SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
CCC[C@@H](OCC)C(=O)NCc1cnn2c1CN(Cc1nnsc1Cl)CC2
|
CCC[C@@H]OCC)))C=O)NCccnnc5CNCcnnsc5Cl)))))))CC6
|
[C][C][C][C@@H1][Branch1][Ring2][O][C][C][C][=Branch1][C][=O][N][C][C][C][=N][N][C][=Ring1][Branch1][C][N][Branch1][#Branch2][C][C][N][=N][S][C][=Ring1][Branch1][Cl][C][C][Ring1][=N]
|
c19cnn2c1CN7CC2.CCC[C@@H]4C3=O.c18nnsc1Cl.O45.C5C.N36.C69.C78
|
C=C=CCCC(=O)N(C)CC1(NC(=O)Cc2csc(-n3c(C)ccc3C)n2)CC1
|
C=C=CCCC=O)NC)CCNC=O)Cccsc-ncC)ccc5C))))))n5))))))))CC3
|
[C][=C][=C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][N][N][C][Branch1][C][C][=C][C][=C][Ring1][=Branch1][C][=N][Ring1][N][C][C][Ring2][Ring1][Ring1]
|
C=C=CCCC4=O.n1%10c(C)ccc1C.c18csc%10n1.C179CC1.C5(=O)C8.N46C.C69.N57
|
C=C[C@@H]1COC[C@H]1NC(=O)C#CCNC(=O)C1=C(C#N)CCC1
|
C=C[C@@H]COC[C@H]5NC=O)C#CCNC=O)C=CC#N))CCC5
|
[C][=C][C@@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][#C][C][N][C][=Branch1][C][=O][C][=C][Branch1][Ring1][C][#N][C][C][C][Ring1][#Branch1]
|
C3(=O)C1=C(C#N)CCC1.C=C[C@@H]1COC[C@H]15.C2(=O)C#CC4.N25.N34
|
C[C@@H](c1ccncc1)N1CC[C@](C(=O)O)(c2cccc(Br)c2)C1
|
C[C@@H]cccncc6))))))NCC[C@]C=O)O))cccccBr)c6))))))C5
|
[C][C@@H1][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][C][C@][Branch1][=Branch1][C][=Branch1][C][=O][O][Branch1][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][Ring1][#C]
|
N13CC[C@]46C1.c16cccc(Br)c1.c15ccncc1.C[C@H]35.C4(=O)O
|
COCC[C@@H]1CN(C(=O)COC(C)(C)C)CCN1C(=O)CSC(C)(C)C
|
COCC[C@@H]CNC=O)COCC)C)C)))))CCN6C=O)CSCC)C)C
|
[C][O][C][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][Branch1][C][C][Branch1][C][C][C][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][S][C][Branch1][C][C][Branch1][C][C][C]
|
[C@@H]19CN2CCN13.C2(=O)C5.C6(C)(C)C.C3(=O)C7.C8(C)(C)C.C4C9.CO4.O56.S78
|
C[C@@H]1CN(C(=O)c2ccc(Br)c3cn[nH]c23)[C@@H](C)CN1S(C)(=O)=O
|
C[C@@H]CNC=O)ccccBr)ccn[nH]c95))))))))))[C@@H]C)CN6SC)=O)=O
|
[C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][C][=N][NH1][C][Ring1][#Branch2][=Ring1][Branch1][C@@H1][Branch1][C][C][C][N][Ring2][Ring1][Ring1][S][Branch1][C][C][=Branch1][C][=O][=O]
|
c16ccc(Br)c2cn[nH]c12.C[C@@H]1CN4[C@@H](C)CN15.S5(C)(=O)=O.C46=O
|
CCO[C@H](C(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(=NC)o2)C[C@H]1O)C(C)C
|
CCO[C@H]C=O)N[C@@H]CCNC=O)cc[nH]c=NC))o5))))))C[C@H]6O)))))))))CC)C
|
[C][C][O][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][Ring1][=N][C][O][Ring1][#Branch1][C][C@H1][Ring1][#C][O][C][Branch1][C][C][C]
|
[C@@H]17CCN4C[C@H]1O.[C@@H]6(C3=O)C(C)C.c18c[nH]c(=NC)o1.C48=O.CC5.O56.N37
|
O=C(C#C[C@@H]1CCCO1)NCC[C@@H]1CCN(C(=O)C2(O)CCOCC2)C1
|
O=CC#C[C@@H]CCCO5)))))))NCC[C@@H]CCNC=O)CO)CCOCC6)))))))C5
|
[O][=C][Branch1][#Branch2][C][#C][C@@H1][C][C][C][O][Ring1][Branch1][N][C][C][C@@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][O][C][C][O][C][C][Ring1][#Branch1][C][Ring1][=C]
|
O=C3C#C[C@@H]1CCCO1.C16(O)CCOCC1.[C@@H]17CCN4C1.C5C7.C46=O.N35
|
CCC1(Cn2nnnc2N2CCC[C@]3(CC(=O)N(C)C3)C2)CCOCC1
|
CCCCnnnnc5NCCC[C@]CC=O)NC)C5))))C6))))))))))))CCOCC6
|
[C][C][C][Branch2][Ring1][#C][C][N][N][=N][N][=C][Ring1][Branch1][N][C][C][C][C@][Branch1][=N][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][#Branch1][C][Ring1][N][C][C][O][C][C][Ring2][Ring1][Branch2]
|
N14CCC[C@]2(CC(=O)N(C)C2)C1.C167CCOCC1.n15nnnc14.CC6.C57
|
CC(C)[C@H](O)C(C)(C)C(=O)NC[C@]1(F)CCCN(C(=O)CC2(C(F)(F)F)CC2)C1
|
CCC)[C@H]O)CC)C)C=O)NC[C@]F)CCCNC=O)CCCF)F)F))CC3)))))C6
|
[C][C][Branch1][C][C][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1][C][Ring1][P]
|
CC(C)[C@H](O)C(C)(C)C3=O.[C@@]16(F)CCCN4C1.C4(=O)C7.C178CC1.C8(F)(F)F.N35.C56
|
CC[C@H](C(=O)NC[C@H]1CCCC2(CN(C(=O)c3cnc(C4CC4)o3)C2)O1)[C@H](C)O
|
CC[C@H]C=O)NC[C@H]CCCCCNC=O)ccncCCC3)))o5))))))C4)))O6)))))))))[C@H]C)O
|
[C][C][C@H1][Branch2][Ring2][=N][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][Branch2][Ring1][O][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2][C][Ring1][=C][O][Ring2][Ring1][Ring1][C@H1][Branch1][C][C][O]
|
[C@H]19CCCC2(CN6C2)O1.CC[C@H](C5=O)[C@H](C)O.c18cnc%10o1.C68=O.C1%10CC1.N57.C79
|
CC1(C)OC[C@H](CCC(=O)N[C@@H]2C=C[C@H](CNC(=O)C3(C4CC4)CC3)C2)O1
|
CCC)OC[C@H]CCC=O)N[C@@H]C=C[C@H]CNC=O)CCCC3)))CC3))))))C5)))))))))O5
|
[C][C][Branch1][C][C][O][C][C@H1][Branch2][Ring2][Ring2][C][C][C][=Branch1][C][=O][N][C@@H1][C][=C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][Ring1][=Branch1][C][Ring1][#C][O][Ring2][Ring1][#Branch2]
|
