SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(C)(CO)C(=O)NC[C@]1(O)CCN(C(=O)C2(c3ccno3)CC2)C1
|
CCC)CO))C=O)NC[C@]O)CCNC=O)Ccccno5)))))CC3))))C5
|
[C][C][Branch1][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C@][Branch1][C][O][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][Branch2][C][=C][C][=N][O][Ring1][Branch1][C][C][Ring1][Branch2][C][Ring1][S]
|
CC(C)(CO)C4=O.[C@@]18(O)CCN5C1.c19ccno1.C179CC1.C57=O.N46.C68
|
CCCC(=O)N1CC=C[C@H]1CNC(=O)[C@H]1CCCN(C(=O)c2ccc(C)cc2)C1
|
CCCC=O)NCC=C[C@H]5CNC=O)[C@H]CCCNC=O)ccccC)cc6)))))))C6
|
[C][C][C][C][=Branch1][C][=O][N][C][C][=C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][Ring1][#C]
|
[C@H]17CCCN5C1.c18ccc(C)cc1.N13CC=C[C@H]19.CCCC3=O.C47=O.C58=O.C69.N46
|
CCC[C@@H]1CCN(C(=O)[C@H](CC(C)C)NC(=O)c2ccsc2)C1
|
CCC[C@@H]CCNC=O)[C@H]CCC)C)))NC=O)cccsc5)))))))))C5
|
[C][C][C][C@@H1][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][Ring2][Ring1][Ring2]
|
C3(=O)[C@@H]5CC(C)C.[C@@H]17CCN3C1.c16ccsc1.CCC7.C46=O.N45
|
C[C@H](c1noc(-c2ccc3cc[nH]c3n2)n1)[C@H]1CCCO1
|
C[C@H]cnoc-cccccc[nH]c5n9)))))))))n5)))))[C@H]CCCO5
|
[C][C@H1][Branch2][Ring1][#Branch1][C][=N][O][C][Branch1][=C][C][=C][C][=C][C][=C][NH1][C][Ring1][Branch1][=N][Ring1][=Branch2][=N][Ring1][=C][C@H1][C][C][C][O][Ring1][Branch1]
|
c16ccc2cc[nH]c2n1.c15noc6n1.[C@H]14CCCO1.C[C@@H]45
|
CC[C@H](CC(=O)N1CCO[C@@](C)(CNC(=O)C=C(C)Cl)C1)c1ccc(OC)cc1
|
CC[C@H]CC=O)NCCO[C@@]C)CNC=O)C=CC)Cl))))))C6))))))))ccccOC))cc6
|
[C][C][C@H1][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][C][O][C@@][Branch1][C][C][Branch1][=N][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][Cl][C][Ring1][#C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2]
|
N12CCO[C@]7(C)C1.CC[C@@H]8CC2=O.c18ccc4cc1.C3(=O)C=6.C=6(C)Cl.C57.N35.O4C
|
CN(CCOCCNC(=O)[C@@H]1C[C@@H]1F)C(=O)Cc1cc(F)ccc1Cl
|
CNCCOCCNC=O)[C@@H]C[C@@H]3F)))))))))))C=O)CcccF)ccc6Cl
|
[C][N][Branch1][P][C][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][F][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Cl]
|
c19cc(F)ccc1Cl.[C@@H]18C[C@@H]1F.C3(=O)C9.CN36.C6C4.C5C7.C28=O.O45.N27
|
C=CCCCC(=O)N[C@H]1C[C@@](C(=O)NOCC=C)(c2c(F)cccc2F)C1
|
C=CCCCC=O)N[C@H]C[C@@]C=O)NOCC=C))))))ccF)cccc6F)))))))C4
|
[C][=C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@][Branch1][#Branch2][C][=Branch1][C][=O][N][O][C][C][=C][Branch1][=N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][Ring2][Ring1][Ring1]
|
c17c(F)cccc1F.C=CCCCC3=O.[C@H]15C[C@@]67C1.C6(=O)NO4.C4C=C.N35
|
CCCC[C@@H](C)CN1CCC[C@]1(C)Cc1cccc2ccccc12
|
CCCC[C@@H]C)CNCCC[C@]5C)Ccccccccccc%106
|
[C][C][C][C][C@@H1][Branch1][C][C][C][N][C][C][C][C@][Ring1][Branch1][Branch1][C][C][C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1]
|
c15cccc2ccccc12.CCCC[C@@H](C)C3.N13CCC[C@@]14C.C45
|
O=C([C@@H]1C[C@H]1CF)N1CCN(C(=O)c2cc(Br)co2)[C@H](c2cn[nH]c2)C1
|
O=C[C@@H]C[C@H]3CF)))))NCCNC=O)cccBr)co5))))))[C@H]ccn[nH]c5)))))C6
|
[O][=C][Branch1][Branch2][C@@H1][C][C@H1][Ring1][Ring1][C][F][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][O][Ring1][=Branch1][C@H1][Branch1][Branch2][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
N13CCN4[C@H]8C1.c15cc(Br)co1.c18cn[nH]c1.[C@@H]16C[C@H]17.O=C36.C45=O.C7F
|
Cc1cc(Br)cnc1C(=O)N[C@H]1C[C@@H](NC(=O)[C@]2(C#N)[C@H](C#N)C2(C)C)C1
|
CcccBr)cnc6C=O)N[C@H]C[C@@H]NC=O)[C@]C#N))[C@H]C#N))C3C)C))))))C4
|
[C][C][=C][C][Branch1][C][Br][=C][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C@][Branch1][Ring1][C][#N][C@H1][Branch1][Ring1][C][#N][C][Ring1][#Branch1][Branch1][C][C][C][C][Ring1][S]
|
[C@@]18(C#N)[C@H](C#N)C1(C)C.Cc1cc(Br)cnc17.[C@H]15C[C@@H]6C1.C37=O.C48=O.N35.N46
|
CCOCCNC(=NCCc1cnccn1)N1CC[C@H](NC(=O)NC)C1
|
CCOCCNC=NCCccnccn6)))))))))NCC[C@H]NC=O)NC))))C5
|
[C][C][O][C][C][N][C][=Branch1][N][=N][C][C][C][=C][N][=C][C][=N][Ring1][=Branch1][N][C][C][C@H1][Branch1][Branch2][N][C][=Branch1][C][=O][N][C][C][Ring1][#Branch2]
|
N6C(=NCC8)N1CC[C@H]7C1.c18cnccn1.C5C6.C23=O.CC4.O45.N27.N3C
|
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCCO3)C1
|
CnccCF)F)F))nc5[C@@H]CCCNC=O)cccCl)ccc6)OCCO6))))))))))C6
|
[C][N][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][=Branch2][C@@H1][C][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][=Branch1][Ring2][=C][Ring1][#Branch1][O][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
c15cc(Cl)c2c(c1)OCCO2.Cn1cc6nc17.[C@@H]17CCCN4C1.C6(F)(F)F.C45=O
|
CCc1sccc1C(=O)N[C@@H]1C=CCN(C(=O)c2csc(C3CCCCC3)n2)C1
|
CCcsccc5C=O)N[C@@H]C=CCNC=O)ccscCCCCCC6))))))n5))))))C6
|
[C][C][C][S][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][=C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][S][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][=N][Ring1][O][C][Ring2][Ring1][Ring1]
|
