SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(C)[C@@H]1C[C@]1(N)C(=O)NC[C@@H](Cc1ccc(F)cc1)C(=O)N(C)C
|
CCC)[C@@H]C[C@]3N)C=O)NC[C@@H]CccccF)cc6)))))))C=O)NC)C
|
[C][C][Branch1][C][C][C@@H1][C][C@][Ring1][Ring1][Branch1][C][N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C]
|
C4[C@@H](C7)C3=O.c17ccc(F)cc1.[C@@H]16C[C@@]15N.CC6C.C25=O.N3(C)C.N24
|
Cc1cc(C(=O)NCC2CCCN2C(=O)c2c(Cl)cnn2C(C)C)c(C)nc1C
|
CcccC=O)NCCCCCN5C=O)ccCl)cnn5CC)C))))))))))))))))cC)nc6C
|
[C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=N][N][Ring1][=Branch1][C][Branch1][C][C][C][=C][Branch1][C][C][N][=C][Ring2][Ring1][O][C]
|
Cc1cc7c(C)nc1C.c16c(Cl)cnn18.C19CCCN14.C37=O.C46=O.C8(C)C.N35.C59
|
C=CCCCCCCC(=O)N1C[C@@H](O)C[C@@]1(C)C(=O)N(C)CCOC
|
C=CCCCCCCC=O)NC[C@@H]O)C[C@@]5C)C=O)NC)CCOC
|
[C][=C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C@@][Ring1][=Branch1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][O][C]
|
C=CCCCCCCC2=O.N12C[C@@H](O)C[C@]16C.C36=O.N35C.C5C4.O4C
|
Cc1noc(Cl)c1CC(=O)NC[C@@]12CN(C(=O)[C@H]3CCCO3)C[C@@H]1CCO2
|
CcnocCl)c5CC=O)NC[C@@]CNC=O)[C@H]CCCO5))))))C[C@@H]5CCO8
|
[C][C][=N][O][C][Branch1][C][Cl][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C@@][C][N][Branch1][N][C][=Branch1][C][=O][C@H1][C][C][C][O][Ring1][Branch1][C][C@@H1][Ring1][N][C][C][O][Ring1][#C]
|
[C@@]128CN5C[C@@H]1CCO2.Cc1noc(Cl)c19.[C@H]17CCCO1.C9C4=O.C57=O.N46.C68
|
CCC[C@H](NC(C)=O)C(=O)N1CC(NC(=O)C[C@H](O)c2ccc(Cl)cc2)C1
|
CCC[C@H]NCC)=O)))C=O)NCCNC=O)C[C@H]O)ccccCl)cc6))))))))))C4
|
[C][C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Ring1][P]
|
CCC[C@H]6C4=O.c18ccc(Cl)cc1.C5(=O)C[C@@H]8O.N14CC7C1.C3(C)=O.N36.N57
|
C#C[C@@H](C)NC(=O)[C@H]1CC[C@H](CNC(=O)c2cc(C)nnc2O)CC1
|
C#C[C@@H]C)NC=O)[C@H]CC[C@H]CNC=O)cccC)nnc6O))))))))))CC6
|
[C][#C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][N][=C][Ring1][#Branch1][O][C][C][Ring2][Ring1][C]
|
c18cc(C)nnc1O.[C@H]17CC[C@H]9CC1.C#C[C@H]5C.C37=O.C48=O.N35.C69.N46
|
O=C(CC[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1)NCCCn1cnnn1
|
O=CCC[C@H]CCCCN6C=O)ccc[N+]=O)[O-]))n[nH]5))))))))))))))NCCCncnnn5
|
[O][=C][Branch2][Ring1][=N][C][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=N][NH1][Ring1][Branch2][N][C][C][C][N][C][=N][N][=N][Ring1][Branch1]
|
c15cc([N+](=O)[O-])n[nH]1.[C@H]17CCCCN13.O=C2CC7.n16cnnn1.C4CC6.C35=O.N24
|
O=C(COc1ccsn1)N[C@H]1COCC[C@H]1C(=O)NC1CCSCC1
|
O=CCOcccsn5)))))))N[C@H]COCC[C@H]6C=O)NCCCSCC6
|
[O][=C][Branch1][#Branch2][C][O][C][C][=C][S][N][=Ring1][Branch1][N][C@H1][C][O][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][S][C][C][Ring1][=Branch1]
|
[C@H]16COCC[C@H]18.C17CCSCC1.c15ccsn1.O=C2C4.C38=O.O45.N26.N37
|
CCC1([C@@H](C(=O)Nc2ccccc2OC)N(C)Cc2csc3ccccc23)CC1
|
CCC[C@@H]C=O)Ncccccc6OC))))))))))NC)Cccscccccc96))))))))))))CC3
|
[C][C][C][Branch2][Ring2][Branch1][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][N][Branch1][C][C][C][C][=C][S][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][C][Ring2][Ring1][O]
|
c1%11csc2ccccc12.c18ccccc15.[C@H]6%10C4=O.C19%10CC1.N67C.CC9.N48.O5C.C7%11
|
NC(=O)c1ccc(C(=O)N2C[C@H](NC(=O)c3ccsc3)C[C@]23CCCOC3)cc1
|
NC=O)ccccC=O)NC[C@H]NC=O)cccsc5)))))))C[C@]5CCCOC6)))))))))))cc6
|
[N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][C@][Ring1][=N][C][C][C][O][C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch2]
|
N14C[C@H]6C[C@]12CCCOC2.c17ccc8cc1.c19ccsc1.NC7=O.C48=O.C59=O.N56
|
C#Cc1ccc(C(=O)N(C)[C@H]2CCOc3cc(F)ccc32)c(F)c1
|
C#CccccC=O)NC)[C@H]CCOcccF)ccc6%10))))))))))))cF)c6
|
[C][#C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][O][C][Branch1][C][F][=C][Ring2][Ring1][=Branch1]
|
N4(C)[C@H]1CCOc2cc(F)ccc21.C#Cc1ccc5c(F)c1.C45=O
|
C[C@H](C(=O)NCc1ccc(S(N)(=O)=O)cc1)c1ccccc1
|
C[C@H]C=O)NCccccSN)=O)=O))cc6)))))))))cccccc6
|
[C][C@H1][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
c15ccc(S(N)(=O)=O)cc1.c14ccccc1.C[C@@H]4C2=O.N23.C35
|
COc1ccc([C@H](C)NC(=O)Cc2ccc(Cl)cc2OC)cc1Br
|
COcccc[C@H]C)NC=O)CccccCl)cc6OC))))))))))))cc6Br
|
[C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][C][C][=C][Ring2][Ring1][Branch1][Br]
|
c14ccc7cc1Br.c18ccc(Cl)cc15.C3(=O)C8.[C@@H]67C.CO4.N36.O5C
|
CCc1cc(CNC(=O)[C@H]2COC[C@H]2NC(=O)CC[C@H](C)SC)on1
|
CCcccCNC=O)[C@H]COC[C@H]5NC=O)CC[C@H]C)SC)))))))))))))))on5
|