CC1(C)OC[C@H]%10O1.[C@@H]18C=C[C@H]%11C1.C19(C2CC2)CC1.C%10CC5=O.C69=O.N58.C7%11.N67
|
CCOCCCCC(=O)N1CCC(/C=C/C(=O)N(C)[C@@H]2CC[C@H]2C)CC1
|
CCOCCCCC=O)NCCC/C=C/C=O)NC)[C@@H]CC[C@H]4C)))))))))CC6
|
[C][C][O][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][C][/C][=C][/C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C@H1][Ring1][Ring2][C][C][C][Ring1][P]
|
N13CCC(C=8)CC1.C6CCCC3=O.[C@@H]17CC[C@H]1C.C=8C4=O.N47C.CC5.O56
|
CN(Cc1cccc(O)c1)C(=O)NCCN1CCCC1(C)C
|
CNCcccccO)c6)))))))C=O)NCCNCCCC5C)C
|
[C][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][N][C][C][C][C][Ring1][Branch1][Branch1][C][C][C]
|
c17cccc(O)c1.N16CCCC1(C)C.CN24.C23=O.C5C6.C47.N35
|
CCOc1cc(/C=C/C(=O)N2CCC[C@@H](NC(=O)C(C)(F)F)C2)cc(Cl)c1OC
|
CCOccc/C=C/C=O)NCCC[C@@H]NC=O)CC)F)F))))C6)))))))))ccCl)c6OC
|
[C][C][O][C][=C][C][Branch2][Ring1][=C][/C][=C][/C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][F][F][C][Ring1][=N][=C][C][Branch1][C][Cl][=C][Ring2][Ring1][Branch2][O][C]
|
c16cc(C=9)cc(Cl)c17.N13CCC[C@@H]8C1.C4(=O)C(C)(F)F.C=9C3=O.CC5.O56.N48.O7C
|
CCN1CCN(C(=O)[C@@H](NC(=O)c2cccc(C)c2C)c2cn(C)nn2)CC1=O
|
CCNCCNC=O)[C@@H]NC=O)cccccC)c6C)))))))))ccnC)nn5)))))))CC6=O
|
[C][C][N][C][C][N][Branch2][Ring2][Ring2][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1][C][C][Ring2][Ring1][#Branch2][=O]
|
N17CCN3CC1=O.c16cccc(C)c1C.c18cn(C)nn1.C3(=O)[C@@H]58.C46=O.CC7.N45
|
C=C1CC[C@@H]1C(=O)N[C@]1(C)CCN(c2cc(Cl)nc(COC)n2)C1
|
C=CCC[C@@H]4C=O)N[C@]C)CCNcccCl)ncCOC)))n6))))))C5
|
[C][=C][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C][N][Branch1][P][C][=C][C][Branch1][C][Cl][=N][C][Branch1][Ring2][C][O][C][=N][Ring1][#Branch2][C][Ring1][S]
|
c16cc(Cl)nc8n1.[C@@]15(C)CCN6C1.C=C1CC[C@@H]17.C37=O.N35.C48.O4C
|
Cn1cccc1CCC(=O)N1CC[C@@H](NC(=O)c2n[nH]c3c2CCOC3)[C@@H](F)C1
|
Cncccc5CCC=O)NCC[C@@H]NC=O)cn[nH]cc5CCOC6)))))))))))[C@@H]F)C6
|
[C][N][C][=C][C][=C][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][C][O][C][Ring1][=Branch1][C@@H1][Branch1][C][F][C][Ring2][Ring1][Ring1]
|
c17n[nH]c2c1CCOC2.N14CC[C@@H]6[C@@H](F)C1.Cn1cccc18.C8CC4=O.C57=O.N56
|
CCOCC(=O)NCCNC(=O)[C@H]1CCCN(C(=O)c2ccccc2CC)C1
|
CCOCC=O)NCCNC=O)[C@H]CCCNC=O)cccccc6CC)))))))))C6
|
[C][C][O][C][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][S]
|
[C@H]1%11CCCN6C1.c1%12ccccc14.C8C3=O.C9C%10.C5%11=O.C6%12=O.CC7.O78.N39.N5%10.C4C
|
C=C1CC(C)(C(=O)N2CCn3nc(CNC(=O)C[C@H](C)[C@@H]4CCCO4)cc3C2)C1
|
C=CCCC)C=O)NCCnncCNC=O)C[C@H]C)[C@@H]CCCO5))))))))))cc5C9))))))))))C4
|
[C][=C][C][C][Branch1][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][N][N][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C@@H1][C][C][C][O][Ring1][Branch1][C][=C][Ring1][P][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][N]
|
N15CCn2nc%10cc2C1.C=C1CC8(C)C1.C6(=O)C[C@@H]9C.[C@@H]19CCCO1.C58=O.C7%10.N67
|
Cc1nn(C)cc1C(=O)N1[C@@H]2CCC[C@@H]2[C@@H]1CC(=O)N1CC(c2cccnc2)C1
|
CcnnC)cc5C=O)N[C@@H]CCC[C@@H]5[C@@H]7CC=O)NCCccccnc6))))))C4
|
[C][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C@@H1][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][#Branch2]
|
N13[C@@H]2CCC[C@@H]2[C@@H]16.Cc1nn(C)cc15.c17cccnc1.N14CC7C1.C6C4=O.C35=O
|
COC(=O)c1sc2c(c1NC(=O)C1CC3(C1)CC1(CC1)C3)CC[C@H](C(C)(C)C)C2
|
COC=O)csccc5NC=O)CCCC4)CCCC3))C4)))))))))CC[C@H]CC)C)C))C6
|
[C][O][C][=Branch1][C][=O][C][S][C][=C][Branch2][Ring1][N][C][=Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][#Branch1][C][C][C@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch1]
|
c17sc2c(c16)CC[C@H]9C2.C18CC2(C1)CC1(CC1)C2.C9(C)(C)C.C47=O.C58=O.CO4.N56
|
Cc1n[nH]cc1CC(=O)N[C@@H](C)C1(C(=O)N[C@H](CO)CN2CCCC2)CC1
|
Ccn[nH]cc5CC=O)N[C@@H]C)CC=O)N[C@H]CO))CNCCCC5)))))))))CC3
|
[C][C][=N][NH1][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][N][C][C][C][C][Ring1][Branch1][C][C][Ring1][#C]
|
Cc1n[nH]cc1%10.[C@H]6(C7)CO.N17CCCC1.C%10C3=O.C189CC1.[C@@H]59C.C48=O.N35.N46
|
CC(=O)c1cnn(C)c1C(=O)N1CC(c2cn(Cc3cnoc3)nn2)C1
|
CC=O)ccnnC)c5C=O)NCCccnCccnoc5))))))nn5)))))C4
|
[C][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][C][=C][N][Branch1][=Branch2][C][C][C][=N][O][C][=Ring1][Branch1][N][=N][Ring1][O][C][Ring1][#C]
|
c16cnn(C)c15.c19cn7nn1.N14CC9C1.c18cnoc1.CC6=O.C45=O.C78
|
CC(=Cc1cn[nH]c1)C(=O)NC1CCC(C(=O)NC[C@@H]2COCCO2)CC1
|
CC=Cccn[nH]c5))))))C=O)NCCCCC=O)NC[C@@H]COCCO6)))))))))CC6
|
[C][C][=Branch1][=Branch2][=C][C][C][=N][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][#C][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C][O][Ring1][=Branch1][C][C][Ring1][S]