[C@@H]16C=CCN5C1.c19sccc18.c17csc%10n1.C1%10CCCCC1.C48=O.C57=O.CC9.N46
|
C=C(CCNC(=O)[C@H]1C[C@@H]1F)CNC(=O)C1(c2ccc(Br)c(Cl)c2)CC1
|
C=CCCNC=O)[C@H]C[C@@H]3F))))))))CNC=O)CccccBr)cCl)c6))))))CC3
|
[C][=C][Branch1][=C][C][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][F][C][N][C][=Branch1][C][=O][C][Branch1][#C][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][Cl][=C][Ring1][Branch2][C][C][Ring1][O]
|
c19ccc(Br)c(Cl)c1.C=C(C6)CC5.[C@H]17C[C@@H]1F.C189CC1.C37=O.C48=O.N35.N46
|
CC(C)[C@@H](NC(=O)CN1CCC(F)CC1)C(=O)N[C@H]1CCn2nnnc2C1
|
CCC)[C@@H]NC=O)CNCCCF)CC6)))))))))C=O)N[C@H]CCnnnnc5C9
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][N][C][C][C][Branch1][C][F][C][C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][N][N][=N][N][=C][Ring1][Branch1][C][Ring1][=Branch2]
|
[C@H]17CCn2nnnc2C1.CC(C)[C@@H]5C4=O.N16CCC(F)CC1.C3(=O)C6.N35.N47
|
COC(=O)N1CC(CN2C(=O)CCN(Cc3cc(C(F)(F)F)ncc3F)C2=O)C1
|
COC=O)NCCCNC=O)CCNCcccCF)F)F))ncc6F))))))))C6=O))))))))C4
|
[C][O][C][=Branch1][C][=O][N][C][C][Branch2][Ring2][=Branch1][C][N][C][=Branch1][C][=O][C][C][N][Branch2][Ring1][Branch1][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][=C][Ring1][#Branch2][F][C][Ring2][Ring1][Ring1][=O][C][Ring2][Ring1][=Branch2]
|
N16C(=O)CCN7C1=O.c1%10cc8ncc1F.N15CC9C1.C8(F)(F)F.C45=O.CO4.C69.C7%10
|
C/C(=C\C(C)(C)C)C(=O)N[C@H]1C[C@@H](CNC(=O)[C@H]2CC[C@]3(C2)CC3(F)F)C1
|
C/C=C\CC)C)C)))C=O)N[C@H]C[C@@H]CNC=O)[C@H]CC[C@]C5)CC3F)F))))))))))C4
|
[C][/C][=Branch1][#Branch2][=C][\C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C@H1][C][C][C@][Branch1][Ring2][C][Ring1][Branch1][C][C][Ring1][Ring2][Branch1][C][F][F][C][Ring1][P]
|
[C@H]18CC[C@]2(C1)CC2(F)F.CC=9C4=O.C=9C(C)(C)C.[C@H]17C[C@@H]%10C1.C58=O.N47.C6%10.N56
|
Cc1ccccc1CCNC(=O)[C@@H]1CCCN1C(=O)[C@@]1(C)CCC[C@H]1O
|
Ccccccc6CCNC=O)[C@@H]CCCN5C=O)[C@@]C)CCC[C@H]5O
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][C@H1][Ring1][=Branch1][O]
|
Cc1ccccc17.[C@]16(C)CCC[C@H]1O.[C@@H]15CCCN13.C7C4.C25=O.C36=O.N24
|
CN1CCN(C(=O)CC23CCCN2CCC3)C[C@@H]1CNC(=O)C[C@@H]1CCNC1=O
|
CNCCNC=O)CCCCCN5CCC8))))))))))C[C@@H]6CNC=O)C[C@@H]CCNC5=O
|
[C][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][C][C][N][Ring1][Branch1][C][C][C][Ring1][Branch2][C][C@@H1][Ring1][P][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][N][C][Ring1][Branch1][=O]
|
CN1CCN4C[C@@H]18.C127CCCN1CCC2.[C@@H]19CCNC1=O.C4(=O)C7.C5(=O)C9.C68.N56
|
COC(=O)c1csc(CN2CC3(CC(C(=O)Nc4c(C)cc(Br)nc4Cl)C3)C2)n1
|
COC=O)ccscCNCCCCC=O)NccC)ccBr)nc6Cl)))))))))C4)))C4)))))n5
|
[C][O][C][=Branch1][C][=O][C][=C][S][C][Branch2][Ring2][Branch2][C][N][C][C][Branch2][Ring1][=N][C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][Branch1][C][C][C][=C][Branch1][C][Br][N][=C][Ring1][Branch2][Cl][C][Ring1][S][C][Ring2][Ring1][Ring1][=N][Ring2][Ring1][=Branch2]
|
c18c(C)cc(Br)nc1Cl.N17CC2(CC%10C2)C1.c19csc%11n1.C59=O.C6%10=O.CO5.C7%11.N68
|
CCOc1nccc(C)c1C(=O)NC[C@](C)(O)CNC(=O)[C@@]1(C)CCOC1
|
CCOcncccC)c6C=O)NC[C@]C)O)CNC=O)[C@@]C)CCOC5
|
[C][C][O][C][=N][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][C][O][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][O][C][Ring1][=Branch1]
|
c15nccc(C)c19.C6[C@](C)(O)C7.[C@]18(C)CCOC1.C29=O.C38=O.CC4.O45.N26.N37
|
CCCn1cc(C(=O)NC[C@]23CCC[C@H]2CN(C(=O)[C@]2(C)CC2(F)F)C3)cn1
|
CCCnccC=O)NC[C@]CCC[C@H]5CNC=O)[C@]C)CC3F)F)))))C8)))))))))))cn5
|
[C][C][C][N][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@][C][C][C][C@H1][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][F][F][C][Ring1][S][C][=N][Ring2][Ring1][=Branch2]
|
[C@]12%10CCC[C@H]1CN5C2.n19cc8cn1.[C@@]17(C)CC1(F)F.CCC9.C48=O.C57=O.N46.C6%10
|
CC1(OCC(=O)N2CC[C@H]([C@H]3CCN(C(=O)CCc4csc(=N)[nH]4)C3)C2)CCC1
|
CCOCC=O)NCC[C@H][C@H]CCNC=O)CCccsc=N)[nH]5))))))))C5)))))C5))))))))CCC4
|
[C][C][Branch2][Ring2][O][O][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][#Branch2][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][=C][S][C][=Branch1][C][=N][NH1][Ring1][=Branch1][C][Ring1][#C][C][Ring2][Ring1][Ring2][C][C][C][Ring2][Ring1][N]
|
N15CC[C@H]([C@H]2CCN6C2)C1.c19csc(=N)[nH]1.CC17CCC1.C6(=O)CC9.C8C5=O.O78
|
CC(=O)NCCCC(=O)N1CC[C@@H]2[C@H](CC1)[C@H]2NC(=O)C(C)(C)C(C)(C)C
|
CC=O)NCCCC=O)NCC[C@@H][C@H]CC7))[C@H]3NC=O)CC)C)CC)C)C
|
[C][C][=Branch1][C][=O][N][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C@H1][Branch1][Branch1][C][C][Ring1][#Branch1][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C]
|
N14CC[C@@H]2[C@@H]7[C@@H]2CC1.C5(=O)C(C)(C)C(C)(C)C.C6CCC4=O.CC3=O.N36.N57
|
CCCCCCn1nnnc1[C@@H](NCCSCCCO)c1cc(C(C)(C)C)no1
|
CCCCCCnnnnc5[C@@H]NCCSCCCO))))))))cccCC)C)C))no5
|
[C][C][C][C][C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][=Branch2][N][C][C][S][C][C][C][O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][O][Ring1][=Branch2]
