SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(C)[C@@]1(C)CN(C(=O)c2ccc(CNC(=O)C[C@H]3CCSC3)cc2)CCO1
|
CCC)[C@@]C)CNC=O)ccccCNC=O)C[C@H]CCSC5)))))))))cc6)))))))CCO6
|
[C][C][Branch1][C][C][C@@][Branch1][C][C][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#C][C][N][C][=Branch1][C][=O][C][C@H1][C][C][S][C][Ring1][Branch1][C][=C][Ring1][S][C][C][O][Ring2][Ring1][=Branch2]
|
[C@]18(C)CN4CCO1.c17ccc%10cc1.[C@H]19CCSC1.C5(=O)C9.CC8C.C47=O.C6%10.N56
|
CO[C@@H](CSC)C(=O)N1CCN(C(=O)c2cnsn2)C[C@H](O)C1
|
CO[C@@H]CSC)))C=O)NCCNC=O)ccnsn5))))))C[C@H]O)C7
|
[C][O][C@@H1][Branch1][Ring2][C][S][C][C][=Branch1][C][=O][N][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=N][S][N][=Ring1][Branch1][C][C@H1][Branch1][C][O][C][Ring1][#C]
|
N13CCN4C[C@H](O)C1.[C@H]5(C6)C3=O.c17cnsn1.C47=O.CO5.S6C
|
CCc1nn(C)c(Cl)c1C(=O)NC[C@@H]1CN(C(=O)CSCCOC)CC1(C)C
|
CCcnnC)cCl)c5C=O)NC[C@@H]CNC=O)CSCCOC)))))))CC5C)C
|
[C][C][C][=N][N][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][O][C][=Branch1][C][=O][C][S][C][C][O][C][C][C][Ring1][=N][Branch1][C][C][C]
|
c19nn(C)c(Cl)c18.[C@@H]1%10CN3CC1(C)C.C3(=O)C6.C28=O.C7C4.CC9.N25.C5%10.S67.O4C
|
Cc1coc(-c2ccc(C)c(S(=O)(=O)NCc3cc(C4CC4)no3)c2)n1
|
Cccoc-ccccC)cS=O)=O)NCcccCCC3)))no5))))))))c6))))))n5
|
[C][C][=C][O][C][Branch2][Ring2][#Branch1][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2][=C][Ring2][Ring1][Ring2][=N][Ring2][Ring1][=Branch2]
|
c19ccc(C)c(S6(=O)=O)c1.Cc1coc9n1.c17cc8no1.C18CC1.N56.C57
|
COC[C@H](Cl)C(=O)N1Cc2ccc(O)cc2C[C@@H]1C(=O)N[C@H](C)CN(C)C
|
COC[C@H]Cl)C=O)NCccccO)cc6C[C@@H]%10C=O)N[C@H]C)CNC)C
|
[C][O][C][C@H1][Branch1][C][Cl][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][C@@H1][Ring1][O][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][Branch1][C][C][C]
|
N13Cc2ccc(O)cc2C[C@@H]18.C5[C@H](Cl)C3=O.[C@@H]6(C)C7.C48=O.N7(C)C.CO5.N46
|
Cc1cc(NC(=O)[C@H]2CN(Cc3cc(Br)ccn3)CCO2)c(F)cc1Cl
|
CcccNC=O)[C@H]CNCcccBr)ccn6)))))))CCO6))))))))cF)cc6Cl
|
[C][C][=C][C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C@H1][C][N][Branch1][=N][C][C][=C][C][Branch1][C][Br][=C][C][=N][Ring1][#Branch1][C][C][O][Ring1][=C][=C][Branch1][C][F][C][=C][Ring2][Ring1][Branch2][Cl]
|
Cc1cc6c(F)cc1Cl.[C@H]17CN5CCO1.c18cc(Br)ccn1.C47=O.N46.C58
|
CC[C@@H](CNC(=O)[C@@H]1C[C@H]1C(C)C)NC(=O)CCCNC(C)=O
|
CC[C@@H]CNC=O)[C@@H]C[C@H]3CC)C))))))))NC=O)CCCNCC)=O
|