|
C16CCC7CC1.C=8c1cn[nH]c1.[C@@H]19COCCO1.CC=8C3=O.C47=O.N36.N45.C59
|
CCn1nccc1C=CC(=O)N1CC[C@@](CF)(NC(=O)[C@@H]2CN(C)CCO2)C1
|
CCnnccc5C=CC=O)NCC[C@@]CF))NC=O)[C@@H]CNC)CCO6))))))))C5
|
[C][C][N][N][=C][C][=C][Ring1][Branch1][C][=C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][Ring1][C][F][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][N][Branch1][C][C][C][C][O][Ring1][#Branch1][C][Ring1][P]
|
n18nccc1C=7.N13CC[C@]59C1.[C@@H]16CN(C)CCO1.C=7C3=O.C46=O.CC8.C9F.N45
|
CCc1cc(OC)ccc1C(=O)N[C@@H]1CCOC1
|
CCcccOC))ccc6C=O)N[C@@H]CCOC5
|
[C][C][C][=C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C@@H1][C][C][O][C][Ring1][Branch1]
|
c16cc3ccc15.[C@@H]14CCOC1.C25=O.CC6.O3C.N24
|
CCCCCCCCCC(=O)NC1CCC(N(C)C(=O)C(CC)(CC)CO)CC1
|
CCCCCCCCCC=O)NCCCCNC)C=O)CCC))CC))CO)))))CC6
|
[C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Ring2][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][O][C][C][Ring1][P]
|
CCCCCCCCCC2=O.C3(=O)C(CC)(CC)CO.C14CCC5CC1.N35C.N24
|
CN(C[C@H]1CCCN(C(=O)c2cc(O)nc(O)n2)C1)C(=O)c1c(O)cccc1F
|
CNC[C@H]CCCNC=O)cccO)ncO)n6)))))))C6)))))))C=O)ccO)cccc6F
|
[C][N][Branch2][Ring1][#C][C][C@H1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][C][O][=N][Ring1][Branch2][C][Ring1][S][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][F]
|
c16cc(O)nc(O)n1.c17c(O)cccc1F.[C@H]18CCCN3C1.CN45.C36=O.C47=O.C58
|
CC[C@H](C)[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CCCC(C)C)CC1(F)F
|
CC[C@H]C)[C@H]O)C=O)NC[C@H]CCNC=O)CCCCC)C))))))CC6F)F
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][C][C][C][Ring1][=C][Branch1][C][F][F]
|
[C@H]15CCN3CC1(F)F.CC[C@H](C)[C@H](O)C2=O.C3(=O)CCCC(C)C.N24.C45
|
CCCCCCC[C@@H]1CCCN1C(=O)Nc1cc(Br)c(I)c(Br)c1
|
CCCCCCC[C@@H]CCCN5C=O)NcccBr)cI)cBr)c6
|
[C][C][C][C][C][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Br][=C][Branch1][C][I][C][Branch1][C][Br][=C][Ring1][=Branch2]
|
c14cc(Br)c(I)c(Br)c1.CCCCCCC5.[C@@H]15CCCN12.C23=O.N34
|
CCn1cc(C(=O)N[C@H]2CC(=O)N(C3CN(C(=O)C4=NO[C@H](C)C4)C3)C2)cn1
|
CCnccC=O)N[C@H]CC=O)NCCNC=O)C=NO[C@H]C)C5))))))C4))))C5)))))))cn5
|
[C][C][N][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@H1][C][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=N][O][C@H1][Branch1][C][C][C][Ring1][=Branch1][C][Ring1][N][C][Ring2][Ring1][C][C][=N][Ring2][Ring1][#Branch2]
|
C6(=O)C1=NO[C@H](C)C1.[C@H]17CC(=O)N%10C1.n19cc8cn1.C1%10CN6C1.C58=O.CC9.N57
|
COC(=O)C1CC(n2nnnc2[C@@](CCC(C)C)(NC(C)(C)CCF)C2CC2)C1
|
COC=O)CCCnnnnc5[C@@]CCCC)C))))NCC)C)CCF)))))CCC3)))))))))C4
|
[C][O][C][=Branch1][C][=O][C][C][C][Branch2][Ring2][Ring2][N][N][=N][N][=C][Ring1][Branch1][C@@][Branch1][Branch2][C][C][C][Branch1][C][C][C][Branch1][N][N][C][Branch1][C][C][Branch1][C][C][C][C][F][C][C][C][Ring1][Ring1][C][Ring2][Ring1][=Branch2]
|
[C@]478CCC(C)C.n19nnnc17.C5(C)(C)CCF.C16CC9C1.C36=O.C18CC1.CO3.N45
|
CC[C@H](C(=O)N1CC(OC2CCN(C(=O)C3C[C@H]4C[C@@H]4C3)CC2)C1)N(CC)CC
|
CC[C@H]C=O)NCCOCCCNC=O)CC[C@H]C[C@@H]3C6)))))))CC6)))))))C4)))))NCC))CC
|
[C][C][C@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch2][O][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][C][Ring1][=C][C][Ring2][Ring1][Ring1][N][Branch1][Ring1][C][C][C][C]
|
C18CCN6CC1.CC[C@@H]9C5=O.C1%12C[C@H]2C[C@@H]2C1.N15CC7C1.C6%12=O.N9%10%11.O78.C%10C.C%11C
|
O=C(NCC1(O)CN(C(=O)C2CCC3(CC2)CC3)C1)c1cnc2sccn2c1=O
|
O=CNCCO)CNC=O)CCCCCC6))CC3)))))))C4))))))ccncsccn5c9=O
|
[O][=C][Branch2][Ring1][P][N][C][C][Branch1][C][O][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch1][C][Ring1][#C][C][=C][N][=C][S][C][=C][N][Ring1][Branch1][C][Ring1][=Branch2][=O]
|
c18cnc2sccn2c1=O.C17CCC2(CC1)CC2.C19(O)CN5C1.O=C48.C57=O.N46.C69
|
O=C(NC1(CNC(=O)C2(n3ccnn3)CC2)CC1)[C@H]1CC(=O)N(c2cn[nH]c2)C1
|
O=CNCCNC=O)Cnccnn5)))))CC3))))))CC3))))[C@H]CC=O)Nccn[nH]c5)))))C5
|
[O][=C][Branch2][Ring1][=C][N][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][C][Ring1][Branch2][C][C][Ring1][#C][C@H1][C][C][=Branch1][C][=O][N][Branch1][Branch2][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring1][O]
|
[C@H]18CC(=O)N%12C1.n1%11ccnn1.c1%12cn[nH]c1.C16%10CC1.C19%11CC1.O=C48.C59=O.N46.C7%10.N57
|
CC=C(CC)C(=O)N1CCC([C@@H]2N(C(=O)/C(Cl)=C/Cl)CC2(C)C)CC1
|
CC=CCC))C=O)NCCC[C@@H]NC=O)/CCl)=C/Cl))))CC4C)C)))))CC6
|
[C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C@@H1][N][Branch1][O][C][=Branch1][C][=O][/C][Branch1][C][Cl][=C][/Cl][C][C][Ring1][#Branch2][Branch1][C][C][C][C][C][Ring2][Ring1][C]