|
CCCCCC6.n16nnnc17.c18cc9no1.C5CCO.C9(C)(C)C.[C@@H]278.C3C4.N23.S45
|
Cc1coc(C=CC(=O)N[C@H](C)C[C@@H](C)NC(=O)c2cc(C(=O)C(C)C)c[nH]2)n1
|
CccocC=CC=O)N[C@H]C)C[C@@H]C)NC=O)cccC=O)CC)C)))c[nH]5))))))))))))))n5
|
[C][C][=C][O][C][Branch2][Ring2][Branch2][C][=C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][C][C][=C][NH1][Ring1][#Branch2][=N][Ring2][Ring1][N]
|
Cc1coc(C=9)n1.[C@@H]5(C)C[C@H]6C.c17cc8c[nH]1.C8(=O)C(C)C.C=9C3=O.C47=O.N35.N46
|
CC[C@@H](O)[C@H]1CCCN1S(=O)(=O)c1ccc(NCc2ncoc2C)cc1Br
|
CC[C@@H]O)[C@H]CCCN5S=O)=O)ccccNCcncoc5C))))))))cc6Br
|
[C][C][C@@H1][Branch1][C][O][C@H1][C][C][C][N][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][O][N][C][C][N][=C][O][C][=Ring1][Branch1][C][C][=C][Ring1][=C][Br]
|
S4(=O)(=O)c1ccc5cc1Br.[C@H]16CCCN14.c17ncoc1C.CC[C@H]6O.N35.C37
|
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNC(=O)[C@]23CCCCC(=O)N2CCC3)[C@H](C)C1
|
C=CC)CC)C)C=O)NC[C@@H]CNC=O)[C@]CCCCC=O)N7CCC%10)))))))))))))[C@H]C)C5
|
[C][=C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C@][C][C][C][C][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][C][Ring1][O][C@H1][Branch1][C][C][C][Ring2][Ring1][Branch1]
|
[C@]127CCCCC(=O)N1CCC2.C=C(C)C(C)(C)C4=O.N14C[C@@H]8[C@H](C)C1.C57=O.C68.N56
|
Cc1noc(C)c1C[C@H](C)C(=O)N[C@@]1(C)CCN(C(=O)C[C@]2(O)CCCOC2)C1
|
CcnocC)c5C[C@H]C)C=O)N[C@@]C)CCNC=O)C[C@]O)CCCOC6))))))))C5
|
[C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@][Branch1][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C@][Branch1][C][O][C][C][C][O][C][Ring1][#Branch1][C][Ring1][S]
|
Cc1noc(C)c17.[C@]15(C)CCN4C1.[C@@]16(O)CCCOC1.C7[C@H](C)C3=O.C4(=O)C6.N35
|
O=C(Nc1ccc2nncn2c1)[C@H]1CCCCN1Cc1cccc(OC(F)F)c1
|
O=CNccccnncn5c9))))))))))[C@H]CCCCN6CcccccOCF)F)))c6
|
[O][=C][Branch1][#C][N][C][C][=C][C][=N][N][=C][N][Ring1][Branch1][C][=Ring1][=Branch2][C@H1][C][C][C][C][N][Ring1][=Branch1][C][C][=C][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring1][#Branch2]
|
c16ccc2nncn2c1.[C@H]17CCCCN15.c18cccc4c1.O4C(F)F.O=C37.N36.C58
|
C#Cc1nc(C(=O)N2C[C@H](NC(=O)[C@H](C)n3cc(C)cn3)CC2(CC)CC)cs1
|
C#CcncC=O)NC[C@H]NC=O)[C@H]C)nccC)cn5))))))))CC5CC))CC))))))))cs5
|
[C][#C][C][=N][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=C][Branch1][C][C][C][=N][Ring1][=Branch1][C][C][Ring1][S][Branch1][Ring1][C][C][C][C][=C][S][Ring2][Ring1][O]
|
N14C[C@H]6CC19%10.C#Cc1nc7cs1.n18cc(C)cn1.C5(=O)[C@@H]8C.C47=O.N56.C9C.C%10C
|
COC[C@@H](C(=O)NCc1c[nH]nc1C(=O)NC[C@H](SC)C1CC1)N(C)C
|
COC[C@@H]C=O)NCcc[nH]nc5C=O)NC[C@H]SC))CCC3)))))))))))))))NC)C
|
[C][O][C][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][=C][NH1][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][S][C][C][C][C][Ring1][Ring1][N][Branch1][C][C][C]
|
C5[C@H]6C2=O.c13c[nH]nc1%10.C8[C@H]9%11.C4%10=O.C1%11CC1.N6(C)C.CO5.N27.C73.N48.S9C
|
Cc1ccc(SCCC(=O)N2CCC[C@@]3(NC(=O)c4cc[nH]c4)C[C@H]23)cc1
|
CccccSCCC=O)NCCC[C@@]NC=O)ccc[nH]c5)))))))C[C@H]73)))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring1][P][S][C][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][=N][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=Ring1][Branch1][C][C@H1][Ring1][#C][Ring1][O][C][=C][Ring2][Ring1][#Branch2]
|
N15CCC[C@@]28C[C@H]12.Cc1ccc%10cc1.C7CC5=O.c19cc[nH]c1.C69=O.S7%10.N68
|
COc1ccccc1[C@]1(C)C[C@@H]1C(=O)NCc1ncoc1CCNC(=O)C(F)F
|
COcccccc6[C@]C)C[C@@H]3C=O)NCcncoc5CCNC=O)CF)F
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@][Branch1][C][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][N][=C][O][C][=Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][F]
|
c14ccccc1%10.c18ncoc19.[C@@]1%10(C)C[C@@H]17.C3(=O)C(F)F.C27=O.C9C6.CO4.N25.C58.N36
|
CC(=CC(=O)N1C[C@H](C)C[C@@H](CO)C1)CNC(=O)c1ccc(C)c(C#N)c1
|
CC=CC=O)NC[C@H]C)C[C@@H]CO))C6))))))))CNC=O)ccccC)cC#N))c6
|
[C][C][=Branch2][Ring1][Branch1][=C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C@@H1][Branch1][Ring1][C][O][C][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch1][Ring1][C][#N][=C][Ring1][=Branch2]
|
c15ccc(C)c(C#N)c1.N12C[C@H]7C[C@@H](C)C1.CC=6C4.C=6C2=O.C35=O.C7O.N34
|
CCC1(C(=O)NC2CCN(C(=O)CCCN(C)C(=O)c3ccn(C)n3)CC2)CC1
|
CCCC=O)NCCCNC=O)CCCNC)C=O)cccnC)n5)))))))))))CC6))))))))CC3
|
[C][C][C][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][C][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][O]
|
C18CCN5CC1.C5(=O)CCC7.c19ccn(C)n1.C1%10%11CC1.C4%10=O.N67C.C69=O.CC%11.N48
|
CCCCCCCCCC[C@H](C)NC(=O)Nc1c[nH]c2ncccc12
|
CCCCCCCCCC[C@H]C)NC=O)Ncc[nH]cncccc96
|
[C][C][C][C][C][C][C][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][N][C][=C][NH1][C][=N][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]
|
CCCCCCCCCC[C@@H]5C.c16c[nH]c2ncccc12.C34=O.N35.N46
|
C[C@@H](NC(=O)c1cccc2nc(O)oc12)C(C)(C)NC(=O)c1coc(C(N)=O)c1
|