[C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][N][C][Branch1][C][C][=O]
|
C3(=O)CCC7.CC[C@H]5C6.[C@@H]18C[C@H]19.C28=O.C9(C)C.C4(C)=O.N26.N35.N47
|
Cc1cn(C(C)(C)C(=O)NC[C@H]2CCCN2C(=O)[C@H]2CCCc3nncn32)cn1
|
CccnCC)C)C=O)NC[C@H]CCCN5C=O)[C@H]CCCcnncn59)))))))))))))))))))cn5
|
[C][C][=C][N][Branch2][Ring2][=Branch1][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][C][C][=N][N][=C][N][Ring1][Branch1][Ring1][=Branch2][C][=N][Ring2][Ring1][N]
|
C5(=O)[C@H]1CCCc2nncn21.Cc1cn7cn1.C7(C)(C)C4=O.[C@H]18CCCN15.N46.C68
|
CC/C=C/C[C@H](C)C(=O)N[C@@H]1CC[C@]2(CCN(C(=O)CCc3ccc(C)s3)C2)C1
|
CC/C=C/C[C@H]C)C=O)N[C@@H]CC[C@]CCNC=O)CCccccC)s5))))))))C5))))C5
|
[C][C][/C][=C][/C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@][Branch2][Ring1][=Branch2][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][C][S][Ring1][=Branch1][C][Ring1][#C][C][Ring2][Ring1][Ring1]
|
[C@@H]16CC[C@]2(CCN5C2)C1.C=7C[C@H](C)C4=O.c18ccc(C)s1.C5(=O)CC8.CCC=7.N46
|
Cc1snnc1C(=O)N[C@H]1C[C@H](NC(=O)CNC(=O)NCC2CCCC2)C1
|
Ccsnnc5C=O)N[C@H]C[C@H]NC=O)CNC=O)NCCCCCC5))))))))))))C4
|
[C][C][S][N][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][C]
|
Cc1snnc1%12.[C@H]1%10C[C@H]%11C1.C14CCCC1.C5(=O)C8.C3%12=O.C67=O.N3%10.N5%11.N68.N79.C94
|
CC(C)[C@H](O)[C@@H](C)C(=O)N1CC[C@@](C)(CC(=O)N[C@H]2C[C@@H]2c2ccnn2C)C1
|
CCC)[C@H]O)[C@@H]C)C=O)NCC[C@@]C)CC=O)N[C@H]C[C@@H]3cccnn5C))))))))))))C5
|
[C][C][Branch1][C][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Ring1][Ring1][C][=C][C][=N][N][Ring1][Branch1][C][C][Ring2][Ring1][Ring1]
|
CC(C)[C@H](O)[C@@H](C)C3=O.N13CC[C@]6(C)C1.c17ccnn1C.C6C4=O.[C@H]15C[C@@H]17.N45
|
CCc1ccc(C(=O)NCC23CC(NC(=O)C[C@H]4C=CS(=O)(=O)C4)(C2)[C@H](C)O3)o1
|
CCccccC=O)NCCCCNC=O)C[C@H]C=CS=O)=O)C5))))))))C4)[C@H]C)O5))))))))o5
|
[C][C][C][=C][C][=C][Branch2][Ring2][=N][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C@H1][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1][Branch1][Ring2][C][Ring1][#C][C@H1][Branch1][C][C][O][Ring2][Ring1][C][O][Ring2][Ring1][O]
|
C12%10CC8(C1)[C@H](C)O2.[C@H]1%12C=CS(=O)(=O)C1.c1%11ccc9o1.C6(=O)C%12.C59=O.CC%11.N57.C7%10.N68
|
CC(C)n1cc(C(=O)N[C@H]2CC=CC[C@H]2C(=O)N(C)C2CC(CO)C2)cn1
|
CCC)nccC=O)N[C@H]CC=CC[C@H]6C=O)NC)CCCCO))C4))))))))))))))cn5
|
[C][C][Branch1][C][C][N][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][C][C][=C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Branch1][Ring1][C][O][C][Ring1][=Branch1][C][=N][Ring2][Ring1][Branch2]