|
N13CCC6CC1.[C@@H]16N4CC1(C)C.C=5(CC)C3=O.C4(=O)/C(Cl)=C/Cl.CC=5
|
Cc1ncsc1C(=O)N1CCC[C@@H](c2n[nH]c(CNC(=O)C3CSC3)n2)C1
|
Ccncsc5C=O)NCCC[C@@H]cn[nH]cCNC=O)CCSC4)))))))n5)))))C6
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][=Branch1][C][=N][NH1][C][Branch1][=N][C][N][C][=Branch1][C][=O][C][C][S][C][Ring1][Ring2][=N][Ring1][=N][C][Ring2][Ring1][Ring1]
|
N14CCC[C@@H]%10C1.Cc1ncsc17.c1%10n[nH]c9n1.C18CSC1.C47=O.C58=O.C69.N56
|
C[C@@H](NC(=O)C1(NC(=O)C[C@@H]2CC(=O)NC2=O)CC(F)C1)C1CCC1
|
C[C@@H]NC=O)CNC=O)C[C@@H]CC=O)NC5=O)))))))))CCF)C4))))))CCCC4
|
[C][C@@H1][Branch2][Ring2][Ring1][N][C][=Branch1][C][=O][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][C][Branch1][C][F][C][Ring1][S][C][C][C][C][Ring1][Ring2]
|
[C@@H]19CC(=O)NC1=O.C167CC(F)C1.C4(=O)C9.C18CCC1.C[C@@H]58.C37=O.N35.N46
|
COc1ncc(C(=O)NC[C@@H]2CCCN(C(=O)c3cc(F)cc(Br)c3C)C2)cn1
|
COcnccC=O)NC[C@@H]CCCNC=O)cccF)ccBr)c6C))))))))C6)))))))))cn6
|
[C][O][C][=N][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][Br][=C][Ring1][Branch2][C][C][Ring1][P][C][=N][Ring2][Ring1][O]
|
c19cc(F)cc(Br)c1C.c16ncc8cn1.[C@@H]1%10CCCN5C1.C48=O.C59=O.CO6.N47.C7%10
|
CCOCCC(=O)N1C[C@@H]2CC[C@@H](N=c3nc(C(F)(F)F)[nH]s3)[C@@H]2C1
|
CCOCCC=O)NC[C@@H]CC[C@@H]N=cncCF)F)F))[nH]s5))))))[C@@H]5C8
|
[C][C][O][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@H1][Branch2][Ring1][Ring1][N][=C][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][NH1][S][Ring1][=Branch2][C@@H1][Ring1][#C][C][Ring2][Ring1][C]
|
N14C[C@@H]2CC[C@@H](N=c3nc7[nH]s3)[C@@H]2C1.C6CC4=O.C7(F)(F)F.CC5.O56
|
CCC(CC)CC(=O)NCc1ncccc1C(=O)N1CCc2ccc(C)cc21
|
CCCCC))CC=O)NCcncccc6C=O)NCCccccC)cc69
|
[C][C][C][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][=N][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][#Branch2]
|
N14CCc2ccc(C)cc21.CCC(CC)CC3=O.c17ncccc16.C46=O.N35.C57
|
COCC[C@@H](CNC(=O)c1cnn2c(=O)cc[nH]c12)NC(=O)[C@@H]1CCCS1(=O)=O
|
COCC[C@@H]CNC=O)ccnnc=O)cc[nH]c96))))))))))))NC=O)[C@@H]CCCS5=O)=O
|
[C][O][C][C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][=N][N][C][=Branch1][C][=O][C][=C][NH1][C][=Ring1][#Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O]
|
c19cnn2c(=O)cc[nH]c12.[C@@H]18CCCS1(=O)=O.C5C[C@H]6C7.C39=O.C48=O.CO5.N37.N46
|
CCc1ncccc1NC(=O)[C@@H](C)CNC(=O)[C@H](O)c1cncn1C
|
CCcncccc6NC=O)[C@@H]C)CNC=O)[C@H]O)ccncn5C
|
[C][C][C][=N][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][N][=C][N][Ring1][Branch1][C]
|
c16ncccc15.C2(=O)[C@@H](C)C4.c17cncn1C.C3(=O)[C@@H]7O.CC6.N25.N34
|
CCSc1ccc(C(=O)N[C@@H](C)[C@H]2CCN(C(=O)c3cc4ccsc4s3)C2)cn1
|
CCSccccC=O)N[C@@H]C)[C@H]CCNC=O)cccccsc5s8)))))))))C5))))))))cn6
|
[C][C][S][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][C][=C][S][C][=Ring1][Branch1][S][Ring1][Branch2][C][Ring1][#C][C][=N][Ring2][Ring1][#Branch2]
|
c19cc2ccsc2s1.c1%12ccc%10cn1.[C@H]1%11CCN6C1.C5%10=O.[C@@H]7%11C.C69=O.CC8.S8%12.N57
|
COC(=O)[C@](C)(F)C(=O)N1CCC(n2cc([C@]3(OC)CCOC3)nn2)CC1
|
COC=O)[C@]C)F)C=O)NCCCncc[C@]OC))CCOC5)))))nn5)))))CC6
|
[C][O][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][N][C][=C][Branch1][N][C@][Branch1][Ring1][O][C][C][C][O][C][Ring1][#Branch1][N][=N][Ring1][N][C][C][Ring2][Ring1][C]
|
C4(=O)[C@](C)(F)C5=O.N15CCC7CC1.n17cc8nn1.[C@]168CCOC1.CO4.O6C
|
C[C@@H]1CC[C@H](CNC(=NCCF)NCc2ccc(S(C)(=O)=O)cc2)C1
|
C[C@@H]CC[C@H]CNC=NCCF))))NCccccSC)=O)=O))cc6)))))))))))C5
|
[C][C@@H1][C][C][C@H1][Branch2][Ring1][=C][C][N][C][=Branch1][Branch1][=N][C][C][F][N][C][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][C][Ring2][Ring1][Branch2]
|
c16ccc(S(C)(=O)=O)cc1.N3C(=NCCF)N4.C[C@@H]1CC[C@H]5C1.C35.C46
|
Cc1nn([C@@H]2CCOC2)cc1C(=O)N1C[C@H](O)[C@H](NC(=O)CC2(C)CC2)C1
|
Ccnn[C@@H]CCOC5)))))cc5C=O)NC[C@H]O)[C@H]NC=O)CCC)CC3))))))C5
|
[C][C][=N][N][Branch1][Branch2][C@@H1][C][C][O][C][Ring1][Branch1][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][=C]
|
Cc1nn8cc16.N13C[C@@H]5[C@@H](O)C1.[C@@H]18CCOC1.C4(=O)C7.C17(C)CC1.C36=O.N45
|
O=C(C#C[C@H]1CCCO1)N1CCCC[C@H]2[C@H]1CCCN2C(=O)C1=CCCCO1
|
O=CC#C[C@H]CCCO5)))))))NCCCC[C@H][C@H]7CCCN6C=O)C=CCCCO6
|
[O][=C][Branch1][#Branch2][C][#C][C@H1][C][C][C][O][Ring1][Branch1][N][C][C][C][C][C@H1][C@H1][Ring1][#Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][C][C][O][Ring1][=Branch1]
|
N13CCCC[C@H]2[C@H]1CCCN24.O=C3C#C[C@H]1CCCO1.C4(=O)C1=CCCCO1
|
CC[C@@H](CN(C)C(=O)c1ccc(F)cc1NS(C)(=O)=O)NC(=O)[C@H]1CC(C)(C)O1
|
CC[C@@H]CNC)C=O)ccccF)cc6NSC)=O)=O))))))))))))NC=O)[C@H]CCC)C)O4