C[C@@H]NC=O)cccccncO)oc95)))))))))))CC)C)NC=O)ccocCN)=O))c5
|
[C][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][N][=C][Branch1][C][O][O][C][Ring1][#Branch2][=Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][Branch2]
|
c18cccc2nc(O)oc12.C[C@@H]5C6(C)C.c19coc7c1.C38=O.C49=O.C7(N)=O.N35.N46
|
Cc1ccc2[nH]cc(CCC(=O)NCCN(C)C(=O)[C@H]3C[C@]3(C)C(F)(F)F)c2c1
|
Ccccc[nH]ccCCC=O)NCCNC)C=O)[C@H]C[C@]3C)CF)F)F)))))))))))))c5c9
|
[C][C][=C][C][=C][NH1][C][=C][Branch2][Ring2][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C@][Ring1][Ring1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][Branch2][=C][Ring2][Ring1][N]
|
Cc1ccc2[nH]cc%10c2c1.C%10CC4=O.[C@H]18C[C@@]19C.C9(F)(F)F.C6C7.N57C.C58=O.N46
|
C=C(C)CNC(=O)[C@@H]([C@@H]1C[C@H]1c1cccs1)N(CCCC)CCCC
|
C=CC)CNC=O)[C@@H][C@@H]C[C@H]3ccccs5))))))))NCCCC))))CCCC
|
[C][=C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=N][C@@H1][C][C@H1][Ring1][Ring1][C][=C][C][=C][S][Ring1][Branch1][N][Branch1][Branch1][C][C][C][C][C][C][C][C]
|
C2(=O)[C@H]47.c18cccs1.C=C(C)C3.[C@@H]17C[C@H]18.C5CCC.C6CCC.N456.N23
|
CC(C)(C)c1nc(C(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)N3C(=O)COC2COC2)n[nH]1
|
CCC)C)cncC=O)NC[C@H]C[C@H]CC[C@@H]C7)N5C=O)COCCOC4)))))))))))))))))n[nH]5
|
[C][C][Branch1][C][C][Branch1][C][C][C][=N][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][O][C][C][O][C][Ring1][Ring2][=N][NH1][Ring2][Ring1][=Branch2]
|
[C@H]1%11C[C@H]2CC[C@@H](C1)N25.c1%10nc9n[nH]1.CC%10(C)C.C5(=O)C6.C17COC1.C49=O.N48.C8%11.O67
|
COC1CC(CCC(=O)N[C@@H](C(=O)NCCC(F)=C(F)F)C2CCCC2)C1
|
COCCCCCC=O)N[C@@H]C=O)NCCCF)=CF)F)))))))CCCCC5))))))))))C4
|
[C][O][C][C][C][Branch2][Ring2][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][=C][Branch1][C][F][F][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
C7CC(F)=C(F)F.C15CC8C1.C8CC3=O.[C@@H]69C4=O.C19CCCC1.CO5.N36.N47
|
CN(C(=O)c1cn(CC2(C)COC2)nn1)[C@@H]1CCN(C(=O)C2(Br)CC2)C1
|
CNC=O)ccnCCC)COC4)))))nn5))))))[C@@H]CCNC=O)CBr)CC3))))C5
|
[C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][N][Branch1][O][C][C][Branch1][C][C][C][O][C][Ring1][Branch1][N][=N][Ring1][O][C@@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][Br][C][C][Ring1][Ring2][C][Ring1][O]
|
c16cn8nn1.[C@@H]15CCN4C1.C19(C)COC1.C17(Br)CC1.CN35.C36=O.C47=O.C89
|
COCc1ccnc(C(=O)N[C@@H]2CCN(C(=O)CC(Cl)Cl)C[C@H]2CO)c1
|
COCcccncC=O)N[C@@H]CCNC=O)CCCl)Cl))))C[C@H]6CO))))))))))c6
|
[C][O][C][C][=C][C][=N][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][Branch1][C][Cl][Cl][C][C@H1][Ring1][N][C][O][=C][Ring2][Ring1][#Branch1]
|
[C@@H]16CCN4C[C@H]18.c19ccnc7c1.C4(=O)CC(Cl)Cl.C37=O.CO5.C59.N36.C8O
|
CN(C)C(=O)CN1CC2(C[C@H](NC(=O)c3cc4c(O)ncnc4cn3)CO2)C1
|
CNC)C=O)CNCCC[C@H]NC=O)ccccO)ncnc6cn%10))))))))))))CO5))))C4
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][C][Branch2][Ring1][P][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][N][=C][N][=C][Ring1][#Branch1][C][=N][Ring1][O][C][O][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch1]
|
c19cc2c(O)ncnc2cn1.N17CC2(C[C@H]8CO2)C1.C5(=O)C7.CN5C.C69=O.N68
|
C[C@@H]1CN(C(=O)CCC2CCN(C(=O)C34CCC(CC3)C4)CC2)Cc2c[nH]nc21
|
C[C@@H]CNC=O)CCCCCNC=O)CCCCCC6))C5))))))CC6)))))))))Ccc[nH]nc59
|
[C][C@@H1][C][N][Branch2][Ring2][Ring1][C][=Branch1][C][=O][C][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1][C][C][Ring1][#C][C][C][=C][NH1][N][=C][Ring1][Branch1][Ring2][Ring1][N]
|
C[C@@H]1CN5Cc2c[nH]nc21.C18CCN6CC1.C127CCC(CC1)C2.C5(=O)CC8.C67=O
|
CN(C(=O)c1ccc(CCO)cc1)C1CCN(C(=O)C2C[C@H]3COC[C@@H]3C2)CC1
|
CNC=O)ccccCCO)))cc6)))))))CCCNC=O)CC[C@H]COC[C@@H]5C8)))))))))CC6
|
[C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][C][C][O][C][=C][Ring1][=Branch2][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C@H1][C][O][C][C@@H1][Ring1][Branch1][C][Ring1][Branch2][C][C][Ring1][S]
|
C17C[C@H]2COC[C@@H]2C1.c18ccc9cc1.C16CCN5CC1.CN46.C48=O.C9CO.C57=O
|
C[C@@H]1CO[C@H](C(=O)N2CC(N(C)C(=O)C3=C[C@@H](C)C3)C2)C1
|
C[C@@H]CO[C@H]C=O)NCCNC)C=O)C=C[C@@H]C)C4))))))C4)))))C5
|
[C][C@@H1][C][O][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C@@H1][Branch1][C][C][C][Ring1][Branch1][C][Ring1][=N][C][Ring2][Ring1][Ring2]
|
C5(=O)C1=C[C@@H](C)C1.C[C@@H]1CO[C@H]7C1.N14CC6C1.C47=O.N56C
|
COC(=O)c1sc(S(=O)(=O)N2CC[C@H]3CNC(=O)N[C@H]3C2)c(C)c1Cl
|
COC=O)cscS=O)=O)NCC[C@H]CNC=O)N[C@H]6C%10)))))))))))cC)c5Cl
|
[C][O][C][=Branch1][C][=O][C][S][C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C@H1][C][N][C][=Branch1][C][=O][N][C@H1][Ring1][#Branch1][C][Ring1][O][=C][Branch1][C][C][C][=Ring2][Ring1][Ring2][Cl]
|
c16sc(S5(=O)=O)c(C)c1Cl.N15CC[C@H]2CNC(=O)N[C@H]2C1.C46=O.CO4
|
Cc1ccc2cc(C(=O)NC3(C)CN(C(=O)c4nocc4Cl)C3)[nH]c2c1
|
CccccccC=O)NCC)CNC=O)cnocc5Cl)))))))C4))))))[nH]c5c9
|