[C][C][C][C][=C][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][C@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C@H1][Branch1][C][C][S][C][O][N][=Ring2][Ring1][#Branch1]
|
C4(=O)CC[C@@H]6C.c19cc%10on1.[C@H]18COC[C@H]17.C38=O.CC9.C5%10.N35.N47.S6C
|
CC(C)C[C@@H](O)C(=O)NC[C@H](C)NC(=O)C=Cc1cnc[nH]1
|
CCC)C[C@@H]O)C=O)NC[C@H]C)NC=O)C=Cccnc[nH]5
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][NH1][Ring1][Branch1]
|
CC(C)C[C@@H](O)C2=O.C=6c1cnc[nH]1.C4[C@@H]5C.C3(=O)C=6.N24.N35
|
CCCCCS(=O)(=O)CC(=O)NC[C@@H](CC(C)C)NC(=O)C1CC2(CCCC2)C1
|
CCCCCS=O)=O)CC=O)NC[C@@H]CCC)C)))NC=O)CCCCCCC5))))C4
|
[C][C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Ring1][Branch2]
|
CCCCCS(=O)(=O)CC3=O.C17CC2(CCCC2)C1.C5[C@H]6CC(C)C.C47=O.N35.N46
|
CCc1nc(CN2CCN([C@@H]3CCCN(C(=O)C[C@H](C)C4CC4)C3)C(=O)C2)cs1
|
CCcncCNCCN[C@@H]CCCNC=O)C[C@H]C)CCC3))))))C6))))))C=O)C6)))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][=Branch2][C][N][C][C][N][Branch2][Ring1][=Branch2][C@@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring1][=C][C][=Branch1][C][=O][C][Ring2][Ring1][Branch1][=C][S][Ring2][Ring1][O]
|
N16CCN%10C(=O)C1.[C@@H]1%10CCCN5C1.c17nc8cs1.C5(=O)C[C@@H]9C.C19CC1.CC7.C68
|
CCn1cc(C(=O)N2CC(CO)(NC(=O)C[C@H]3C=CCCC3)C2)c(C)n1
|
CCnccC=O)NCCCO))NC=O)C[C@H]C=CCCC6)))))))))C4)))))cC)n5
|
[C][C][N][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][O][Branch1][#C][N][C][=Branch1][C][=O][C][C@H1][C][=C][C][C][C][Ring1][=Branch1][C][Ring1][S][C][Branch1][C][C][=N][Ring2][Ring1][Branch2]
|
n18cc7c(C)n1.N14CC69C1.[C@H]1%10C=CCCC1.C5(=O)C%10.C47=O.CC8.C9O.N56
|
C=C1CC(CC(=O)N2C[C@H]3CCC[C@]3(NC(=O)c3cnn4cccc(Cl)c34)C2)C1
|
C=CCCCC=O)NC[C@H]CCC[C@]5NC=O)ccnnccccCl)c96)))))))))))C8))))))))))C4
|
[C][=C][C][C][Branch2][Ring2][O][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@][Ring1][Branch1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=N][N][C][=C][C][=C][Branch1][C][Cl][C][=Ring1][#Branch2][Ring1][#Branch1][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][N]
|
c18cnn2cccc(Cl)c12.N15C[C@H]2CCC[C@]27C1.C=C1CC9C1.C9C5=O.C68=O.N67
|
CNS(=O)(=O)NCC(=O)N1C[C@H]2CC[C@H]1CN(C(=O)c1cnccc1C)C2
|
CNS=O)=O)NCC=O)NC[C@H]CC[C@H]6CNC=O)ccnccc6C))))))))C7
|
[C][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Ring1][=Branch1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][C][Ring1][S]
|
N13C[C@H]2CC[C@H]1CN4C2.c16cnccc1C.CNS(=O)(=O)N5.C5C3=O.C46=O
|
CC[C@H](C)NC(=NCCc1c[nH]c2cccc(C)c12)NCCN(C)C(=O)OC
|
CC[C@H]C)NC=NCCcc[nH]cccccC)c96))))))))))))NCCNC)C=O)OC
|
[C][C][C@H1][Branch1][C][C][N][C][=Branch2][Ring1][Ring2][=N][C][C][C][=C][NH1][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch2][Ring1][#Branch1][N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][O][C]
|
c18c[nH]c2cccc(C)c12.N5C(=NCC8)N6.CC[C@@H]5C.C6C7.N47C.C34=O.O3C
|
O=C(N[C@@H]1CCN(C(=O)C=Cc2cn[nH]c2)C[C@H]1O)c1ccc(O)nc1
|
O=CN[C@@H]CCNC=O)C=Cccn[nH]c5))))))))C[C@H]6O))))))))ccccO)nc6
|
[O][=C][Branch2][Ring1][#Branch2][N][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][=N][NH1][C][=Ring1][Branch1][C][C@H1][Ring1][#C][O][C][=C][C][=C][Branch1][C][O][N][=C][Ring1][#Branch1]
|
[C@@H]15CCN4C[C@H]1O.c16ccc(O)nc1.C=7c1cn[nH]c1.C4(=O)C=7.O=C36.N35
|
CC(C)C(F)(F)CC(=O)N[C@H]1CCN(C(=O)C(C)(C)c2cccnc2)C[C@H]1CO
|
CCC)CF)F)CC=O)N[C@H]CCNC=O)CC)C)ccccnc6))))))))C[C@H]6CO
|
[C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C@H1][Ring1][P][C][O]
|
CC(C)C(F)(F)CC3=O.[C@H]15CCN4C[C@H]16.C4(=O)C7(C)C.c17cccnc1.N35.C6O
|
C[C@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCCCN1C(=O)c1ccc(C(N)=O)s1
|
C[C@H]OCC[C@@H]5C=O)NC[C@@H]CCCCN6C=O)ccccCN)=O))s5
|
[C][C@H1][O][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][S][Ring1][Branch2]
|
[C@@H]18CCCCN13.C[C@H]1OCC[C@@H]17.c15ccc6s1.C27=O.C35=O.C6(N)=O.N24.C48
|
C[C@@H]1CN(C(=O)[C@@H]2C=CCCC2)C[C@H]1CNC(=O)COc1ccc2c(c1)CCC2
|
C[C@@H]CNC=O)[C@@H]C=CCCC6)))))))C[C@H]5CNC=O)COcccccc6)CCC5
|
[C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][=C][C][C][C][Ring1][=Branch1][C][C@H1][Ring1][=N][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1]
|
c16ccc2c(c1)CCC2.C[C@@H]1CN3C[C@H]19.[C@@H]18C=CCCC1.C4(=O)C5.C38=O.C79.N47.O56
|
CC(C)OCCC(=O)N1CC[C@H]2OCCN(C(=O)C(=O)N3CCC[C@@H](C)C3)[C@H]2C1
|
CCC)OCCC=O)NCC[C@H]OCCNC=O)C=O)NCCC[C@@H]C)C6))))))))[C@H]6C%10
|