|
[C][C][C@@H1][Branch2][Ring1][=C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][S][Branch1][C][C][=Branch1][C][=O][=O][N][C][=Branch1][C][=O][C@H1][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch1]
|
c19ccc(F)cc17.[C@H]18CC(C)(C)O1.CC[C@H]4C5.S6(C)(=O)=O.N25C.C29=O.C38=O.N67.N34
|
Cc1ncc(N[C@H](c2cn(C3CC3)nc2C)c2nnnn2C(C)(C)C)c(C)n1
|
CcnccN[C@H]ccnCCC3)))nc5C))))))cnnnn5CC)C)C)))))))))cC)n6
|
[C][C][=N][C][=C][Branch2][Ring2][Ring1][N][C@H1][Branch1][S][C][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][=C][Ring1][Branch2][C][C][=N][N][=N][N][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][=N][Ring2][Ring1][O]
|
Cc1ncc5c(C)n1.c18cn9nc1C.c17nnnn16.C6(C)(C)C.[C@H]478.C19CC1.N45
|
C[C@H](NC(=O)CCC#N)[C@H](C)NC(=O)c1ccnc(-c2cc[nH]n2)c1
|
C[C@H]NC=O)CCC#N))))))[C@H]C)NC=O)cccnc-ccc[nH]n5)))))c6
|
[C][C@H1][Branch1][#Branch2][N][C][=Branch1][C][=O][C][C][C][#N][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][=C][Ring1][O]
|
c17ccnc8c1.C3(=O)CCC#N.C[C@H]5[C@@H]6C.c18cc[nH]n1.C47=O.N35.N46
|
CN(C[C@@H]1CCC(=O)N1)C(=O)C(=O)NCCCCOC1CCCCCC1
|
CNC[C@@H]CCC=O)N5))))))C=O)C=O)NCCCCOCCCCCCC7
|
[C][N][Branch1][N][C][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][O][C][C][C][C][C][C][C][Ring1][#Branch1]
|
C15CCCCCC1.[C@@H]18CCC(=O)N1.C2(=O)C3=O.C7CCC4.CN26.C68.N37.O45
|
CC(C)CC1(CN(C)C(=O)COCCNC(=O)[C@@H]2CCC[C@@H](C)C2)CC1
|
CCC)CCCNC)C=O)COCCNC=O)[C@@H]CCC[C@@H]C)C6)))))))))))))))CC3
|
[C][C][Branch1][C][C][C][C][Branch2][Ring1][=C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch1][C][C][Ring2][Ring1][=Branch1]
|
[C@@H]19CCC[C@@H](C)C1.CC(C)C%10.C1%10%11CC1.C3(=O)C5.N37C.C6C8.C49=O.C7%11.O56.N48
|
Cc1ccn(CCC(=O)N(C)[C@H]2CN(C(=O)C3CN(C)C3)CC[C@H]2O)n1
|
CcccnCCC=O)NC)[C@H]CNC=O)CCNC)C4)))))CC[C@H]6O)))))))))))n5
|
[C][C][C][=C][N][Branch2][Ring2][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][Branch1][C][C][C][Ring1][Branch1][C][C][C@H1][Ring1][=N][O][N][=Ring2][Ring1][=Branch2]
|
[C@H]16CN5CC[C@H]1O.Cc1ccn8n1.C8CC4=O.C17CN(C)C1.N46C.C57=O
|
COCc1nc(C)c(C(=O)N2CC3(C2)SCC[C@@H]3NC(=O)[C@@H]2CCCC2(F)F)s1
|
COCcncC)cC=O)NCCC4)SCC[C@@H]5NC=O)[C@@H]CCCC5F)F))))))))))))))))s5
|
[C][O][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][S][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][Ring1][Branch1][Branch1][C][F][F][S][Ring2][Ring1][#Branch2]
|
N14CC2(C1)SCC[C@@H]27.c1%10nc(C)c8s1.[C@@H]19CCCC1(F)F.C48=O.C59=O.CO6.C6%10.N57
|
CC(=O)Nc1cccnc1C(=O)N[C@@H](C)CN(C)c1nn(C(C)C)cc1[N+](=O)[O-]
|
CC=O)Nccccnc6C=O)N[C@@H]C)CNC)cnnCC)C))cc5[N+]=O)[O-]
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][Branch2][N+1][=Branch1][C][=O][O-1]
|
c16nn9cc1[N+](=O)[O-].c17cccnc18.[C@H]4(C)C5.CC2=O.C38=O.N56C.C9(C)C.N27.N34
|
CCc1occ(C)c1C(=O)N[C@@H]1CCC[C@@H](CNC(=O)C(C)(C)N2CCCC2)C1
|
CCcoccC)c5C=O)N[C@@H]CCC[C@@H]CNC=O)CC)C)NCCCC5)))))))))C6
|
[C][C][C][O][C][=C][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][N][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][C]
|
c19occ(C)c18.[C@@H]17CCC[C@@H]%10C1.C4(=O)C6(C)C.N16CCCC1.C38=O.CC9.N37.C5%10.N45
|
Cc1ccc2cccnc2c1C(=O)NCCNC(=O)Cc1csc(C(C)(C)C)n1
|
Ccccccccnc6c%10C=O)NCCNC=O)CccscCC)C)C))n5
|
[C][C][=C][C][=C][C][=C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][Ring1][=Branch2]
|
Cc1ccc2cccnc2c17.c18csc9n1.C4(=O)C8.C9(C)(C)C.C37=O.C5C6.N35.N46
|
CC(C)(C(=O)N1[C@H]2CC[C@H]1CN(C(=O)CC[C@H]1CC1(Cl)Cl)C2)S(C)(=O)=O
|
CCC)C=O)N[C@H]CC[C@H]5CNC=O)CC[C@H]CC3Cl)Cl)))))))C7)))))))))SC)=O)=O
|
[C][C][Branch1][C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C@H1][C][C][Ring1][Ring1][Branch1][C][Cl][Cl][C][Ring1][S][S][Branch1][C][C][=Branch1][C][=O][=O]
|
CC(C)(C3=O)S(C)(=O)=O.N13[C@H]2CC[C@H]1CN4C2.C4(=O)CC5.[C@H]15CC1(Cl)Cl
|
CCCCO[C@@H](C)C(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@@H]1C(=O)OC
|
CCCCO[C@@H]C)C=O)NC[C@@H]O)C[C@H]5C=O)NCC[C@@H]4C=O)OC
|
[C][C][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][O][C]
|
N13C[C@@H](O)C[C@H]17.[C@H]6(C)C3=O.N14CC[C@@H]18.CCCC5.C47=O.C28=O.O56.O2C
|
COCC(=O)NCCC(=O)N1CC[C@](O)(CNC(=O)[C@@H](O)C(F)(F)F)C1
|
COCC=O)NCCC=O)NCC[C@]O)CNC=O)[C@@H]O)CF)F)F))))))C5
|
[C][O][C][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][O][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][S]
|
C4(=O)[C@@H](O)C(F)(F)F.N13CC[C@@]8(O)C1.C6CC3=O.C5C2=O.CO5.N26.C78.N47
|
C#Cc1ccc(CC(=O)N[C@@H]2CN(C(=O)[C@](C)(O)C(C)C)C[C@@H]2N=[N+]=[N-])cc1
|
