN35.C36=O
|
CCCc1cc(C(=O)N2CCCC[C@H]2CNC(=O)Cc2cc(C)ns2)cc(O)n1
|
CCCcccC=O)NCCCC[C@H]6CNC=O)CcccC)ns5))))))))))))))))ccO)n6
|
[C][C][C][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][C][=N][S][Ring1][=Branch1][=C][C][Branch1][C][O][=N][Ring2][Ring1][#Branch2]
|
c18cc6cc(O)n1.N13CCCC[C@H]17.c19cc(C)ns1.C4(=O)C9.CCC8.C36=O.C57.N45
|
CSCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3cn[nH]c3)cn2)C(C)(C)C1
|
CSCC=O)N[C@@H]CNC=O)cccc-ccn[nH]c5)))))cn6)))))))CC)C)C5
|
[C][S][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][C][C][=N][NH1][C][=Ring1][Branch1][C][=N][Ring1][O][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][Ring2]
|
[C@@H]17CN5C(C)(C)C1.c18ccc9cn1.c19cn[nH]c1.C6C4=O.C58=O.CS6.N47
|
C[C@H](CNC(=O)[C@H]1C[C@H]2CC[C@H]2C1)[C@H](F)C(=O)NCc1ncn(C)n1
|
C[C@H]CNC=O)[C@H]C[C@H]CC[C@H]4C7))))))))))[C@H]F)C=O)NCcncnC)n5
|
[C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][C][C@H1][C][C][C@H1][Ring1][Ring2][C][Ring1][#Branch1][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][N][=C][N][Branch1][C][C][N][=Ring1][=Branch1]
|
C[C@H](C5)[C@H](F)C4=O.[C@H]17C[C@H]2CC[C@H]2C1.c18ncn(C)n1.C37=O.N35.N46.C68
|
Cn1cccc1CC(=O)N1CCC[C@H](NC(=O)c2cc(F)cc3ccccc23)C1
|
Cncccc5CC=O)NCCC[C@H]NC=O)cccF)ccccccc%106))))))))))))C6
|
[C][N][C][=C][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1][C][Ring2][Ring1][Ring2]
|
c17cc(F)cc2ccccc12.N14CCC[C@H]6C1.Cn1cccc18.C8C4=O.C57=O.N56
|
C[C@@H]1[C@@H](NC(=O)C2=COCCC2)CCN1C(=O)c1cnc(CCC(F)(F)F)s1
|
C[C@@H][C@@H]NC=O)C=COCCC6))))))))CCN5C=O)ccncCCCF)F)F))))s5
|
[C][C@@H1][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][O][C][C][C][Ring1][=Branch1][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][O][C][C][C][Branch1][C][F][Branch1][C][F][F][S][Ring1][O]
|
C3(=O)C1=COCCC1.C[C@@H]1[C@@H]5CCN14.c16cnc7s1.C7CC(F)(F)F.C46=O.N35
|
CC(C)C[C@@H](O)C(=O)N1CCC[C@](C)(CNC(=O)c2cc(C(C)C)no2)C1
|
CCC)C[C@@H]O)C=O)NCCC[C@]C)CNC=O)cccCC)C))no5))))))))C6
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][O][Ring1][Branch2][C][Ring2][Ring1][Ring1]
|
CC(C)C[C@@H](O)C3=O.N13CCC[C@@]8(C)C1.c16cc7no1.C46=O.C7(C)C.C58.N45
|
CCc1nccnc1CNC(=O)[C@H](CCCOC)NC(=O)C[C@@]1(C)CCOC1
|
CCcnccnc6CNC=O)[C@H]CCCOC)))))NC=O)C[C@@]C)CCOC5
|
[C][C][C][=N][C][=C][N][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][O][C][N][C][=Branch1][C][=O][C][C@@][Branch1][C][C][C][C][O][C][Ring1][=Branch1]
|
C2(=O)[C@@H]6CCC4.c17nccnc18.[C@]19(C)CCOC1.C3(=O)C9.CC7.C58.N25.O4C.N36
|
Cc1cc(CCC(=O)N2CCO[C@@H](C(=O)N[C@@H](C)c3cccs3)C2)on1
|
CcccCCC=O)NCCO[C@@H]C=O)N[C@@H]C)ccccs5))))))))C6)))))))))on5
|
[C][C][C][=C][Branch2][Ring1][P][C][C][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=C][C][=C][S][Ring1][Branch1][C][Ring1][S][O][N][=Ring2][Ring1][=Branch2]
|
N14CCO[C@@H]7C1.Cc1cc8on1.C8CC4=O.c19cccs1.C57=O.[C@@H]69C.N56
|
C=CCC1(NC(=O)C[C@@H]2CCCCC2(F)F)CN(C(=O)CC[C@@H]2CCCO2)C1
|
C=CCCNC=O)C[C@@H]CCCCC6F)F))))))))))CNC=O)CC[C@@H]CCCO5))))))))C4
|
[C][=C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][C][C][Ring1][=Branch1][Branch1][C][F][F][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][O][Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
[C@@H]18CCCCC1(F)F.C157CN4C1.C4(=O)CC6.[C@@H]16CCCO1.C3(=O)C8.C=CC7.N35
|
C[C@]1(CNC(=O)CCF)COCCN(C(=O)c2c(F)cc(C(F)(F)F)cc2F)C1
|
C[C@]CNC=O)CCF))))))COCCNC=O)ccF)ccCF)F)F))cc6F))))))))C7
|
[C][C@][Branch1][#Branch2][C][N][C][=Branch1][C][=O][C][C][F][C][O][C][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][F][C][Ring2][Ring1][N]