|
[C@H]15CC=CC[C@H]17.n19cc8cn1.C16CC%10C1.CC9C.C38=O.C47=O.N46C.N35.C%10O
|
Cc1coc(C)c1C(=O)N[C@]1(C)CCN(C(=O)c2cc(C(C)C)n(C)c2C)C1
|
CccocC)c5C=O)N[C@]C)CCNC=O)cccCC)C))nC)c5C)))))))C5
|
[C][C][=C][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][N][Branch1][C][C][C][=Ring1][=Branch2][C][C][Ring2][Ring1][C]
|
c17cc8n(C)c1C.Cc1coc(C)c16.[C@@]15(C)CCN4C1.C36=O.C47=O.C8(C)C.N35
|
COc1cccc(CCC(=O)N(C)CC[C@@H](C)NC(=O)CSCC(C)C)c1F
|
COcccccCCC=O)NC)CC[C@@H]C)NC=O)CSCCC)C))))))))))))))c6F
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][=C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][S][C][C][Branch1][C][C][C][=C][Ring2][Ring1][=Branch2][F]
|
c14cccc9c1F.C9CC2=O.C5C[C@H]6C.C3(=O)C7.C8C(C)C.N25C.CO4.N36.S78
|
O=C(NCCCCNC(=O)[C@@H]1C[C@H]1C1CCC1)c1cc2scc(Br)c2[nH]1
|
O=CNCCCCNC=O)[C@@H]C[C@H]3CCCC4))))))))))))))cccsccBr)c5[nH]8
|
[O][=C][Branch2][Ring1][=Branch1][N][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][C][C][C][Ring1][Ring2][C][=C][C][S][C][=C][Branch1][C][Br][C][=Ring1][=Branch1][NH1][Ring1][=Branch2]
|
c17cc2scc(Br)c2[nH]1.[C@@H]18C[C@H]1C1CCC1.C5CCC6.O=C37.C48=O.N35.N46
|
C[C@@H]1OCC[C@H]1C(=O)N(CCC(=O)N(C)C1CC2(CC2)C1)CC1CC1
|
C[C@@H]OCC[C@H]5C=O)NCCC=O)NC)CCCCC3))C4))))))))CCCC3
|
[C][C@@H1][O][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=Branch1][C][C][C][C][Ring1][Ring1]
|
C[C@@H]1OCC[C@H]18.C17CC2(CC2)C1.C5CC4=O.C38=O.N356.N47C.C19CC1.C69
|
Cn1nc(C(=O)N[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3CF)C23CC3)cc1-c1cccnc1
|
CnncC=O)N[C@@H]CCNC=O)[C@@H]C[C@H]3CF))))))C5CC3)))))))))cc5-ccccnc6
|
[C][N][N][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][F][C][Ring1][N][C][C][Ring1][Ring1][C][=C][Ring2][Ring1][=Branch1][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
[C@@H]16CCN5C12CC2.Cn1nc7cc1%10.c1%10cccnc1.[C@@H]18C[C@H]19.C47=O.C58=O.N46.C9F
|
CC(C)c1cc(C(=O)NC[C@@H]2CN(C(=O)c3cccc(Cl)c3Br)CCO2)n[nH]1
|
CCC)cccC=O)NC[C@@H]CNC=O)cccccCl)c6Br))))))))CCO6)))))))))n[nH]5
|
[C][C][Branch1][C][C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Br][C][C][O][Ring1][S][=N][NH1][Ring2][Ring1][=Branch2]
|
c18cccc(Cl)c1Br.[C@@H]19CN5CCO1.c1%10cc7n[nH]1.CC%10C.C47=O.C58=O.N46.C69
|
CNC(=O)N1CC(C(=O)N2CC3(CC3)C[C@H]2CNC(=O)Cc2cccnc2C)C1
|