C#CccccCC=O)N[C@@H]CNC=O)[C@]C)O)CC)C))))C[C@@H]5N=[N+]=[N-])))))))))))cc6
|
[C][#C][C][=C][C][=C][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][C][O][C][Branch1][C][C][C][C][C@@H1][Ring1][=N][N][=N+1][=N-1][C][=C][Ring2][Ring1][#Branch2]
|
[C@@H]15CN4C[C@@H]1N=[N+]=[N-].C#Cc1ccc6cc1.C4(=O)[C@](C)(O)C(C)C.C6C3=O.N35
|
Nc1c(F)cccc1C(=O)N1CC[C@](CF)(NC(=O)CCF)C1
|
NccF)cccc6C=O)NCC[C@]CF))NC=O)CCF)))))C5
|
[N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch1][Ring1][C][F][Branch1][=Branch2][N][C][=Branch1][C][=O][C][C][F][C][Ring1][=N]
|
Nc1c5cccc1F.N12CC[C@@]46C1.C3(=O)CCF.C25=O.C6F.N34
|
O=C([C@@H]1CC1(F)F)N1C[C@@H]2C[C@@]2(CNc2ncccn2)C1
|
O=C[C@@H]CC3F)F))))NC[C@@H]C[C@@]3CNcncccn6))))))))C6
|
[O][=C][Branch1][#Branch2][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F][N][C][C@@H1][C][C@@][Ring1][Ring1][Branch1][O][C][N][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][=C]
|
N13C[C@@H]2C[C@@]27C1.c15ncccn1.[C@@H]16CC1(F)F.O=C36.C47.N45
|
CCC[C@@H](OC)C(=O)NCC12CC(NC(=O)CN3CC[C@H](C)C3)(C1)C(C)(C)O2
|
CCC[C@@H]OC))C=O)NCCCCNC=O)CNCC[C@H]C)C5))))))))C4)CC)C)O5
|
[C][C][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][P][N][C][=Branch1][C][=O][C][N][C][C][C@H1][Branch1][C][C][C][Ring1][=Branch1][Branch1][Ring2][C][Ring1][=C][C][Branch1][C][C][Branch1][C][C][O][Ring2][Ring1][C]
|
C12%10CC9(C1)C(C)(C)O2.CCC[C@@H]6C4=O.N18CC[C@H](C)C1.C5(=O)C8.O6C.N47.C7%10.N59
|
C[C@@H](O)CC(C)(C)CNC(=O)[C@H]1CCN(C(=O)C2(CO)CCCCC2)C[C@H]1O
|
C[C@@H]O)CCC)C)CNC=O)[C@H]CCNC=O)CCO))CCCCC6)))))))C[C@H]6O
|
[C][C@@H1][Branch1][C][O][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][C][C][C][Ring1][Branch2][C][C@H1][Ring1][S][O]
|
C[C@@H](O)CC(C)(C)C5.[C@H]16CCN4C[C@H]1O.C178CCCCC1.C36=O.C47=O.N35.C8O
|
CN(C(=O)c1cccc2c1CCCC2)C1CC(NC(=O)[C@@H]2CCC(=O)N2)C1
|
CNC=O)cccccc6CCCC6)))))))))))CCCNC=O)[C@@H]CCC=O)N5)))))))C4
|
[C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][=Branch1][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][Ring1][=N]
|
c18cccc2c1CCCC2.[C@@H]17CCC(=O)N1.C15CC6C1.CN35.C38=O.C47=O.N46
|
CC1(C)C[C@H](C(=O)N2CC[C@@H]3[C@@H](NC(=O)c4ccco4)[C@@H]32)CCO1
|
CCC)C[C@H]C=O)NCC[C@@H][C@@H]NC=O)cccco5)))))))[C@@H]36)))))))CCO6
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C@@H1][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C@@H1][Ring1][O][Ring1][=C][C][C][O][Ring2][Ring1][#Branch1]
|
CC1(C)C[C@H]9CCO1.N15CC[C@@H]2[C@@H]7[C@@H]21.c18ccco1.C59=O.C68=O.N67
|
COCc1ccc(C(=O)N2C[C@H](C)N(C(=O)CC(C)(C)C(C)(F)F)C[C@H]2C)[nH]1
|
COCccccC=O)NC[C@H]C)NC=O)CCC)C)CC)F)F)))))C[C@H]6C))))))))[nH]5
|
[C][O][C][C][=C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][F][F][C][C@H1][Ring1][P][C][NH1][Ring2][Ring1][=Branch2]
|
C4(=O)CC(C)(C)C(C)(F)F.N13C[C@H](C)N4C[C@H]1C.c17ccc6[nH]1.C36=O.CO5.C57
|
Nc1ccc(Br)c(C(=O)NCCCOCCc2ccccc2)c1
|
NccccBr)cC=O)NCCCOCCcccccc6))))))))))))))c6
|
[N][C][=C][C][=C][Branch1][C][Br][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1]
|
Nc1ccc(Br)c7c1.c18ccccc1.C6CC4.C37=O.C5C8.N36.O45
|
COC[C@H](O)C(=O)N[C@@H](C)[C@H]1CCN(C(=O)Cc2ccccc2OC)C1
|
COC[C@H]O)C=O)N[C@@H]C)[C@H]CCNC=O)Ccccccc6OC))))))))))C5
|
[C][O][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring1][S]
|
c19ccccc16.C5[C@H](O)C3=O.[C@H]18CCN4C1.C4(=O)C9.[C@@H]78C.CO5.N37.O6C
|
CSCC1(CC(=O)N2C[C@@H](N(C)C(=O)c3cnsc3)C3(CC3)C2)CC1
|
CSCCCC=O)NC[C@@H]NC)C=O)ccnsc5)))))))CCC3))C5)))))))CC3
|
[C][S][C][C][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][S][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=N][S][C][=Ring1][Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][S][C][C][Ring2][Ring1][=Branch1]
|
N14C[C@@H]7C2(CC2)C1.c18cnsc1.C19%10CC1.C%10C4=O.N57C.C58=O.CS6.C69
|
COc1ccc(C(=O)N[C@@H]2COC[C@H]2CNC(=O)c2cnsn2)c(OC)n1
|
COccccC=O)N[C@@H]COC[C@H]5CNC=O)ccnsn5)))))))))))))))cOC))n6
|
[C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C@@H1][C][O][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][=N][S][N][=Ring1][Branch1][C][Branch1][Ring1][O][C][=N][Ring2][Ring1][=Branch2]
|
c15ccc%10c6n1.[C@@H]18COC[C@H]1%11.c19cnsn1.C3%10=O.C49=O.CO5.N38.C7%11.N47.O6C
|
CN1CCC[C@@]1(C)C(=O)N1CCC[C@H](N(CCF)C(=O)Cc2ccc(Cl)s2)C1
|
CNCCC[C@@]5C)C=O)NCCC[C@H]NCCF)))C=O)CccccCl)s5))))))))C6
|
[C][N][C][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][=Branch1][N][Branch1][Ring2][C][C][F][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1][C][Ring2][Ring1][Ring1]
|
CN1CCC[C@]17C.N13CCC[C@H]6C1.c18ccc(Cl)s1.C4(=O)C8.C37=O.N456.C5CF