|
C[C@]17COCCN4C1.c16c(F)cc8cc1F.C3(=O)CCF.C8(F)(F)F.C46=O.C57.N35
|
CCCC(=O)N[C@@H]1CN(C(=O)COCCc2cccc(F)c2)C[C@@H]2CCC[C@@H]21
|
CCCC=O)N[C@@H]CNC=O)COCCcccccF)c6)))))))))))C[C@@H]CCC[C@@H]59
|
[C][C][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][O][C][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C@@H1][C][C][C][C@@H1][Ring1][Branch1][Ring2][Ring1][=Branch1]
|
[C@@H]17CN4C[C@@H]2CCC[C@@H]21.c18cccc(F)c1.CCCC3=O.C4(=O)C5.C6C8.N37.O56
|
Cc1nc(C)c(C(=O)NC[C@@]23CCC[C@@H]2N(C(=O)c2ccon2)CCC3)[nH]1
|
CcncC)cC=O)NC[C@@]CCC[C@@H]5NC=O)cccon5))))))CCC9))))))))))))[nH]5
|
[C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@][C][C][C][C@@H1][Ring1][Branch1][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][O][N][=Ring1][Branch1][C][C][C][Ring1][S][NH1][Ring2][Ring1][#Branch2]
|
[C@@]129CCC[C@@H]1N5CCC2.Cc1nc(C)c7[nH]1.c18ccon1.C47=O.C58=O.N46.C69
|
CO[C@]1(C(=O)N(C)C2CN(C(=O)c3nccnc3C)C2)CCCOC1
|
CO[C@]C=O)NC)CCNC=O)cnccnc6C))))))))C4))))))CCCOC6
|
[C][O][C@][Branch2][Ring1][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=N][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][=N][C][C][C][O][C][Ring2][Ring1][#Branch1]
|
[C@@]169CCCOC1.c18nccnc1C.C17CN5C1.C49=O.N47C.C58=O.CO6
|
CC[C@H](C)CCCCC(=O)N[C@H]1C=CCN(C(=O)c2cccc([S@@+](C)[O-])c2)C1
|
CC[C@H]C)CCCCC=O)N[C@H]C=CCNC=O)ccccc[S@@+]C)[O-]))c6)))))))C6
|
[C][C][C@H1][Branch1][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][=C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][S@@+1][Branch1][C][C][O-1][=C][Ring1][=Branch2][C][Ring1][P]
|
CC[C@H](C)CCCCC3=O.c16cccc([S@@+](C)[O-])c1.[C@H]15C=CCN4C1.C46=O.N35
|
COC[C@](C)(O)C(=O)N[C@H]1C[C@@H](CN=c2c([N+](=O)[O-])c[nH]c3ccc(F)cc23)C1
|
COC[C@]C)O)C=O)N[C@H]C[C@@H]CN=cc[N+]=O)[O-]))c[nH]ccccF)cc%106))))))))))))C4
|
[C][O][C][C@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][O][C][N][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][=C][Ring1][#Branch1][C][Ring2][Ring1][Ring2]
|
C7N=c1c([N+](=O)[O-])c[nH]c2ccc(F)cc12.C5[C@](C)(O)C4=O.[C@H]16C[C@@H]7C1.CO5.N46
|
Cc1cccc(CCC(=O)N[C@H]2CN(C(=O)c3cc(Br)ccc3C)CC23CC3)n1
|
CcccccCCC=O)N[C@H]CNC=O)cccBr)ccc6C))))))))CC5CC3)))))))))))n6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][C][C][C][Ring1][#C][C][C][Ring1][Ring1][=N][Ring2][Ring1][N]
|
[C@H]16CN5CC12CC2.c17cc(Br)ccc1C.Cc1cccc8n1.C8CC4=O.C57=O.N46
|
CC[C@H](O)CCNC(=O)[C@H]1CCCN1c1cnccn1
|
CC[C@H]O)CCNC=O)[C@H]CCCN5ccnccn6
|
[C][C][C@H1][Branch1][C][O][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Ring1][Branch1][C][=C][N][=C][C][=N][Ring1][=Branch1]
|
CC[C@H](O)CC3.[C@H]15CCCN14.c14cnccn1.C25=O.N23
|
C[C@@]1(CNC(=O)[C@H]2CCc3nnc(O)n3C2)CCCN1c1nccc(CC#N)n1
|
C[C@@]CNC=O)[C@H]CCcnncO)n5C9))))))))))))CCCN5cncccCC#N)))n6
|
[C][C@@][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][=N][N][=C][Branch1][C][O][N][Ring1][=Branch1][C][Ring1][#Branch2][C][C][C][N][Ring2][Ring1][Ring1][C][=N][C][=C][C][Branch1][Ring2][C][C][#N][=N][Ring1][=Branch2]
|
[C@H]17CCc2nnc(O)n2C1.C[C@@]18CCCN16.c16nccc9n1.C47=O.C9C#N.C58.N45
|
CN(CC[C@H]1CCCCN1C(=O)COCc1ccnc(O)c1)C(=O)c1ccns1
|
CNCC[C@H]CCCCN6C=O)COCcccncO)c6))))))))))))))))))C=O)cccns5
|
[C][N][Branch2][Ring1][=N][C][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][O][C][C][=C][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=N][S][Ring1][Branch1]
|
[C@H]18CCCCN12.c19ccnc(O)c1.c17ccns1.C2(=O)C4.CN36.C6C8.C37=O.O45.C59
|
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.