CNC=O)NCCC=O)NCCCC3))C[C@H]5CNC=O)Cccccnc6C)))))))))))))))))C4
|
[C][N][C][=Branch1][C][=O][N][C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2]
|
N16CC2(CC2)C[C@H]1%10.c1%11cccnc1C.N15CC9C1.C7(=O)C%11.C45=O.C69=O.CN4.C8%10.N78
|
COc1cc(CC(=O)N[C@H]2CCN(Cc3cc(Cl)c(F)c(Cl)c3)C2)cc(OC)c1
|
COcccCC=O)N[C@H]CCNCcccCl)cF)cCl)c6)))))))C5))))))))ccOC))c6
|
[C][O][C][=C][C][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][Ring1][C][C][=C][C][Branch1][C][Cl][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][Ring1][#C][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][O]
|
c1%10cc(Cl)c(F)c(Cl)c1.c15cc6cc9c1.[C@H]18CCN7C1.C9C4=O.CO5.N48.C7%10.O6C
|
Cc1cn2c(CC(=O)N3CC[C@H](NC(=O)C[C@@H](O)C4CCCC4)[C@H]3C)csc2n1
|
CccncCC=O)NCC[C@H]NC=O)C[C@@H]O)CCCCC5)))))))))[C@H]5C))))))))csc5n8
|
[C][C][=C][N][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][C][C][C][C][Ring1][Branch1][C@H1][Ring1][S][C][=C][S][C][Ring2][Ring1][=Branch2][=N][Ring2][Ring1][N]
|
Cc1cn2c8csc2n1.N15CC[C@H]7[C@H]1C.C6(=O)C[C@H]9O.C19CCCC1.C8C5=O.N67
|
C[C@H](C(=O)N1CCC[C@@](C)(NC(=O)c2cc3ccccc3s2)C1)n1cccn1
|
C[C@H]C=O)NCCC[C@@]C)NC=O)cccccccc6s9)))))))))))C6)))))))ncccn5
|
[C][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2][C][Ring2][Ring1][Ring1][N][C][=C][C][=N][Ring1][Branch1]
|
c17cc2ccccc2s1.N14CCC[C@]6(C)C1.C[C@@H]8C4=O.n18cccn1.C57=O.N56
|
N#C[C@]1(C(=O)N2Cc3[nH]nc(C(=O)NCC4SCCS4)c3C2)CCOC1
|
N#C[C@]C=O)NCc[nH]ncC=O)NCCSCCS5))))))))c5C8)))))))))CCOC5
|
[N][#C][C@][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][NH1][N][=C][Branch1][=C][C][=Branch1][C][=O][N][C][C][S][C][C][S][Ring1][Branch1][C][=Ring1][=C][C][Ring1][P][C][C][O][C][Ring2][Ring1][Branch2]
|
N15Cc2[nH]nc8c2C1.N#C[C@]19CCOC1.C1%10SCCS1.C59=O.C68=O.N67.C7%10
|
C=C=C(C)CC(=O)NC[C@@H](CC1CCCC1)C(=O)N1CC[C@H]1C(C)(C)O
|
C=C=CC)CC=O)NC[C@@H]CCCCCC5))))))C=O)NCC[C@H]4CC)C)O
|
[C][=C][=C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Ring1][Ring2][C][Branch1][C][C][Branch1][C][C][O]
|
C=C=C(C)CC2=O.C4[C@@H](C6)C3=O.C16CCCC1.N13CC[C@H]15.C5(C)(C)O.N24
|
CC(C)(C(=O)NCCN(C(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)C1CC1)[C@@H]1CCOC1
|
CCC)C=O)NCCNC=O)[C@@H]CCCNSC)=O)=O))C6)))))))CCC3))))))))[C@@H]CCOC5
|
[C][C][Branch1][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][#Branch2][C][C][C][Ring1][Ring1][C@@H1][C][C][O][C][Ring1][Branch1]
|