[C][C][Branch1][C][C][O][C][C][C][=Branch1][C][=O][N][C][C][C@H1][O][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch1][C@H1][Ring1][P][C][Ring2][Ring1][Branch1]
|
N14CC[C@H]2OCCN5[C@H]2C1.N16CCC[C@@H](C)C1.C8CC4=O.C5(=O)C6=O.CC7C.O78
|
CCC(=O)NCC(=O)NC[C@H]1C[C@H](OC)CN1C(=O)CCN1CCC(O)CC1
|
CCC=O)NCC=O)NC[C@H]C[C@H]OC))CN5C=O)CCNCCCO)CC6
|
[C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch1][Ring1][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1]
|
[C@H]19C[C@H]5CN14.N18CCC(O)CC1.C4(=O)CC8.CCC2=O.C6C3=O.N26.N37.C79.O5C
|
CCN(C(=O)c1cocc1C)[C@@H]1CCCN(C(=O)C[C@@H]2CCCN2C)C1
|
CCNC=O)ccocc5C)))))))[C@@H]CCCNC=O)C[C@@H]CCCN5C))))))))C6
|
[C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][C][C@@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@@H1][C][C][C][N][Ring1][Branch1][C][C][Ring1][#C]
|
[C@@H]16CCCN4C1.c17cocc1C.[C@@H]18CCCN1C.C4(=O)C8.N356.C37=O.CC5
|
CCCn1ncc(C(=O)NC[C@]2(F)C[C@@H](N=c3[nH]c(C(C)C)ncc3Br)C2)c1C
|
CCCnnccC=O)NC[C@]F)C[C@@H]N=c[nH]cCC)C))ncc6Br))))))))C4)))))))c5C
|
[C][C][C][N][N][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch2][Ring1][C][N][=C][NH1][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][C][=C][Ring1][=Branch2][Br][C][Ring1][S][=C][Ring2][Ring1][=Branch2][C]
|
[C@]19(F)C[C@H](N=c2[nH]c8ncc2Br)C1.n17ncc6c1C.CCC7.C46=O.C8(C)C.N45.C59
|
CC(C)n1ccc(CC(=O)N2C[C@@H]3CC[C@@H](C2)N3C(=O)[C@]2(C)CC[C@@H](C)C2)n1
|
CCC)ncccCC=O)NC[C@@H]CC[C@@H]C7)N5C=O)[C@]C)CC[C@@H]C)C5)))))))))))))))n5
|
[C][C][Branch1][C][C][N][C][=C][C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch1][=N][Ring2][Ring1][=Branch2]
|
N14C[C@@H]2CC[C@@H](C1)N25.[C@@]16(C)CC[C@@H](C)C1.n17ccc8n1.C8C4=O.CC7C.C56=O
|
C[C@H](O)C(F)(F)C(=O)N1CC2(CC[C@@H]2NC(=O)c2ccc(OC3CCC3)cc2)C1
|
C[C@H]O)CF)F)C=O)NCCCC[C@@H]4NC=O)ccccOCCCC4)))))cc6)))))))))))C4
|
[C][C@H1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][N][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][O][C][C][C][C][Ring1][Ring2][C][=C][Ring1][O][C][Ring2][Ring1][Branch1]
|
C[C@H](O)C(F)(F)C4=O.N14CC2(CC[C@@H]28)C1.c19ccc7cc1.C16CCC1.C59=O.N58.O67
|
CCCCCCn1nnnc1[C@@H](NCc1noc(C)n1)C1(CF)CC1
|
CCCCCCnnnnc5[C@@H]NCcnocC)n5)))))))CCF))CC3
|
[C][C][C][C][C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][=N][N][C][C][=N][O][C][Branch1][C][C][=N][Ring1][=Branch1][C][Branch1][Ring1][C][F][C][C][Ring1][Branch1]
|
CCCCCC4.n14nnnc15.c16noc(C)n1.C178CC1.[C@@H]257.N23.C36.C8F
|
CCCNC(=O)[C@@H](c1ccc(F)c(C)c1)N1CCCC[C@@H]1COC(=O)N(C)C
|
CCCNC=O)[C@@H]ccccF)cC)c6))))))NCCCC[C@@H]6COC=O)NC)C
|
[C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][C][=C][Ring1][Branch2][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][O][C][=Branch1][C][=O][N][Branch1][C][C][C]
|
c19ccc(F)c(C)c1.N17CCCC[C@@H]18.C3(=O)[C@H]79.CCC6.C24=O.N4(C)C.N36.C58.O25
|
O=C(Nc1ccccc1OC(F)(F)F)[C@H]1C[C@H](F)CN(C(=O)c2cc[nH]n2)C1
|
O=CNcccccc6OCF)F)F))))))))))[C@H]C[C@H]F)CNC=O)ccc[nH]n5))))))C6
|
[O][=C][Branch2][Ring1][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][C@H1][C][C@H1][Branch1][C][F][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][NH1][N][=Ring1][Branch1][C][Ring1][=C]
|
[C@H]18C[C@H](F)CN4C1.c16ccccc15.O5C(F)(F)F.c17cc[nH]n1.O=C38.C47=O.N36
|
CCc1nc([C@H](C)NC(=O)Cn2nc(Br)c(Br)n2)cs1
|
CCcnc[C@H]C)NC=O)CnncBr)cBr)n5)))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring1][Branch2][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][N][=C][Branch1][C][Br][C][Branch1][C][Br][=N][Ring1][#Branch1][=C][S][Ring2][Ring1][C]
|
n15nc(Br)c(Br)n1.c16nc7cs1.C3(=O)C5.[C@@H]47C.CC6.N34
|
CC1(C)CCN(C(=O)C(C2CC2)C2CC2)[C@@H]1C(=O)NCC1(F)CCOCC1
|
CCC)CCNC=O)CCCC3)))CCC3)))))[C@@H]5C=O)NCCF)CCOCC6
|
[C][C][Branch1][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][Ring1][C@@H1][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][C][O][C][C][Ring1][#Branch1]
|
CC1(C)CCN3[C@@H]16.C19(F)CCOCC1.C3(=O)C78.C17CC1.C18CC1.C46=O.N45.C59
|
C#CCCCCNC(=O)C1(CNC(=O)CCCn2cncn2)CC(=C)C1
|
C#CCCCCNC=O)CCNC=O)CCCncncn5)))))))))))CC=C)C4
|
[C][#C][C][C][C][C][N][C][=Branch1][C][=O][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C][N][C][=N][C][=N][Ring1][Branch1][C][C][=Branch1][C][=C][C][Ring1][P]
|
C#CCCCC5.C179CC(=C)C1.C4(=O)CCC8.n18cncn1.C37=O.N35.C69.N46
|
CC(C)(C)n1nccc1C(=O)N[C@H](CNC(=O)CCCCC1CC1)C1CC1
|
CCC)C)nnccc5C=O)N[C@H]CNC=O)CCCCCCC3))))))))))CCC3
|