|
CC(=O)N[C@@H](C(=O)N[C@@H](CNC(=O)CCCN=[N+]=[N-])CC(C)C)C(C)(C)C
|
CC=O)N[C@@H]C=O)N[C@@H]CNC=O)CCCN=[N+]=[N-])))))))))CCC)C))))))CC)C)C
|
[C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C][C][C][N][=N+1][=N-1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C]
|
[C@H]4(C2=O)C(C)(C)C.C3(=O)CCCN=[N+]=[N-].[C@H]5(C6)CC(C)C.CC1=O.N14.N25.N36
|
COc1cc(Cl)ccc1C(=O)N[C@H]1CCC[C@@H]1NC(=O)[C@H](C)Cc1ccccn1
|
COcccCl)ccc6C=O)N[C@H]CCC[C@@H]5NC=O)[C@H]C)Ccccccn6
|
[C][O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1]
|
c14cc(Cl)ccc17.[C@H]15CCC[C@@H]16.C3(=O)[C@H](C)C8.c18ccccn1.C27=O.CO4.N25.N36
|
Cn1cccc1CCC(=O)NC[C@@]12CC[C@@H](CN(C(=O)C3(C4CC4)CCC3)C1)C2
|
Cncccc5CCC=O)NC[C@@]CC[C@@H]CNC=O)CCCC3)))CCC4)))))C7)))C5
|
[C][N][C][=C][C][=C][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@][C][C][C@@H1][Branch2][Ring1][#Branch2][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][#Branch1][C][Ring1][S][C][Ring1][P]
|
[C@@]12%10CC[C@@H](CN6C1)C2.C18(C2CC2)CCC1.Cn1cccc19.C9CC5=O.C68=O.N57.C7%10
|
C#CCN(CC)CCNC(=O)C#CC(C)(C)C
|
C#CCNCC))CCNC=O)C#CCC)C)C
|
[C][#C][C][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][Branch1][C][C][C]
|
C1(=O)C#CC(C)(C)C.C#CC2.N234.C4C5.C3C.N15
|
Cc1ncsc1C(=O)N1CC2(C[C@H](C(=O)NC[C@H]3CC(=O)N(C)C3)CO2)C1
|
Ccncsc5C=O)NCCC[C@H]C=O)NC[C@H]CC=O)NC)C5))))))))CO5))))C4
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=N][C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@H1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][#Branch1][C][O][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14CC2(C[C@H]8CO2)C1.[C@H]19CC(=O)N(C)C1.Cc1ncsc17.C47=O.C58=O.N56.C69
|
CC(C)(C)OC(=O)NCC#Cc1cncc(C(=O)N[C@@H](CC(F)(F)F)C(N)=O)c1
|
CCC)C)OC=O)NCC#CccnccC=O)N[C@@H]CCF)F)F)))CN)=O)))))c6
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][#C][C][=C][N][=C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][N][=O][=C][Ring2][Ring1][C]
|
C6C#Cc1cncc8c1.[C@H]7(CC(F)(F)F)C(N)=O.CC5(C)C.C23=O.C48=O.O25.N36.N47
|
COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3c([N+](=O)[O-])cnn3C)C2)cc(OC)n1
|
COcccC=O)N[C@H]C[C@H]NC=O)cc[N+]=O)[O-]))cnn5C))))))))C4))))))ccOC))n6
|
[C][O][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=N][N][Ring1][Branch2][C][C][Ring1][S][=C][C][Branch1][Ring1][O][C][=N][Ring2][Ring1][O]
|
c1%10c([N+](=O)[O-])cnn1C.c16cc%11cc7n1.[C@H]18C[C@H]9C1.C4%11=O.C5%10=O.CO6.N48.N59.O7C
|
CCCC1(C(=O)NC[C@H]2C[C@@H](NC(=O)c3cccc(C)c3C(F)(F)F)C2)CCC1
|
CCCCC=O)NC[C@H]C[C@@H]NC=O)cccccC)c6CF)F)F))))))))))C4)))))))CCC4
|
[C][C][C][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][C][C][C][C][Ring2][Ring1][#Branch2]
|
c19cccc(C)c1%12.C18%10CCC1.[C@H]1%11C[C@@H]7C1.C%12(F)(F)F.CCC%10.C48=O.C59=O.N46.C6%11.N57
|
CC/C=C/CC(=O)N[C@H]1C[C@@]12CCN(C(=O)COc1cnn(C)c1)C2
|
CC/C=C/CC=O)N[C@H]C[C@@]3CCNC=O)COccnnC)c5))))))))C5
|
[C][C][/C][=C][/C][C][=Branch1][C][=O][N][C@H1][C][C@@][Ring1][Ring1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][#C]
|
[C@H]17C[C@@]12CCN4C2.c16cnn(C)c1.C=8CC3=O.C4(=O)C5.CCC=8.N37.O56
|
O=C(N[C@H](Cn1ccnn1)C(=O)N1CC(O)(c2nn[nH]n2)C1)c1ccncn1
|
O=CN[C@H]Cnccnn5))))))C=O)NCCO)cnn[nH]n5)))))C4)))))))cccncn6
|
[O][=C][Branch2][Ring2][Ring1][N][C@H1][Branch1][=Branch2][C][N][C][=C][N][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][Branch2][C][N][=N][NH1][N][=Ring1][Branch1][C][Ring1][#Branch2][C][=C][C][=N][C][=N][Ring1][=Branch1]
|
[C@@H]5(C7)C4=O.N14CC8(O)C1.c16ccncn1.n17ccnn1.c18nn[nH]n1.O=C36.N35
|
CC[C@@H](C)C(=O)NCC(=O)NC[C@H](NC(=O)c1cnsc1C)c1ccc(F)cc1
|
CC[C@@H]C)C=O)NCC=O)NC[C@H]NC=O)ccnsc5C))))))))ccccF)cc6
|
[C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][=N][S][C][=Ring1][Branch1][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
c19ccc(F)cc1.CC[C@@H](C)C2=O.c18cnsc1C.C5C3=O.C6[C@H]79.C48=O.N25.N36.N47
|
CC[C@@H](C)C[C@H](C)C(=O)N1C[C@H](n2cc(COCc3ccccc3)nn2)CO1
|
CC[C@@H]C)C[C@H]C)C=O)NC[C@H]nccCOCcccccc6)))))))))nn5)))))CO5
|
[C][C][C@@H1][Branch1][C][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch1][N][C][=C][Branch1][N][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C][O][Ring2][Ring1][Ring1]
|
CC[C@@H](C)C[C@H](C)C(=O)N1C[C@H]8CO1.n18cc6nn1.c17ccccc1.C46.O45.C57
|
Cc1ccc(C(=O)N[C@H]2C[C@@H]3CN(C(=O)Cc4cc(Cl)cs4)C[C@@H]3C2)c(O)n1
|
CccccC=O)N[C@H]C[C@@H]CNC=O)CcccCl)cs5)))))))C[C@@H]5C8))))))))))cO)n6
|