[C@@H]18CCCN6C1.CC9(C)C2=O.[C@@H]19CCOC1.S6(C)(=O)=O.C4C5.N357.C38=O.C17CC1.N24
|
O=C(NC[C@@H]1CCC[C@@H](NC(=O)C23CC(F)(C2)C3)C1)c1cncc(C(F)(F)F)n1
|
O=CNC[C@@H]CCC[C@@H]NC=O)CCCF)C4)C4))))))C6))))))))ccnccCF)F)F))n6
|
[O][=C][Branch2][Ring1][P][N][C][C@@H1][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][#C][C][=C][N][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2]
|
[C@@H]1%11CCC[C@@H]7C1.c18cncc%10n1.C129CC(F)(C1)C2.C%10(F)(F)F.O=C48.C59=O.N46.C6%11.N57
|
CCOC[C@@H](N=[N+]=[N-])C(=O)N1CC[C@@H](C(=O)NCc2csnn2)C12CCC2
|
CCOC[C@@H]N=[N+]=[N-])))C=O)NCC[C@@H]C=O)NCccsnn5))))))))C5CCC4
|
[C][C][O][C][C@@H1][Branch1][Ring2][N][=N+1][=N-1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=C][C][=Branch1][C][=O][N][C][C][=C][S][N][=N][Ring1][Branch1][C][Ring1][=C][C][C][C][Ring1][Ring2]
|
N13CC[C@@H]8C12CCC2.C6[C@@H](N=[N+]=[N-])C3=O.c19csnn1.C48=O.CC5.O56.N47.C79
|
CC(C)C(C)(C)C(=O)N[C@H]1CCCCN(C(=O)[C@@H]2COc3ccccc3O2)C1
|
CCC)CC)C)C=O)N[C@H]CCCCNC=O)[C@@H]COcccccc6O%10)))))))))))C7
|
[C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#Branch2][C][Ring2][Ring1][Ring1]
|
[C@@H]17COc2ccccc2O1.CC(C)C(C)(C)C4=O.[C@H]16CCCCN5C1.C57=O.N46
|
CC(=O)N1CCC(C(=O)N2CC(CCO)(NC(=O)[C@H]3C[C@@H]3c3cccs3)C2)CC1
|
CC=O)NCCCC=O)NCCCCO)))NC=O)[C@H]C[C@@H]3ccccs5))))))))))C4)))))CC6
|
[C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][C][O][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][=C][C][=C][S][Ring1][Branch1][C][Ring2][Ring1][C][C][C][Ring2][Ring1][#Branch2]
|
N14CCC8CC1.N15CC7%10C1.c1%11cccs1.[C@H]19C[C@@H]1%11.CC4=O.C58=O.C%10CO.C69=O.N67
|
CON1C[C@H](C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C(=O)N[C@@H](C)CO)CC1=O
|
CONC[C@H]C=O)NC[C@@H][C@H]C5)[C@H]3C=O)N[C@@H]C)CO)))))))))))CC5=O
|
[C][O][N][C][C@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][O][C][C][Ring2][Ring1][Ring2][=O]
|
CON1C[C@H]7CC1=O.N14C[C@@H]2[C@@H]8[C@@H]2C1.[C@H]6(C)CO.C47=O.C58=O.N56
|
CC[C@H](OC1CCCCC1)C(=O)NCc1ccc([C@@H](C)NC(=O)C2CC2)cc1
|
CC[C@H]OCCCCCC6)))))))C=O)NCcccc[C@@H]C)NC=O)CCC3))))))cc6
|
[C][C][C@H1][Branch1][#Branch2][O][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][#C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][=C][Ring1][=C]
|
c1%10ccc%11cc1.CC[C@H]5C3=O.C16CCCCC1.[C@H]8%11C.C49=O.C19CC1.O56.N37.C7%10.N48
|
COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ncccc1NC(=O)CC#N
|