[C][C][Branch1][C][C][Branch1][C][C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][Ring1][C][C][C][Ring1][Ring1]
|
C3(=O)CCCC9.n17nccc16.CC7(C)C.[C@H]48C5.C26=O.C19CC1.C18CC1.N24.N35
|
CCc1ccc(C(=O)NC[C@H]2C[C@@H](CNC(=O)CC3(COC)CC3)CO2)c(F)c1
|
CCccccC=O)NC[C@H]C[C@@H]CNC=O)CCCOC)))CC3)))))))CO5))))))))cF)c6
|
[C][C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][Branch1][Ring2][C][O][C][C][C][Ring1][=Branch1][C][O][Ring1][S][C][Branch1][C][F][=C][Ring2][Ring1][O]
|
c16ccc%11c(F)c1.[C@H]1%12C[C@@H]%13CO1.C7(=O)C%14.C1%145CC1.C4%11=O.CC6.N49.C9%12.C%10%13.N7%10.C85.O8C
|
CN1CCC[C@@H]1CCC(=O)NCC1=CCN(C(=O)C[C@@H]2CC3CCC2CC3)CC1
|
CNCCC[C@@H]5CCC=O)NCC=CCNC=O)C[C@@H]CCCCC6CC6))))))))))CC6
|
[C][N][C][C][C][C@@H1][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C@@H1][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1][C][C][Ring1][P]
|
C6C1=CCN5CC1.[C@@H]18CC2CCC1CC2.CN1CCC[C@@H]17.C7CC4=O.C5(=O)C8.N46
|
C[C@@H](CCC(C)(C)C)C(=O)N(C)C[C@@H]1CN(C(=O)c2cn(C)c(=O)n2C)CCO1
|
C[C@@H]CCCC)C)C))))C=O)NC)C[C@@H]CNC=O)ccnC)c=O)n5C)))))))CCO6
|
[C][C@@H1][Branch1][O][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][C][O][Ring1][S]
|
C[C@@H](CCC(C)(C)C)C3=O.c16cn(C)c(=O)n1C.[C@@H]17CN4CCO1.N35C.C46=O.C57
|
C#Cc1cccc(C(=O)N2CCC[C@H](N(CC)C(=O)CC3CC(=C)C3)C2)c1C
|
C#CcccccC=O)NCCC[C@H]NCC))C=O)CCCC=C)C4)))))))C6)))))))c6C
|
[C][#C][C][=C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Ring2][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=C][C][Ring1][Branch1][C][Ring1][P][=C][Ring2][Ring1][=Branch2][C]
|
C#Cc1cccc8c1C.N14CCC[C@H]7C1.C19CC(=C)C1.C5(=O)C9.C48=O.N567.C6C
|
Cc1ccc(C(=O)N2CCCC[C@]3(CCN(C(=O)C4CC(F)(F)C4)C3)C2)o1
|
CccccC=O)NCCCC[C@]CCNC=O)CCCF)F)C4)))))C5))))C7))))))))o5
|
[C][C][=C][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][C][C][C@][Branch2][Ring1][=Branch2][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][Ring1][=N][C][Ring2][Ring1][Ring1][O][Ring2][Ring1][#Branch2]
|
N15CCCC[C@]2(CCN6C2)C1.Cc1ccc7o1.C18CC(F)(F)C1.C57=O.C68=O
|
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)N[C@H]2C[C@H](c3ccccc3Cl)C2)c1
|
COC=O)cccCl)ccNC=O)C=O)N[C@H]C[C@H]cccccc6Cl)))))))C4))))))))c6
|
[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Ring1][O][=C][Ring2][Ring1][Branch2]
|
c19cc7cc(Cl)c1.c1%10ccccc1Cl.C5(=O)C6=O.[C@H]18C[C@H]%10C1.C49=O.CO4.N57.N68
|
C=C1CCC(C(=O)N2CC(F)(F)C[C@H]2CNC(=O)[C@@H](O)c2ccnn2C)CC1
|
C=CCCCC=O)NCCF)F)C[C@H]5CNC=O)[C@@H]O)cccnn5C))))))))))))))))CC6
|
[C][=C][C][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][Ring2][Ring1][O]
|
N13CC(F)(F)C[C@H]17.C=C1CCC6CC1.c18ccnn1C.C4(=O)[C@H]8O.C36=O.C57.N45
|
O=C([C@H](O)c1cnc[nH]1)N1CCN(C2CN(C(=O)[C@H](F)C3(O)CCCC3)C2)CC1
|
O=C[C@H]O)ccnc[nH]5))))))NCCNCCNC=O)[C@H]F)CO)CCCC5)))))))C4))))CC6
|
[O][=C][Branch1][N][C@H1][Branch1][C][O][C][=C][N][=C][NH1][Ring1][Branch1][N][C][C][N][Branch2][Ring1][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][Branch1][C][O][C][C][C][C][Ring1][=Branch1][C][Ring1][=C][C][C][Ring2][Ring1][Ring2]
|
N14CCN6CC1.C18(O)CCCC1.O=C4[C@@H]7O.c17cnc[nH]1.C16CN5C1.C5(=O)[C@@H]8F
|
C[C@H](C(=O)NC[C@@H]1CC2(CCN(C(=O)[C@@H](C)C(C)(F)F)CC2)CO1)[C@@H]1CCOC1
|
C[C@H]C=O)NC[C@@H]CCCCNC=O)[C@@H]C)CC)F)F))))CC6)))))CO5))))))))[C@@H]CCOC5
|
[C][C@H1][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch2][Ring1][#Branch2][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][F][F][C][C][Ring1][=C][C][O][Ring2][Ring1][C][C@@H1][C][C][O][C][Ring1][Branch1]
|
[C@@H]16CC2(CCN4CC2)CO1.C4(=O)[C@@H](C)C(C)(F)F.C[C@@H]7C3=O.[C@@H]17CCOC1.N35.C56
|
CCC1=C(C(=O)N[C@H]2C[C@@H](C(=O)NC[C@H]3COC(C)(C)C3)C2)CCCO1
|
CCC=CC=O)N[C@H]C[C@@H]C=O)NC[C@H]COCC)C)C5))))))))C4))))))CCCO6
|
[C][C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@H1][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][C][Ring1][#C][C][C][C][O][Ring2][Ring1][Branch2]
|
CCC1=C(C4=O)CCCO1.[C@H]19COC(C)(C)C1.[C@H]17C[C@@H]8C1.C58=O.N47.N56.C69
|
CC(C)C[C@@H](C)C(=O)N[C@H]1C[C@@H]2[C@H](C1)[C@H]2NC(=O)C(F)(F)CO
|
CCC)C[C@@H]C)C=O)N[C@H]C[C@@H][C@H]C5)[C@H]3NC=O)CF)F)CO
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][O]
|
CC(C)C[C@@H](C)C3=O.[C@@H]15C[C@@H]2[C@@H]6[C@@H]2C1.C4(=O)C(F)(F)CO.N35.N46
|
C[C@](O)(CNC(=O)C1=C(Cl)CCC1)CNC(=O)c1ccc(N)c(F)c1
|
C[C@]O)CNC=O)C=CCl)CCC5))))))))CNC=O)ccccN)cF)c6
|