[C][C][=C][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=N][O][C][=C][Ring1][Branch1][Cl][C][Ring1][=N][NH1][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][=Branch2]
|
Cc1ccc2cc8[nH]c2c1.C17(C)CN6C1.c19nocc1Cl.C58=O.C69=O.N57
|
C=C1CC(C(=O)N2CC3(CCCCN(C(=O)Cc4ccnn4C)C3)C2)C1
|
C=CCCC=O)NCCCCCCNC=O)Ccccnn5C))))))))C7))))))C4)))))C4
|
[C][=C][C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][=C][C][=N][N][Ring1][Branch1][C][C][Ring1][S][C][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch2]
|
N15CC2(CCCCN6C2)C1.c18ccnn1C.C=C1CC7C1.C6(=O)C8.C57=O
|
CC[C@H](C)C[C@H](C)C(=O)N1CCN(C(=O)[C@@]2(CC)CC2(F)F)CC12CCC2
|
CC[C@H]C)C[C@H]C)C=O)NCCNC=O)[C@@]CC))CC3F)F)))))CC6CCC4
|
[C][C][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][C][C][C][Ring1][Branch1][Branch1][C][F][F][C][C][Ring1][#C][C][C][C][Ring1][Ring2]
|
N13CCN4CC12CCC2.CC[C@H](C)C[C@H](C)C3=O.[C@]156CC1(F)F.C45=O.C6C
|
Cc1ccc2[nH]c(C(=O)NC[C@]34CCC[C@@H]3C4(F)F)cc2c1
|
Ccccc[nH]cC=O)NC[C@]CCC[C@@H]5C6F)F))))))))))cc5c9
|
[C][C][=C][C][=C][NH1][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@][C][C][C][C@@H1][Ring1][Branch1][C][Ring1][=Branch1][Branch1][C][F][F][=C][C][Ring1][P][=C][Ring2][Ring1][Branch1]
|
Cc1ccc2[nH]c7cc2c1.[C@]128CCC[C@@H]1C2(F)F.C57=O.N56.C68
|
COCC1(CNC(=O)CCCNC(N)=O)CCN(C(=O)[C@@H]2C[C@H](C)O[C@H]2C)CC1
|
COCCCNC=O)CCCNCN)=O)))))))))CCNC=O)[C@@H]C[C@H]C)O[C@H]5C)))))))CC6
|
[C][O][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C][C][N][C][Branch1][C][N][=O][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][C][O][C@H1][Ring1][=Branch1][C][C][C][Ring2][Ring1][#Branch2]
|
C1%10%11CCN5CC1.[C@@H]19C[C@H](C)O[C@H]1C.C3(=O)CCC8.C4(N)=O.C59=O.CO6.C6%10.C7%11.N37.N48
|
CC(C)C(=O)N(C)CC(=O)NC[C@@H]1COC[C@]2(CCN(C(=O)c3cnc[nH]3)C2)O1
|
CCC)C=O)NC)CC=O)NC[C@@H]COC[C@]CCNC=O)ccnc[nH]5))))))C5))))O6
|
[C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C@][Branch2][Ring1][Ring2][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][NH1][Ring1][Branch1][C][Ring1][N][O][Ring1][P]
|
[C@@H]1%10COC[C@]2(CCN6C2)O1.CC(C)C4=O.c19cnc[nH]1.C7C5=O.N47C.C69=O.N58.C8%10
|
C[C@@H]1CN(C(=O)c2cscc2C(N)=O)C[C@H]1NC(=O)COCCOCCO
|
C[C@@H]CNC=O)ccscc5CN)=O))))))))C[C@H]5NC=O)COCCOCCO
|
[C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][Branch1][C][N][=O][C][C@H1][Ring1][#C][N][C][=Branch1][C][=O][C][O][C][C][O][C][C][O]
|
C[C@@H]1CN3C[C@H]19.c1%10cscc1%11.C4(=O)C5.C3%10=O.C%11(N)=O.C6C7.C8CO.N49.O56.O78
|
C[C@H](CN[C@@H](COC(=N)O)Cc1ccccc1)CC1CCNCC1
|
C[C@H]CN[C@@H]COC=N)O))))Ccccccc6))))))))))CCCCNCC6
|
[C][C@H1][Branch2][Ring1][=Branch1][C][N][C@@H1][Branch1][Branch2][C][O][C][=Branch1][C][=N][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][N][C][C][Ring1][=Branch1]
|
c16ccccc1.C15CCNCC1.C[C@H](C3)C5.[C@H]4(C2)C6.O2C(=N)O.N34
|
CCCCC(=O)N1C[C@H]2CCOC[C@@]2(NC(=O)[C@H]2CC[C@H]([N+](=O)[O-])CC2)C1
|
CCCCC=O)NC[C@H]CCOC[C@@]6NC=O)[C@H]CC[C@H][N+]=O)[O-]))CC6))))))))C9
|
[C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][O][C][C@@][Ring1][=Branch1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][C][C][C@H1][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][C][Ring1][=Branch2][C][Ring2][Ring1][Branch1]
|
N13C[C@H]2CCOC[C@@]25C1.[C@H]16CC[C@H]([N+](=O)[O-])CC1.CCCCC3=O.C46=O.N45
|
CN(C(=O)c1cccc2c1COC2)[C@H]1CCCN(C(=O)[C@]2(CF)CC2(F)F)C1
|
CNC=O)cccccc6COC5))))))))))[C@H]CCCNC=O)[C@]CF))CC3F)F)))))C6
|
[C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][C][Ring1][Branch1][C@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@][Branch1][Ring1][C][F][C][C][Ring1][Branch1][Branch1][C][F][F][C][Ring1][#C]
|
c17cccc2c1COC2.[C@H]15CCCN4C1.[C@@]168CC1(F)F.CN35.C37=O.C46=O.C8F
|
CC[C@](C)(CNC(=O)CCCc1cnn[nH]1)C(=O)N1CC([C@@H]2CC2(F)F)C1
|
CC[C@]C)CNC=O)CCCccnn[nH]5)))))))))))C=O)NCC[C@@H]CC3F)F))))C4
|
[C][C][C@][Branch1][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C][C][=C][N][=N][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][#Branch2][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F][C][Ring1][=Branch2]
|
N14CC([C@@H]2CC2(F)F)C1.CC[C@](C)(C5)C4=O.C3(=O)CCC6.c16cnn[nH]1.N35
|
CC1(CNC(=O)[C@]2(O)CC2(C)C)CCC(NC(=O)c2ccccc2CO)CC1
|
CCCNC=O)[C@]O)CC3C)C)))))))CCCNC=O)cccccc6CO))))))))))CC6
|
[C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@][Branch1][C][O][C][C][Ring1][Ring2][Branch1][C][C][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][C][C][Ring2][Ring1][O]
|
CC19CCC6CC1.c18ccccc1%10.[C@@]17(O)CC1(C)C.C37=O.C48=O.C59.N35.N46.C%10O
|
Cc1nc2cc(C(=O)N(CCO)[C@@H]3CCN(C(=O)COC(F)F)C3)ccc2o1
|
CcncccC=O)NCCO)))[C@@H]CCNC=O)COCF)F)))))C5)))))))ccc6o9
|
[C][C][=N][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C@@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][O][C][Branch1][C][F][F][C][Ring1][N][=C][C][=C][Ring2][Ring1][Branch2][O][Ring2][Ring1][O]
|