[C][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@H1][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][Cl][=C][S][Ring1][=Branch1][C][C@@H1][Ring1][=C][C][Ring1][P][C][Branch1][C][O][=N][Ring2][Ring1][O]
|
[C@H]17C[C@@H]2CN6C[C@@H]2C1.Cc1ccc8c(O)n1.c19cc(Cl)cs1.C6(=O)C9.C58=O.N57
|
CC[C@]1(C(=O)N2CC[C@H](CN(C)C(=O)Cc3cnccc3Cl)C2)CCOC1
|
CC[C@]C=O)NCC[C@H]CNC)C=O)Cccnccc6Cl)))))))))))C5))))))CCOC5
|
[C][C][C@][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][=C][C][=C][Ring1][=Branch1][Cl][C][Ring2][Ring1][C][C][C][O][C][Ring2][Ring1][=Branch2]
|
c1%10cnccc1Cl.[C@]178CCOC1.N14CC[C@H]9C1.C5(=O)C%10.C47=O.N56C.CC8.C69
|
COC[C@@H](NC(=O)[C@@H](O)C1(NC(=O)OC(C)(C)C)CC1)c1ccccc1Cl
|
COC[C@@H]NC=O)[C@@H]O)CNC=O)OCC)C)C)))))CC3))))))cccccc6Cl
|
[C][O][C][C@@H1][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
|
c1%10ccccc1Cl.C3(=O)[C@H]9O.C5[C@@H]7%10.C189CC1.C6(C)(C)C.C24=O.CO5.N37.N48.O26
|
Cc1ccc(F)c(C(=O)N[C@@H]2C[C@@H](O)CN(C(=O)c3cnn(CCO)c3C)C2)c1
|
CccccF)cC=O)N[C@@H]C[C@@H]O)CNC=O)ccnnCCO)))c5C)))))))C6))))))))c6
|
[C][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Branch1][C][O][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=N][N][Branch1][Ring2][C][C][O][C][=Ring1][Branch2][C][C][Ring2][Ring1][C][=C][Ring2][Ring1][N]
|
Cc1ccc(F)c7c1.[C@@H]16C[C@@H](O)CN5C1.c18cnn9c1C.C47=O.C58=O.C9CO.N46
|
CC[C@H](C)c1ccccc1OCC(=O)N[C@H]1CCN(C(=O)c2ccncc2)[C@@H]1C
|
CC[C@H]C)cccccc6OCC=O)N[C@H]CCNC=O)cccncc6)))))))[C@@H]5C
|
[C][C][C@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C@@H1][Ring1][=N][C]
|
c19ccccc16.[C@H]17CCN4[C@@H]1C.c18ccncc1.CC[C@@H]9C.C5C3=O.C48=O.O56.N37
|
CC(=O)N1CC(OCC(=O)N[C@@H]2CC[C@@H](CNC(=O)c3cc(C)cc(Cl)c3)C2)C1
|
CC=O)NCCOCC=O)N[C@@H]CC[C@@H]CNC=O)cccC)ccCl)c6)))))))))C5)))))))))C4
|
[C][C][=Branch1][C][=O][N][C][C][Branch2][Ring2][=Branch1][O][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Ring1][P][C][Ring2][Ring1][#Branch2]
|
c1%11cc(C)cc(Cl)c1.[C@@H]1%10CC[C@@H]%12C1.N14CC8C1.C7C5=O.CC4=O.C6%11=O.O78.N5%10.C9%12.N69
|
COCCn1nnnc1[C@@H](N[C@]1(C)CC1(C)C)C1CCSCC1
|
COCCnnnnc5[C@@H]N[C@]C)CC3C)C)))))CCCSCC6
|
[C][O][C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][=C][N][C@][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][C][C][C][C][C][S][C][C][Ring1][=Branch1]
|
n15nnnc16.[C@@]14(C)CC1(C)C.C17CCSCC1.C2C5.[C@@H]367.CO2.N34
|
CC(C)C(C)(C)C(=O)NCC(C)(C)C1CCN(C(=O)[C@]2(C)CCCNC2=O)CC1
|
CCC)CC)C)C=O)NCCC)C)CCCNC=O)[C@]C)CCCNC6=O))))))))CC6
|
[C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][N][C][Ring1][#Branch1][=O][C][C][Ring1][S]
|
CC(C)C(C)(C)C3=O.[C@@]16(C)CCCNC1=O.C17CCN4CC1.C5C7(C)C.C46=O.N35
|
Cc1cc(C(=O)N[C@H]2CCCN(C(=O)[C@@H]3OCCn4ccnc43)CC2)cn1C
|
CcccC=O)N[C@H]CCCNC=O)[C@@H]OCCnccnc59))))))))))CC7)))))))))cn5C
|
[C][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][O][C][C][N][C][=C][N][=C][Ring1][Branch1][Ring1][=Branch2][C][C][Ring2][Ring1][C][=C][N][Ring2][Ring1][#Branch2][C]
|
C6(=O)[C@@H]1OCCn2ccnc21.[C@H]17CCCN6CC1.Cc1cc8cn1C.C58=O.N57
|
Cc1nc(C(C)C)nc(N2CC[C@H](CNC(=O)C(CC(C)C)CC(C)C)C2)c1Br
|
CcncCC)C))ncNCC[C@H]CNC=O)CCCC)C)))CCC)C)))))))C5)))))c6Br
|
[C][C][=N][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][C][Branch2][Ring1][P][N][C][C][C@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][Branch1][C][C][C][C][C][Branch1][C][C][C][C][Ring2][Ring1][C][=C][Ring2][Ring1][O][Br]
|
C3(=O)C(CC(C)C)CC(C)C.Cc1nc6nc5c1Br.N15CC[C@H]7C1.C6(C)C.C47.N34
|
CC[C@@H](NC(C)=O)C(=O)N1[C@@H]2CCC[C@H]1C[C@H](NC(=O)CC(C)(C)C(=O)OC)C2
|
CC[C@@H]NCC)=O)))C=O)N[C@@H]CCC[C@H]6C[C@H]NC=O)CCC)C)C=O)OC)))))))C8
|
[C][C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Ring1][=Branch1][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][Ring2][Ring1][Ring1]
|
N15[C@@H]2CCC[C@H]1C[C@H]8C2.C6(=O)CC(C)(C)C3=O.CC[C@@H]7C5=O.C4(C)=O.N47.N68.O3C
|
C[C@@H](C(=O)NCc1ccc(CN(C)C(=O)c2cccc(Cl)c2Cl)cc1)N(C)C
|
C[C@@H]C=O)NCccccCNC)C=O)cccccCl)c6Cl))))))))))cc6)))))))))NC)C
|
[C][C@@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][=C][Ring2][Ring1][Ring1][N][Branch1][C][C][C]
|
c18cccc(Cl)c1Cl.c19ccc%10cc1.C[C@H]5C3=O.N47C.C48=O.N5(C)C.N36.C69.C7%10
|
CON=CC(=O)N[C@H]1CCCC[C@@H]1NC(=O)[C@@H]1CCCc2cc(C#N)ccc21
|
CON=CC=O)N[C@H]CCCC[C@@H]6NC=O)[C@@H]CCCcccC#N))ccc6%10
|
[C][O][N][=C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][=C][C][Branch1][Ring1][C][#N][=C][C][=C][Ring1][Branch2][Ring1][N]
|
C4(=O)[C@@H]1CCCc2cc(C#N)ccc21.[C@H]15CCCC[C@@H]16.CON=CC3=O.N35.N46
|
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