[C][C@][Branch1][C][O][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][C][C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][Branch1][C][F][=C][Ring1][Branch2]
|
C2(=O)C1=C(Cl)CCC1.c16ccc(N)c(F)c1.C[C@](O)(C4)C5.C36=O.N24.N35
|
CN1CCN(CC(=O)N2CCC[C@@H]2c2cn(CC(C)(C)C)nn2)CC1=O
|
CNCCNCC=O)NCCC[C@@H]5ccnCCC)C)C)))nn5))))))))))))CC6=O
|
[C][N][C][C][N][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][=C][N][Branch1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][N][=N][Ring1][#Branch2][C][C][Ring2][Ring1][Branch2][=O]
|
CN1CCN4CC1=O.N13CCC[C@@H]16.c16cn5nn1.C5C(C)(C)C.C4C3=O
|
COC(=O)[C@@H]1CCN(C(=O)NCc2ccccc2Cn2ccnc2)[C@@H]1C
|
COC=O)[C@@H]CCNC=O)NCcccccc6Cnccnc5)))))))))))))))[C@@H]5C
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=C][N][=C][Ring1][Branch1][C@@H1][Ring2][Ring1][Branch1][C]
|
[C@@H]17CCN4[C@@H]1C.c19ccccc1%10.n18ccnc1.C37=O.C45=O.CO3.N56.C69.C8%10
|
CCC[C@H](C(=O)OC)C(=O)N1CCC(C)(C)[C@H](NC(=O)C2=COCCC2)C1
|
CCC[C@H]C=O)OC)))C=O)NCCCC)C)[C@H]NC=O)C=COCCC6))))))))C6
|
[C][C][C][C@H1][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][O][C][C][C][Ring1][=Branch1][C][Ring1][P]
|
CCC[C@H](C3=O)C4=O.N14CCC(C)(C)[C@H]6C1.C5(=O)C1=COCCC1.O3C.N56
|
COC(=O)[C@@H]1COCCN1C(=O)c1c(F)cncc1-c1cccc(O)n1
|
COC=O)[C@@H]COCCN6C=O)ccF)cncc6-cccccO)n6
|
[C][O][C][=Branch1][C][=O][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=N][C][=C][Ring1][#Branch1][C][=C][C][=C][C][Branch1][C][O][=N][Ring1][#Branch1]
|
c15c6cncc1F.[C@@H]14COCCN13.c16cccc(O)n1.C24=O.C35=O.CO2
|
CCCC[C@@H](C(=O)N1C[C@@H]2CC[C@]2(NC(=O)c2cscc2C)C1)C(C)C
|
CCCC[C@@H]C=O)NC[C@@H]CC[C@]4NC=O)ccscc5C))))))))C7))))))))CC)C
|
[C][C][C][C][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][=C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][C][Ring1][S][C][Branch1][C][C][C]
|
CCCC[C@@H](C3=O)C(C)C.N13C[C@@H]2CC[C@]25C1.c16cscc1C.C46=O.N45
|
CCCCC1(NC(=O)[C@@H](C[C@H](C)CC)NC(=O)c2cc(CO)oc2C)CC1
|
CCCCCNC=O)[C@@H]C[C@H]C)CC))))NC=O)cccCO))oc5C)))))))))))CC3
|
[C][C][C][C][C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@@H1][Branch1][Branch2][C][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][Ring1][C][O][O][C][=Ring1][#Branch1][C][C][C][Ring2][Ring1][#Branch1]
|
C3(=O)[C@H]6C[C@H](C)CC.c17cc8oc1C.CCCC9.C159CC1.C47=O.N35.N46.C8O
|
CN(CCCCC(=O)N1C[C@@H](CO)C2(CC2)C1)C(=O)C[C@H]1C[C@@H]1C1CC1
|
CNCCCCC=O)NC[C@@H]CO))CCC3))C5))))))))))C=O)C[C@H]C[C@@H]3CCC3
|
[C][N][Branch2][Ring1][#Branch2][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=Branch2][C][=Branch1][C][=O][C][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][Ring1][Ring1]
|
N13C[C@@H]6C2(CC2)C1.C5CCCC3=O.[C@H]17C[C@@H]1C1CC1.C4(=O)C7.CN45.C6O
|
CN(CC(C)(C)CNC(=O)C1(C#N)CC=CC1)C(=O)Cc1cnn(C)c1
|
CNCCC)C)CNC=O)CC#N))CC=CC5))))))))))C=O)CccnnC)c5
|
[C][N][Branch2][Ring1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][=C][C][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
C16(C#N)CC=CC1.C4C(C)(C)C5.c17cnn(C)c1.C3(=O)C7.CN34.C26=O.N25
|
C=C[C@@](C)(O)C(=O)N1CCOC[C@](F)(CNC(=O)C(F)=Cc2cccnc2)C1
|
C=C[C@@]C)O)C=O)NCCOC[C@]F)CNC=O)CF)=Cccccnc6)))))))))))C7
|
[C][=C][C@@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C][C][O][C][C@][Branch1][C][F][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][C][F][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][Branch1]
|
N13CCOC[C@@]7(F)C1.C=C[C@@](C)(O)C3=O.C=6c1cccnc1.C4(=O)C=6F.C57.N45
|
Cn1ccc(C(=O)N2CCN(C(=O)c3ccn(C)n3)C[C@@H](CO)C2)c1
|
CncccC=O)NCCNC=O)cccnC)n5))))))C[C@@H]CO))C7))))))))c5
|
[C][N][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][C@@H1][Branch1][Ring1][C][O][C][Ring1][P][=C][Ring2][Ring1][Branch2]
|
N14CCN5C[C@@H]8C1.Cn1ccc7c1.c16ccn(C)n1.C47=O.C56=O.C8O
|
CO[C@@H](CO)CN[C@@](C)(CCC(C)(C)C)c1nnnn1CCOCC1CC1
|
CO[C@@H]CO))CN[C@@]C)CCCC)C)C))))cnnnn5CCOCCCC3
|
[C][O][C@@H1][Branch1][Ring1][C][O][C][N][C@@][Branch1][C][C][Branch1][O][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=N][N][=N][N][Ring1][Branch1][C][C][O][C][C][C][C][Ring1][Ring1]
|
[C@@]68(C)CCC(C)(C)C.c18nnnn17.[C@@H]2(C5)CO.C7C3.C19CC1.CO2.N56.O34.C49
|
C[C@H](C(=O)NC[C@H](O)CN=c1[nH]cnc2ccc(Cl)cc12)c1cccc(F)c1
|
C[C@H]C=O)NC[C@H]O)CN=c[nH]cnccccCl)cc%106))))))))))))))))cccccF)c6
|
[C][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][=C][NH1][C][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][O][Ring1][#Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