Cc1nc2cc9ccc2o1.[C@@H]18CCN5C1.C5(=O)C6.O6C(F)F.C49=O.N478.C7CO
|
C[C@H](CC(=O)N1CCC[C@H](NC(=O)[C@H]2CC23CCC3)CC1)CC(C)(C)C
|
C[C@H]CC=O)NCCC[C@H]NC=O)[C@H]CC3CCC4))))))))CC7)))))))))CCC)C)C
|
[C][C@H1][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][C][Ring1][Ring2][C][C][Ring1][S][C][C][Branch1][C][C][Branch1][C][C][C]
|
C[C@H](CC4=O)CC(C)(C)C.N14CCC[C@H]6CC1.[C@H]17CC12CCC2.C57=O.N56
|
CCO[C@@H](CC(=O)N1CCN(C(=O)C[C@@H]2CN3CCN2CC3)CC1)C1=CCCC1
|
CCO[C@@H]CC=O)NCCNC=O)C[C@@H]CNCCN6CC6))))))))))CC6))))))))C=CCCC5
|
[C][C][O][C@@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C@@H1][C][N][C][C][N][Ring1][=Branch1][C][C][Ring1][=Branch1][C][C][Ring1][P][C][=C][C][C][C][Ring1][Branch1]
|
[C@H]7(CC4=O)C1=CCCC1.[C@@H]18CN2CCN1CC2.N14CCN5CC1.C5(=O)C8.CC6.O67
|
CC(C(=O)NC[C@H]1C[C@]2(CCN(C(=O)c3ccnc(C#N)c3)C2)CO1)=C1CCC1
|
CCC=O)NC[C@H]C[C@]CCNC=O)cccncC#N))c6)))))))C5))))CO5))))))))=CCCC4
|
[C][C][Branch2][Ring2][#Branch2][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][Ring1][C][#N][=C][Ring1][Branch2][C][Ring1][#C][C][O][Ring2][Ring1][Ring1][=C][C][C][C][Ring1][Ring2]
|
[C@H]19C[C@]2(CCN5C2)CO1.c17ccnc(C#N)c1.CC=8C4=O.C1=8CCC1.C57=O.N46.C69
|
Cc1cccc2c1C[C@@H](C(=O)N1CC(O)(CNC(=O)CC[C@H]3CCCOC3)C1)O2
|
Ccccccc6C[C@@H]C=O)NCCO)CNC=O)CC[C@H]CCCOC6)))))))))))C4)))))O5
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][P][O][Ring2][Ring1][Branch2]
|
Cc1cccc2c1C[C@@H]7O2.N14CC8(O)C1.[C@H]19CCCOC1.C5(=O)CC9.C47=O.C68.N56
|
CC[C@@H](C)[C@H](C(=O)N[C@@H]1COC(=O)C1)N(C)C(=O)c1ccc(C(N)=O)o1
|
CC[C@@H]C)[C@H]C=O)N[C@@H]COC=O)C5)))))))NC)C=O)ccccCN)=O))o5
|
[C][C][C@@H1][Branch1][C][C][C@H1][Branch1][S][C][=Branch1][C][=O][N][C@@H1][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][O][Ring1][Branch2]
|
CC[C@@H](C)[C@@H]4C2=O.[C@@H]15COC(=O)C1.c16ccc7o1.N34C.C36=O.C7(N)=O.N25
|
Cc1oc(C(=O)NC(C)(C)CN(C)C(=O)[C@]2(C)C[C@H]3C[C@H]3C2)cc1Br
|
CcocC=O)NCC)C)CNC)C=O)[C@]C)C[C@H]C[C@H]3C6))))))))))))cc5Br
|
[C][C][O][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@][Branch1][C][C][C][C@H1][C][C@H1][Ring1][Ring1][C][Ring1][#Branch1][=C][C][=Ring2][Ring1][#Branch1][Br]
|
Cc1oc8cc1Br.[C@@]19(C)C[C@H]2C[C@H]2C1.C6(C)(C)C7.C48=O.N57C.C59=O.N46
|
CC[C@H](CCC(=O)NC[C@]1(NC(=O)Cc2cccc3nonc23)CCOC1)OC
|
CC[C@H]CCC=O)NC[C@]NC=O)Ccccccnonc95))))))))))))CCOC5))))))))))OC
|
[C][C][C@H1][Branch2][Ring2][#Branch1][C][C][C][=Branch1][C][=O][N][C][C@][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=N][O][N][=C][Ring1][=Branch2][Ring1][Branch1][C][C][O][C][Ring2][Ring1][C][O][C]
|
c1%10cccc2nonc12.CC[C@@H]6CCC4=O.[C@]189CCOC1.C5(=O)C%10.N47.C79.N58.O6C
|
C[C@@H]1CCN(C(=O)c2nncn2C)C[C@H]1NC(=O)c1ccc2n[nH]cc2c1Cl
|
C[C@@H]CCNC=O)cnncn5C)))))))C[C@H]6NC=O)ccccn[nH]cc5c9Cl
|
[C][C@@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=N][N][=C][N][Ring1][Branch1][C][C][C@H1][Ring1][=C][N][C][=Branch1][C][=O][C][C][=C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Ring1][=Branch2][Cl]
|
c17ccc2n[nH]cc2c1Cl.C[C@@H]1CCN3C[C@H]15.c16nncn1C.C36=O.C47=O.N45
|
O=C(NC[C@@H]1CCCO1)C1CCC(CNCc2cc([N+](=O)[O-])c(F)cc2Cl)CC1
|
O=CNC[C@@H]CCCO5)))))))CCCCCNCccc[N+]=O)[O-]))cF)cc6Cl))))))))))CC6
|
[O][=C][Branch1][#Branch2][N][C][C@@H1][C][C][C][O][Ring1][Branch1][C][C][C][C][Branch2][Ring1][#Branch1][C][N][C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Branch1][C][F][C][=C][Ring1][#Branch2][Cl][C][C][Ring2][Ring1][Ring2]
|
c1%10cc([N+](=O)[O-])c(F)cc1Cl.C17CCC9CC1.[C@@H]18CCCO1.O=C37.N34.C48.C59.N56.C6%10
|
Cc1ccsc1CN(CC(C)C)C(=O)c1cnc2ccc(C(=O)O)cn12
|
Ccccsc5CNCCC)C)))C=O)ccnccccC=O)O))cn96
|
[C][C][C][=C][S][C][=Ring1][Branch1][C][N][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=C][N][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][N][Ring1][=Branch2]
|
c16cnc2ccc7cn12.Cc1ccsc18.C5C(C)C.N345.C36=O.C7(=O)O.C48
|
O=C(Cc1cc(Cl)ccc1O)N[C@@]1(CO)CCCN(C(=O)[C@H]2CCSC2)C1
|
O=CCcccCl)ccc6O))))))))N[C@@]CO))CCCNC=O)[C@H]CCSC5))))))C6
|
[O][=C][Branch1][=C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][N][C@@][Branch1][Ring1][C][O][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C@H1][C][C][S][C][Ring1][Branch1][C][Ring1][#C]
|
c18cc(Cl)ccc1O.[C@]157CCCN4C1.[C@H]16CCSC1.O=C3C8.C46=O.N35.C7O
|
CC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(C)C(F)F)[C@@H]1C(=O)N1CC2(COC(=O)N2C)C1
|
CC[C@@H]CCNC=O)[C@@H]C[C@]3C)CF)F))))))[C@@H]5C=O)NCCCOC=O)N5C)))))C4
|
[C][C][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C][C@][Ring1][Ring1][Branch1][C][C][C][Branch1][C][F][F][C@@H1][Ring1][=C][C][=Branch1][C][=O][N][C][C][Branch1][O][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][Ring1][#Branch2]
|
N14CC2(COC(=O)N2C)C1.[C@@H]17CCN3[C@@H]15.[C@@H]16C[C@@]18C.C36=O.C8(F)F.C45=O.CC7
|
CNC(=O)C1(C(=O)NC[C@@]2(C)CCN(C(=O)[C@H](OC)c3ccc(O)cc3)C2)CC1