COC=O)[C@H]Ccccccc6)))))))NC=O)cncccc6NC=O)CC#N
|
[C][O][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][#N]
|
c17ncccc16.C2(=O)[C@@H]5C8.c18ccccc1.C4(=O)CC#N.C37=O.CO2.N35.N46
|
O=C(c1cc2cccnn2n1)N1CCN(C(=O)c2nc(Cl)sc2Cl)CC1
|
O=Cccccccnn6n9)))))))))NCCNC=O)cncCl)sc5Cl)))))))CC6
|
[O][=C][Branch1][=C][C][C][=C][C][=C][C][=N][N][Ring1][=Branch1][N][=Ring1][=Branch2][N][C][C][N][Branch1][S][C][=Branch1][C][=O][C][N][=C][Branch1][C][Cl][S][C][=Ring1][=Branch1][Cl][C][C][Ring1][#C]
|
c15cc2cccnn2n1.N13CCN4CC1.c16nc(Cl)sc1Cl.O=C35.C46=O
|
FC(F)Oc1ccc(-c2nc(CSc3ccccc3)nn2C2CC2)nc1
|
FCF)Occcc-cncCScccccc6))))))))nn5CCC3))))))))nc6
|
[F][C][Branch1][C][F][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=N][C][Branch1][O][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][Ring1][=N][C][C][C][Ring1][Ring1][N][=C][Ring2][Ring1][=Branch1]
|
c14ccc9nc1.c19nc6nn17.c18ccccc1.FC(F)O4.C17CC1.C56.S58
|
CCN(CC(=O)N[C@@H]1CCC[C@@H]1C#N)C(=O)C[C@H]1CC2(CC2)CO1
|
CCNCC=O)N[C@@H]CCC[C@@H]5C#N))))))))))C=O)C[C@H]CCCC3))CO5
|
[C][C][N][Branch1][S][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][#N][C][=Branch1][C][=O][C][C@H1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][O][Ring1][#Branch1]
|
[C@@H]17CCC[C@@H]1C#N.[C@H]18CC2(CC2)CO1.C6C3=O.C4(=O)C8.N456.CC5.N37
|
O=C(c1cc(O)cc(O)n1)N1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1C=CS(=O)(=O)C1
|
O=CcccO)ccO)n6))))))NC[C@H]CC[C@@H]C7)N5C=O)C[C@H]C=CS=O)=O)C5
|
[O][=C][Branch1][#C][C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=N][Ring1][Branch2][N][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C@H1][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1]
|
N13C[C@H]2CC[C@@H](C1)N24.c15cc(O)cc(O)n1.[C@H]16C=CS(=O)(=O)C1.C4(=O)C6.O=C35
|
Cc1nnc2n1C[C@H](C(=O)N(C)[C@H](C)CCNC(=O)Cc1cnco1)C2
|
Ccnncn5C[C@H]C=O)NC)[C@H]C)CCNC=O)Cccnco5)))))))))))))C5
|
[C][C][=N][N][=C][N][Ring1][Branch1][C][C@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][=C][N][=C][O][Ring1][Branch1][C][Ring2][Ring1][=Branch1]
|
Cc1nnc2n1C[C@H]7C2.[C@@H]5(C)CC6.c18cnco1.C4(=O)C8.C37=O.N35C.N46
|
Cc1cnc(CN2CCC[C@@H]([C@H](C)NC(=O)CC3CCCCC3)C2)s1
|
CccncCNCCC[C@@H][C@H]C)NC=O)CCCCCCC6))))))))))C6)))))))s5
|
[C][C][=C][N][=C][Branch2][Ring1][S][C][N][C][C][C][C@@H1][Branch2][Ring1][Ring1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][C][S][Ring2][Ring1][Branch2]
|