C4[C@H](O)CN=c1[nH]cnc2ccc(Cl)cc12.c15cccc(F)c1.C[C@@H]5C3=O.N34
|
Cc1c(CCN(C)Cc2ccnc(C(F)(F)F)c2)ccc(Cl)c1Cl
|
CccCCNC)CcccncCF)F)F))c6))))))))))cccCl)c6Cl
|
[C][C][=C][Branch2][Ring1][#Branch2][C][C][N][Branch1][C][C][C][C][=C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][C][Branch1][C][Cl][=C][Ring2][Ring1][=Branch1][Cl]
|
Cc1c6ccc(Cl)c1Cl.c17ccnc5c1.C5(F)(F)F.C6C3.N34C.C47
|
COC(=O)CS(=O)(=O)N1C[C@@H](F)C[C@H]1C(=O)N[C@@H]1CCN(S(C)(=O)=O)C1
|
COC=O)CS=O)=O)NC[C@@H]F)C[C@H]5C=O)N[C@@H]CCNSC)=O)=O))C5
|
[C][O][C][=Branch1][C][=O][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@@H1][Branch1][C][F][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][=Branch2]
|
C2(=O)CS4(=O)=O.N14C[C@@H](F)C[C@H]17.[C@@H]16CCN5C1.S5(C)(=O)=O.C37=O.CO2.N36
|
Brc1cnc(CCN[C@@H](c2ncc[nH]2)C2CCCCC2)nc1
|
BrccncCCN[C@@H]cncc[nH]5)))))CCCCCC6))))))))))nc6
|
[Br][C][=C][N][=C][Branch2][Ring1][=Branch1][C][C][N][C@@H1][Branch1][Branch2][C][=N][C][=C][NH1][Ring1][Branch1][C][C][C][C][C][C][Ring1][=Branch1][N][=C][Ring2][Ring1][Branch1]
|
Brc1cnc5nc1.C17CCCCC1.c16ncc[nH]1.C5C3.[C@H]467.N34
|
COC(=O)[C@]1(C)CCN1C(=O)[C@H]1CN(C(=O)c2c[nH]c(=O)cn2)C[C@@H]1C(C)C
|
COC=O)[C@]C)CCN4C=O)[C@H]CNC=O)cc[nH]c=O)cn6)))))))C[C@@H]5CC)C
|
[C][O][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=O][C][=N][Ring1][#Branch1][C][C@@H1][Ring1][=C][C][Branch1][C][C][C]
|
[C@H]18CN5C[C@@H]19.c17c[nH]c(=O)cn1.[C@@]16(C)CCN14.C36=O.C48=O.C57=O.C9(C)C.CO3
|
CC1=C[C@H](C(=O)N2CC[C@]3(CCCC[C@@H]3NC(=O)c3ncccc3F)C2)SC1
|
CC=C[C@H]C=O)NCC[C@]CCCC[C@@H]6NC=O)cncccc6F))))))))))))))C5))))))SC5
|
[C][C][=C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch2][Ring1][=Branch1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][F][C][Ring2][Ring1][Ring2][S][C][Ring2][Ring1][O]
|
N14CC[C@]2(CCCC[C@@H]26)C1.c18ncccc1F.CC1=C[C@H]7SC1.C47=O.C58=O.N56
|
Cc1snnc1C(=O)N1CC(CCCCNC(=O)[C@H]2CCC[C@@H](O)C2)C1
|
Ccsnnc5C=O)NCCCCCCNC=O)[C@H]CCC[C@@H]O)C6))))))))))))C4
|
[C][C][S][N][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][C][O][C][Ring1][#Branch1][C][Ring2][Ring1][C]
|
[C@H]17CCC[C@@H](O)C1.Cc1snnc16.N13CC8C1.C8CCC5.C36=O.C47=O.N45
|
CCCC(=O)N1C[C@H]2CCN(C(=O)c3ncc(Br)cc3C)C[C@@H](C2)C1
|
CCCC=O)NC[C@H]CCNC=O)cnccBr)cc6C))))))))C[C@@H]C7)C9
|
[C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C][C@@H1][Branch1][Ring2][C][Ring1][P][C][Ring2][Ring1][Ring2]
|
N14C[C@H]2CCN5C[C@@H](C2)C1.c16ncc(Br)cc1C.CCCC4=O.C56=O
|
CCC(=O)N[C@H](C)C(=O)NC[C@H](CO)CNC(=O)C=CSCc1ccco1
|
CCC=O)N[C@H]C)C=O)NC[C@H]CO))CNC=O)C=CSCcccco5
|
[C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][S][C][C][=C][C][=C][O][Ring1][Branch1]
|
C6[C@@H](C7)CO.C4(=O)C=CS8.[C@@H]5(C)C3=O.c19ccco1.CCC2=O.N25.N36.N47.C89
|
CCCCC[C@@H](O)C(=O)N1CCC2(CCCN2C(=O)c2cnc(F)cc2C)CC1
|
CCCCC[C@@H]O)C=O)NCCCCCCN5C=O)ccncF)cc6C))))))))))))CC6
|
[C][C][C][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][C][Ring2][Ring1][Ring2]
|
N13CCC2(CCCN24)CC1.CCCCC[C@@H](O)C3=O.c15cnc(F)cc1C.C45=O
|
CN(C)CCCCNC(=O)[C@H]1C[C@@H]2C[C@H]2N1C(=O)c1ccncc1C(F)(F)F
|
CNC)CCCCNC=O)[C@H]C[C@@H]C[C@H]3N6C=O)cccncc6CF)F)F
|
[C][N][Branch1][C][C][C][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][C][C@H1][Ring1][Ring1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
[C@H]17C[C@@H]2C[C@H]2N14.c18ccncc19.C5CCC6.C9(F)(F)F.CN5C.C37=O.C48=O.N36
|
COC1(C#N)CC(C(=O)N[C@@H](CN(C)C)C(=O)NOCC=CCl)C1
|
COCC#N))CCC=O)N[C@@H]CNC)C)))C=O)NOCC=CCl))))))))))C4
|
[C][O][C][Branch1][Ring1][C][#N][C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][O][C][C][=C][Cl][C][Ring2][Ring1][=Branch1]
|
[C@H]5(C6)C(=O)NO4.C13(C#N)CC7C1.C4C=CCl.C27=O.N6(C)C.CO3.N25
|
Cc1c[nH]c(C(=O)N2CC[C@](C)(NC(=O)CCCc3nc(C(C)(C)C)no3)C2)c1
|
Ccc[nH]cC=O)NCC[C@]C)NC=O)CCCcncCC)C)C))no5))))))))))C5))))))c5
|
[C][C][=C][NH1][C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][C][C][C][=N][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][O][Ring1][=Branch2][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][N]
|
N14CC[C@@]6(C)C1.Cc1c[nH]c7c1.C5(=O)CCC8.c18nc9no1.C9(C)(C)C.C47=O.N56
|
Cc1nc(C(=O)N(Cc2cnc3ccccn23)[C@H]2CCNCC[C@@H]2C)co1
|
CcncC=O)NCccncccccn96))))))))))[C@H]CCNCC[C@@H]7C))))))))))co5
|