|
CNC=O)CC=O)NC[C@@]C)CCNC=O)[C@H]OC))ccccO)cc6))))))))C5))))))))CC3
|
[C][N][C][=Branch1][C][=O][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][Ring1][O][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][Ring2][Ring1][C][C][C][Ring2][Ring1][=Branch2]
|
[C@]1%11(C)CCN6C1.c1%12ccc(O)cc1.C6(=O)[C@H]7%12.C19%10CC1.C49=O.C5%10=O.CN4.N58.C8%11.O7C
|
Cn1cnc2c1CCC[C@H]2C(=O)N[C@H]1CC[C@@H](NC(=O)[C@@]2(C)COC(=O)C2)CC1
|
Cncncc5CCC[C@H]6C=O)N[C@H]CC[C@@H]NC=O)[C@@]C)COC=O)C5)))))))CC6
|
[C][N][C][=N][C][=C][Ring1][Branch1][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][O][C][=Branch1][C][=O][C][Ring1][#Branch1][C][C][Ring1][S]
|
Cn1cnc2c1CCC[C@H]2C3=O.[C@H]15CC[C@@H]6CC1.[C@]17(C)COC(=O)C1.C47=O.N35.N46
|
CCC[C@]1(C)CCCN(C(=O)CCCn2cc(-c3c[nH]nc3C(C)C)nn2)C1
|
CCC[C@]C)CCCNC=O)CCCncc-cc[nH]nc5CC)C)))))))nn5)))))))))C6
|
[C][C][C][C@][Branch1][C][C][C][C][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C][C][C][N][C][=C][Branch1][=N][C][=C][NH1][N][=C][Ring1][Branch1][C][Branch1][C][C][C][N][=N][Ring1][=N][C][Ring2][Ring1][=Branch2]
|
[C@@]17(C)CCCN4C1.C4(=O)CCC5.n15cc8nn1.c18c[nH]nc16.CCC7.C6(C)C
|
CCC[C@H](NC(N)=O)C(=O)N1CCN(C(=O)c2ccc(F)cc2F)C[C@H]1C(F)F
|
CCC[C@H]NCN)=O)))C=O)NCCNC=O)ccccF)cc6F))))))))C[C@H]6CF)F
|
[C][C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][C][C@H1][Ring1][S][C][Branch1][C][F][F]
|
N14CCN5C[C@H]18.c17ccc(F)cc1F.CCC[C@H]6C4=O.C3(N)=O.C57=O.C8(F)F.N36
|
CC(C)(CF)C(=O)N1CC[C@@H]1CNC(=O)Cn1cnc(=N)[nH]1
|
CCC)CF))C=O)NCC[C@@H]4CNC=O)Cncnc=N)[nH]5
|
[C][C][Branch1][C][C][Branch1][Ring1][C][F][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][N][C][=N][C][=Branch1][C][=N][NH1][Ring1][=Branch1]
|
CC(C)(CF)C2=O.n15cnc(=N)[nH]1.N12CC[C@@H]16.C3(=O)C5.C46.N34
|
Cc1cc(N2CCC(C(=O)N3CCc4c(O)n[nH]c4C3)CC2)n2nc(C)cc2n1
|
CcccNCCCC=O)NCCccO)n[nH]c5C9))))))))))CC6))))))nncC)cc5n9
|
[C][C][C][=C][Branch2][Ring1][P][N][C][C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][O][=N][NH1][C][=Ring1][=Branch1][C][Ring1][#Branch2][C][C][Ring2][Ring1][C][N][N][=C][Branch1][C][C][C][=C][Ring1][=Branch1][N][=Ring2][Ring1][N]
|
Cc1cc6n2nc(C)cc2n1.N15CCc2c(O)n[nH]c2C1.N16CCC7CC1.C57=O
|
Cc1cccc(-c2nc(CC(=O)O[C@@H](C)c3cc(C)ccc3C)cs2)c1
|
Cccccc-cncCC=O)O[C@@H]C)cccC)ccc6C)))))))))))cs5)))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][C][C][=N][C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][C][=C][S][Ring2][Ring1][Ring1][=C][Ring2][Ring1][=Branch2]
|
c17cc(C)ccc1C.Cc1cccc8c1.c18nc6cs1.C6C4=O.[C@@H]57C.O45
|
Cc1ccc(C(=O)N2CCSC[C@H]2CCNC(=O)[C@H]2CCCC2(F)F)c(O)c1
|
CccccC=O)NCCSC[C@H]6CCNC=O)[C@H]CCCC5F)F)))))))))))))))))cO)c6
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][S][C][C@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][Ring1][Branch1][Branch1][C][F][F][C][Branch1][C][O][=C][Ring2][Ring1][O]
|
Cc1ccc7c(O)c1.N13CCSC[C@H]18.[C@H]16CCCC1(F)F.C37=O.C8C5.C46=O.N45
|
CSC=CC(=O)N[C@H](C)[C@H]1CCCN(C(=O)c2ccnc(P(C)(C)=O)c2)C1
|
CSC=CC=O)N[C@H]C)[C@H]CCCNC=O)cccncPC)C)=O))c6)))))))C6
|
[C][S][C][=C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@H1][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][=Branch2][P][Branch1][C][C][Branch1][C][C][=O][=C][Ring1][#Branch2][C][Ring2][Ring1][C]
|
c16ccnc(P(C)(C)=O)c1.[C@H]17CCCN4C1.CSC=CC3=O.[C@H]57C.C46=O.N35
|
Cc1ccc(C(=O)N2C[C@@H]3C[C@H](NC(=O)CCS(=O)(=O)CC(C)C)[C@H]2C3)cc1F
|
CccccC=O)NC[C@@H]C[C@H]NC=O)CCS=O)=O)CCC)C))))))))[C@H]6C5))))))))cc6F
|
[C][C][=C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Branch1][C][C][C][C@H1][Ring2][Ring1][C][C][Ring1][P][C][=C][Ring2][Ring1][O][F]
|
C5(=O)CCS(=O)(=O)CC(C)C.Cc1ccc7cc1F.N14C[C@H]2C[C@@H]1[C@@H]6C2.C47=O.N56
|
CCC1=C(C(=O)N[C@H]2CC[C@H](NC(=O)CN3C(=O)[C@@H](C)[C@@H](C)C3=O)C2)SCCO1
|
CCC=CC=O)N[C@H]CC[C@H]NC=O)CNC=O)[C@@H]C)[C@@H]C)C5=O)))))))))C5)))))))SCCO6
|
[C][C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C@@H1][Branch1][C][C][C][Ring1][Branch2][=O][C][Ring2][Ring1][C][S][C][C][O][Ring2][Ring1][O]
|
CCC1=C(C4=O)SCCO1.N18C(=O)[C@@H](C)[C@@H](C)C1=O.[C@H]16CC[C@H]7C1.C5(=O)C8.N46.N57
|
COCCN(CCNC(=O)c1cccn2nnnc12)C(=O)[C@@H]1CCOC(C)(C)C1
|
COCCNCCNC=O)ccccnnnnc95)))))))))))))C=O)[C@@H]CCOCC)C)C6
|
[C][O][C][C][N][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][N][=N][N][=C][Ring1][=Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2]
|
c1%10cccn2nnnc12.[C@@H]19CCOC(C)(C)C1.C5C6.N467.C7C8.C3%10=O.C49=O.CO5.N38
|
COC(=O)[C@]1(CF)CCN(c2nnc([C@@]3(O)CCSC3)n2CCC#N)C1
|
COC=O)[C@]CF))CCNcnnc[C@@]O)CCSC5)))))n5CCC#N)))))))))C5
|
[C][O][C][=Branch1][C][=O][C@][Branch1][Ring1][C][F][C][C][N][Branch2][Ring1][Branch2][C][=N][N][=C][Branch1][O][C@@][Branch1][C][O][C][C][S][C][Ring1][=Branch1][N][Ring1][O][C][C][C][#N][C][Ring2][Ring1][=Branch1]
|