[C][C][=N][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][#C][C][C][=C][N][=C][C][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][C@H1][C][C][N][C][C][C@@H1][Ring1][#Branch1][C][=C][O][Ring2][Ring1][#Branch2]
|
c18cnc2ccccn12.[C@H]16CCNCC[C@@H]1C.Cc1nc7co1.C47=O.N456.C58
|
C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCCN(c2cnccn2)C1
|
C[C@@H]CC=O)ccccF)cc6))))))))C=O)N[C@@H]CCCNccnccn6))))))C6
|
[C][C@@H1][Branch1][P][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][C][Ring1][N]
|
C[C@@H](CC6=O)C3=O.c16ccc(F)cc1.[C@@H]15CCCN4C1.c14cnccn1.N35
|
CN(C)C(=O)C=CC(=O)N1C[C@@H]2C[C@H](NC(=O)c3csc(-c4ccco4)n3)[C@@H]2C1
|
CNC)C=O)C=CC=O)NC[C@@H]C[C@H]NC=O)ccsc-cccco5)))))n5)))))))[C@@H]4C7
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][Ring1][#Branch2][C@@H1][Ring1][P][C][Ring2][Ring1][Ring2]
|
N16C[C@@H]2C[C@H]8[C@@H]2C1.c19csc%11n1.c1%11ccco1.C5(=O)C=%10.C=%10C6=O.CN5C.C79=O.N78
|
CCN(C(=O)C=Cc1nccs1)[C@H]1CCN(C(=O)C2CC(=O)CC(=O)C2)C1
|
CCNC=O)C=Ccnccs5))))))))[C@H]CCNC=O)CCC=O)CC=O)C6)))))))C5
|
[C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=N][C][=C][S][Ring1][Branch1][C@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][C][=Branch1][C][=O][C][Ring1][Branch2][C][Ring1][#C]
|
C17CC(=O)CC(=O)C1.C=8c1nccs1.[C@H]16CCN4C1.C3(=O)C=8.N356.C47=O.CC5
|
CCOC(=O)[C@H](CC)C(=O)N1C[C@@H](NC(=O)c2ccc3c(c2)CCC3)CC1(C)C
|
CCOC=O)[C@H]CC))C=O)NC[C@@H]NC=O)cccccc6)CCC5))))))))))CC5C)C
|
[C][C][O][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][C][C][Ring1][P][Branch1][C][C][C]
|
c19ccc2c(c1)CCC2.C4(=O)[C@H](CC)C5=O.N15C[C@@H]8CC1(C)C.C69=O.CC7.O47.N68
|
Cn1ccnc1SCCC(=O)N[C@@H]1C[C@@H]1CNC(=O)c1cc(F)cc(Cl)c1
|
Cnccnc5SCCC=O)N[C@@H]C[C@@H]3CNC=O)cccF)ccCl)c6
|
[C][N][C][=C][N][=C][Ring1][Branch1][S][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][Cl][=C][Ring1][Branch2]
|
c17cc(F)cc(Cl)c1.Cn1ccnc19.C5CC2=O.[C@@H]16C[C@@H]18.C37=O.S59.N26.C48.N34
|
C[C@@H](CNC(=O)c1cc2cc(Cl)c(Cl)cc2[nH]1)CN(C)C(=O)[C@H](O)c1cnc[nH]1
|
C[C@@H]CNC=O)cccccCl)cCl)cc6[nH]9))))))))))))CNC)C=O)[C@H]O)ccnc[nH]5
|
[C][C@@H1][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][NH1][Ring1][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][N][=C][NH1][Ring1][Branch1]
|
c17cc2cc(Cl)c(Cl)cc2[nH]1.C[C@@H](C5)C6.C4(=O)[C@@H]8O.c18cnc[nH]1.C37=O.N46C.N35
|
CN(CCCCNC(=O)Cc1c(F)cccc1F)C(=O)[C@@H]1CC[C@@H]1F
|
CNCCCCNC=O)CccF)cccc6F))))))))))))))C=O)[C@@H]CC[C@@H]4F
|
[C][N][Branch2][Ring1][#Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Ring1][Ring2][F]
|
c17c(F)cccc1F.C4CCC5.[C@@H]16CC[C@@H]1F.C2(=O)C7.CN34.C36=O.N25
|
CCCCOCC(=O)N1C2CCC1(CNC(=O)[C@H]1CC(CC)=NO1)CC2
|
CCCCOCC=O)NCCCC5CNC=O)[C@H]CCCC))=NO5))))))))CC6
|
[C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][Branch1][Ring1][C][C][=N][O][Ring1][#Branch1][C][C][Ring1][P]
|
N13C2CCC19CC2.[C@H]18CC(CC)=NO1.CCCC5.C6C3=O.C48=O.O56.C79.N47
|
CCOc1ccc(S(=O)(=O)NC[C@@](C)(F)C(C)C)cc1Cl
|
CCOccccS=O)=O)NC[C@@]C)F)CC)C))))))cc6Cl
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][C][F][C][Branch1][C][C][C][C][=C][Ring1][P][Cl]
|
c13ccc(S5(=O)=O)cc1Cl.C4[C@@](C)(F)C(C)C.CC2.O23.N45
|
O=C(NCCc1sccc1Cl)[C@@H](CC=CCl)c1ccccc1
|
O=CNCCcsccc5Cl)))))))))[C@@H]CC=CCl))))cccccc6
|
[O][=C][Branch1][N][N][C][C][C][S][C][=C][C][=Ring1][Branch1][Cl][C@@H1][Branch1][Branch1][C][C][=C][Cl][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
O=C2[C@H]5CC=CCl.c14sccc1Cl.c15ccccc1.C3C4.N23
|
CC=C(F)C(=O)NCCC1=CCN(C(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)CC1
|
CC=CF)C=O)NCCC=CCNC=O)ccccSN)=O)=O))cCl)c6)))))))CC6
|
[C][C][=C][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C][=C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][Branch1][C][Cl][=C][Ring1][O][C][C][Ring2][Ring1][Ring1]
|
c16ccc(S(N)(=O)=O)c(Cl)c1.C5CC1=CCN4CC1.C=7(F)C3=O.C46=O.CC=7.N35
|
CN(C)S(=O)(=O)CC(=O)N1CC(O)([C@H]2CCCN2C(=O)c2cn[nH]c2)C1
|
CNC)S=O)=O)CC=O)NCCO)[C@H]CCCN5C=O)ccn[nH]c5)))))))))))C4
|
[C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch2][Ring1][Ring1][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring1][P]
|
S5(=O)(=O)CC3=O.N13CC7(O)C1.[C@H]17CCCN14.c16cn[nH]c1.CN5C.C46=O
|
CC[C@H](C)CC(=O)N1CCO[C@@H]([C@@H](C)NC(=O)CCC(=O)NC)C1
|
CC[C@H]C)CC=O)NCCO[C@@H][C@@H]C)NC=O)CCC=O)NC))))))))C6
|
[C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][Ring1][P]
|
CC[C@H](C)CC2=O.N12CCO[C@@H]6C1.C3(=O)CCC4=O.[C@H]56C.N35.N4C