[C@@]168CCN5C1.c15nnc9n17.[C@]19(O)CCSC1.C7CC#N.C46=O.CO4.C8F
|
COCCC1CN(C(=O)[C@@H]2C[C@H](O)CCN2C(=O)Cn2ccc(C)c2)C1
|
COCCCCNC=O)[C@@H]C[C@H]O)CCN6C=O)CncccC)c5))))))))))))))C4
|
[C][O][C][C][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][N][C][=C][C][Branch1][C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
[C@@H]16C[C@H](O)CCN14.n17ccc(C)c1.C18CN3C1.C4(=O)C7.C5C8.C36=O.CO5
|
CCC(CC)[C@@H](OC)C(=O)N1CCC[C@H](CCC(=O)NC(C)(C)C(C)(C)O)C1
|
CCCCC))[C@@H]OC))C=O)NCCC[C@H]CCC=O)NCC)C)CC)C)O)))))))C6
|
[C][C][C][Branch1][Ring1][C][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][#Branch1][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][Ring2][Ring1][C]
|
CCC(CC)[C@@H]4C2=O.N12CCC[C@H]6C1.C5(C)(C)C(C)(C)O.C6CC3=O.O4C.N35
|
CCc1ccsc1C(=O)N(C)C[C@@H](CC)NC(=O)[C@H]1C[C@@H]2C[C@H]1CC2(F)F
|
CCcccsc5C=O)NC)C[C@@H]CC))NC=O)[C@H]C[C@@H]C[C@H]5CC5F)F
|
[C][C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][C][C@H1][Ring1][Branch1][C][C][Ring1][Branch1][Branch1][C][F][F]
|
[C@H]18C[C@@H]2C[C@H]1CC2(F)F.c19ccsc17.C5[C@H]6CC.C37=O.N35C.C48=O.CC9.N46
|
CCC[C@@H](OC)C(=O)NCCN(CC)C(=O)CCc1nc(CC)no1
|
CCC[C@@H]OC))C=O)NCCNCC))C=O)CCcncCC))no5
|
[C][C][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][C][C][=N][C][Branch1][Ring1][C][C][=N][O][Ring1][#Branch1]
|
CCC[C@@H]4C2=O.c18nc9no1.C3(=O)CC8.C5C6.N367.O4C.N25.C7C.C9C
|
CO[C@H](C)c1nc(C)c(C(=O)N2C[C@H](C)[C@H](NC(=O)C=CC=C(Cl)Cl)C2)s1
|
CO[C@H]C)cncC)cC=O)NC[C@H]C)[C@H]NC=O)C=CC=CCl)Cl)))))))C5))))))s5
|
[C][O][C@H1][Branch1][C][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][Cl][C][Ring1][#C][S][Ring2][Ring1][#Branch1]
|
c19nc(C)c7s1.N13C[C@@H]6[C@@H](C)C1.C=8C=C(Cl)Cl.C4(=O)C=8.[C@H]59C.C37=O.CO5.N46
|
O=C([C@@H]1CC(C2CCOCC2)=NO1)N1CCCC[C@H]1c1nc2ccccc2o1
|
O=C[C@@H]CCCCCOCC6))))))=NO5)))))NCCCC[C@H]6cncccccc6o9
|
[O][=C][Branch2][Ring1][C][C@@H1][C][C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][=N][O][Ring1][O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2]
|
[C@@H]14CC(C2CCOCC2)=NO1.c15nc2ccccc2o1.N13CCCC[C@H]15.O=C34
|
CC/C=C/CC(=O)NC[C@H]1CN(C(=O)c2ccccc2NC)CC(C)(C)C1
|
CC/C=C/CC=O)NC[C@H]CNC=O)cccccc6NC)))))))))CCC)C)C6
|
[C][C][/C][=C][/C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][C]
|
[C@H]19CN4CC(C)(C)C1.c17ccccc16.C=8CC3=O.CCC=8.C47=O.N35.C59.N6C
|
Cn1c(I)cc2c(N[C@@H]3CCC[C@H](C(=O)N4CCO[C@H](C#N)C4)C3)ncnc21
|
CncI)cccN[C@@H]CCC[C@H]C=O)NCCO[C@H]C#N))C6)))))))C6)))))))ncnc69
|
[C][N][C][Branch1][C][I][=C][C][=C][Branch2][Ring1][N][N][C@@H1][C][C][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch1][Ring1][C][#N][C][Ring1][Branch2][C][Ring1][S][N][=C][N][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][O]
|
Cn1c(I)cc2c6ncnc21.N15CCO[C@H](C#N)C1.[C@@H]17CCC[C@H]8C1.C58=O.N67
|
C=CCCCN(CC)C(=O)C1(CNC(=O)[C@H]2CCCC[C@H]2OC)CC(C)(C)C1
|
C=CCCCNCC))C=O)CCNC=O)[C@H]CCCC[C@H]6OC)))))))))))CCC)C)C4
|
[C][=C][C][C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][O][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][C]
|
C19%11CC(C)(C)C1.[C@H]1%10CCCC[C@H]15.C=CCCC6.N367.C39=O.C4%10=O.C7C.C8%11.N48.O5C
|
CC[C@@H](CC(=O)N1CCN(C(=O)C2=CCC2)C[C@H]1CS(C)(=O)=O)C1CC1
|
CC[C@@H]CC=O)NCCNC=O)C=CCC4)))))C[C@H]6CSC)=O)=O)))))))))))CCC3
|
[C][C][C@@H1][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C][N][Branch1][O][C][=Branch1][C][=O][C][=C][C][C][Ring1][Ring2][C][C@H1][Ring1][N][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][C][Ring1][Ring1]
|
N13CCN4C[C@H]15.CC[C@H]6CC3=O.C4(=O)C1=CCC1.C5S(C)(=O)=O.C16CC1
|
CN=c1[nH]c(C(=O)N2CC[C@@H](N(C)C(=O)c3cc4nccnc4cc3F)C2)cs1
|
CN=c[nH]cC=O)NCC[C@@H]NC)C=O)cccnccnc6cc%10F)))))))))))))C5))))))cs5
|
[C][N][=C][NH1][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=N][C][=C][N][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][F][C][Ring2][Ring1][Ring2][=C][S][Ring2][Ring1][O]
|
c19cc2nccnc2cc1F.CN=c1[nH]c8cs1.N15CC[C@@H]7C1.C58=O.N67C.C69=O
|
COCc1nc(=NC[C@H]2CN(C(=O)c3cccc4nc(O)ccc34)CCO2)s[nH]1
|
COCcnc=NC[C@H]CNC=O)cccccncO)ccc%106)))))))))))CCO6))))))))s[nH]5
|
[C][O][C][C][=N][C][=Branch2][Ring2][Ring2][=N][C][C@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=N][C][Branch1][C][O][=C][C][=C][Ring1][O][Ring1][#Branch1][C][C][O][Ring2][Ring1][Ring1][S][NH1][Ring2][Ring1][#Branch2]
|
c17cccc2nc(O)ccc12.c19nc(=NC8)s[nH]1.[C@H]18CN5CCO1.C57=O.CO6.C69
|
C=CC[C@@]1(NC(=O)c2cccn2C(C)C)CCN(C(=O)[C@H](CC)CCOC)C1
|
C=CC[C@@]NC=O)ccccn5CC)C)))))))))CCNC=O)[C@H]CC))CCOC))))))C5
|
[C][=C][C][C@@][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][Branch1][C][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][C][C][C][O][C][C][Ring2][Ring1][=Branch2]
|
C4(=O)[C@H](CC)CC5.[C@@]169CCN4C1.c17cccn18.C=CC9.C37=O.C8(C)C.N36.O5C
|
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