|
CCNC(=O)C(=O)N[C@H]1CCO[C@H]1C(=O)N[C@H](CC)[C@@H](C)O
|
CCNC=O)C=O)N[C@H]CCO[C@H]5C=O)N[C@H]CC))[C@@H]C)O
|
[C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][C][C][O][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C@@H1][Branch1][C][C][O]
|
[C@H]17CCO[C@H]18.[C@@H]6(CC)[C@@H](C)O.C2(=O)C3=O.C48=O.CC5.N25.N37.N46
|
C=C1C[C@@H]1C(=O)N[C@@H]1C=CCN(C(=O)[C@]2(NC(=O)OC(C)(C)C)C[C@@H](OC)C2)C1
|
C=CC[C@@H]3C=O)N[C@@H]C=CCNC=O)[C@]NC=O)OCC)C)C)))))C[C@@H]OC))C4)))))C6
|
[C][=C][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][C][=C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C@][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C@@H1][Branch1][Ring1][O][C][C][Ring1][=C][C][Ring2][Ring1][=Branch1]
|
[C@@H]1%11C=CCN6C1.[C@]1%104C[C@@H]9C1.C=C1C[C@@H]1%12.C8(C)(C)C.C5%12=O.C64=O.C37=O.N5%11.N7%10.O38.O9C
|
CC[C@H](CNC(=O)C[C@H]1C=C[C@@H](NC(=O)COCCF)C1)n1cccn1
|
CC[C@H]CNC=O)C[C@H]C=C[C@@H]NC=O)COCCF)))))))C5)))))))))ncccn5
|
[C][C][C@H1][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][C][C@H1][C][=C][C@@H1][Branch1][O][N][C][=Branch1][C][=O][C][O][C][C][F][C][Ring1][=N][N][C][=C][C][=N][Ring1][Branch1]
|
[C@H]19C=C[C@@H]7C1.CC[C@@H]8C6.n18cccn1.C2(=O)C9.C3(=O)C4.C5CF.N26.N37.O45
|
COc1ccc(Br)c(CC(=O)N(CCNC(=O)[C@H](C)NC(C)=O)C(C)C)c1
|
COccccBr)cCC=O)NCCNC=O)[C@H]C)NCC)=O))))))))CC)C)))))c6
|
[C][O][C][=C][C][=C][Branch1][C][Br][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][Branch1][C][C][=O][C][Branch1][C][C][C][=C][Ring2][Ring1][=Branch2]
|
c15ccc(Br)c%10c1.C3(=O)[C@@H]8C.C%10C2=O.N269.C6C7.C4(C)=O.C9(C)C.CO5.N37.N48
|
CCCC(=O)N(C)[C@H](CC(F)F)C(=O)N1CC2(CCCO2)C1
|
CCCC=O)NC)[C@H]CCF)F)))C=O)NCCCCCO5))))C4
|
[C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C][Branch1][#Branch1][C][C][C][O][Ring1][Branch1][C][Ring1][Branch2]
|
[C@@H]5(CC(F)F)C4=O.N14CC2(CCCO2)C1.CCCC3=O.N35C
|
COc1cnc(Cl)cc1C(=O)N1CC[C@@H](NC(=O)c2ccon2)[C@@H](O)C1
|
COccncCl)cc6C=O)NCC[C@@H]NC=O)cccon5)))))))[C@@H]O)C6
|
[C][O][C][=C][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][C][=C][O][N][=Ring1][Branch1][C@@H1][Branch1][C][O][C][Ring1][#C]
|
c15cnc(Cl)cc18.N13CC[C@@H]6[C@@H](O)C1.c17ccon1.C38=O.C47=O.CO5.N46
|
CC[S@@+]([O-])CCN=c1[nH]c(N2CCC([C@@H](C)OC)CC2)nc2c1CCCCC2
|
CC[S@@+][O-])CCN=c[nH]cNCCC[C@@H]C)OC)))CC6))))))ncc6CCCCC7
|
[C][C][S@@+1][Branch1][C][O-1][C][C][N][=C][NH1][C][Branch1][P][N][C][C][C][Branch1][#Branch1][C@@H1][Branch1][C][C][O][C][C][C][Ring1][#Branch2][=N][C][=C][Ring1][S][C][C][C][C][C][Ring1][#Branch1]
|
CC[S@@+]([O-])CCN=c1[nH]c4nc2c1CCCCC2.N14CCC5CC1.[C@H]35C.O3C
|
CC=C(C)C(=O)NC[C@]1(F)C[C@@H](NC(=O)[C@H](C2CC2)[C@H]2CCCO2)C1
|
CC=CC)C=O)NC[C@]F)C[C@@H]NC=O)[C@H]CCC3)))[C@H]CCCO5))))))))C4
|
[C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@H1][C][C][C][O][Ring1][Branch1][C][Ring1][P]
|
[C@]19(F)C[C@H]6C1.C=7(C)C3=O.C4(=O)[C@@H]8%10.[C@H]18CCCO1.C1%10CC1.CC=7.N35.C59.N46
|
CNS(=O)(=O)CCC(=O)NC[C@H](C)N(C)C(=O)c1cc(Cl)c(Cl)cc1O
|
CNS=O)=O)CCC=O)NC[C@H]C)NC)C=O)cccCl)cCl)cc6O
|
[C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][O]
|
c17cc(Cl)c(Cl)cc1O.S6(=O)(=O)CCC2=O.C4[C@@H]5C.N35C.C37=O.CN6.N24
|
Cc1cnoc1C1(C(=O)N2CC[C@@H](C)N(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CC1
|
Cccnoc5CC=O)NCC[C@@H]C)NC=O)cccc[N+]=O)[O-]))s5))))))CC7))))))))CC3
|
[C][C][C][=N][O][C][=Ring1][Branch1][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][S][Ring1][Branch2][C][C][Ring2][Ring1][C][C][C][Ring2][Ring1][#Branch1]
|
N14CC[C@@H](C)N5CC1.c16ccc([N+](=O)[O-])s1.Cc1cnoc18.C178CC1.C47=O.C56=O
|
CCOc1ccc(NC(C)=O)cc1S(=O)(=O)N[C@@H](C#N)CC
|
CCOccccNCC)=O)))cc6S=O)=O)N[C@@H]C#N))CC
|
[C][C][O][C][=C][C][=C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][Ring1][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][#N][C][C]
|
c14ccc7cc1S6(=O)=O.[C@H]5(C#N)CC.C2(C)=O.CC3.O34.N27.N56
|
Cc1nc2cc(C(=O)N(C)C[C@H]3CN(C(=O)[C@@H]4CNC(=O)N4C)CCO3)[nH]c2s1
|
CcncccC=O)NC)C[C@H]CNC=O)[C@@H]CNC=O)N5C)))))))CCO6)))))))))[nH]c5s8
|
[C][C][=N][C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][N][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][C][O][Ring1][#C][NH1][C][=Ring2][Ring1][=Branch2][S][Ring2][Ring1][N]
|
Cc1nc2cc9[nH]c2s1.[C@H]1%10CN6CCO1.[C@@H]18CNC(=O)N1C.C59=O.N57C.C68=O.C7%10
|
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