N15CCC[C@@H]8C1.Cc1cnc7s1.C19CCCCC1.C4(=O)C9.[C@@H]68C.C57.N46
|
Cc1cc(C(=O)N[C@H](C)C2(O)CN(C(=O)C=Cc3cc[nH]n3)C2)ncc1C(F)F
|
CcccC=O)N[C@H]C)CO)CNC=O)C=Cccc[nH]n5))))))))C4)))))))ncc6CF)F
|
[C][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][Branch1][C][O][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][=C][NH1][N][=Ring1][Branch1][C][Ring1][=C][=N][C][=C][Ring2][Ring1][=Branch2][C][Branch1][C][F][F]
|
Cc1cc7ncc1%10.C19(O)CN5C1.C=8c1cc[nH]n1.C5(=O)C=8.C47=O.[C@H]69C.C%10(F)F.N46
|
Nc1cccc(Cl)c1C(=O)N1C[C@@H](NC(=O)C23CCC(CC2)C3)CC2(CC2)C1
|
NcccccCl)c6C=O)NC[C@@H]NC=O)CCCCCC6))C5)))))))CCCC3))C6
|
[N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][C]
|
N14C[C@@H]6CC2(CC2)C1.Nc1cccc(Cl)c18.C127CCC(CC1)C2.C48=O.C57=O.N56
|
CC(C)C[C@H]1CCCC[C@H]1NC(=O)c1cccc(S(=O)(=O)NCC(F)(F)F)c1
|
CCC)C[C@H]CCCC[C@H]6NC=O)cccccS=O)=O)NCCF)F)F)))))c6
|
[C][C][Branch1][C][C][C][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#C]
|
c16cccc(S4(=O)=O)c1.[C@H]17CCCC[C@H]15.C3C(F)(F)F.CC(C)C7.C26=O.N25.N34
|
C[C@H]1CN(C(=O)c2ccc3sccc3c2)CCN1C(=O)CCc1cccnc1F
|
C[C@H]CNC=O)ccccsccc5c9))))))))))CCN6C=O)CCccccnc6F
|
[C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][S][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C][N][Ring1][P][C][=Branch1][C][=O][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][F]
|
c16ccc2sccc2c1.C[C@H]1CN4CCN15.c17cccnc1F.C5(=O)CC7.C46=O
|
CC(C)=C(C)C(=O)N1CC[C@H](NC(=O)c2cc(Cl)nnc2Cl)[C@@H](F)C1
|
CCC)=CC)C=O)NCC[C@H]NC=O)cccCl)nnc6Cl)))))))))[C@@H]F)C6
|
[C][C][Branch1][C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][N][=C][Ring1][#Branch1][Cl][C@@H1][Branch1][C][F][C][Ring2][Ring1][C]
|
N13CC[C@H]5[C@@H](F)C1.c16cc(Cl)nnc1Cl.C=7(C)C3=O.CC=7C.C46=O.N45
|
Cc1ncc(C(=O)NC[C@@H](C)CNC(=O)C(N)=O)c(O)c1Cl
|
CcnccC=O)NC[C@@H]C)CNC=O)CN)=O)))))))))cO)c6Cl
|
[C][C][=N][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][N][=O][C][Branch1][C][O][=C][Ring2][Ring1][Ring2][Cl]
|
Cc1ncc6c(O)c1Cl.C4[C@@H](C)C5.C3(=O)C(N)=O.C26=O.N24.N35
|
CC[C@H](C)CC(=O)N1CCC[C@@]2(CCN(C(=O)c3ncoc3C(F)(F)F)C2)C1
|
CC[C@H]C)CC=O)NCCC[C@@]CCNC=O)cncoc5CF)F)F))))))))C5))))C6
|
[C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch2][Ring1][=N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][N][=C][O][C][=Ring1][Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][S][C][Ring2][Ring1][Branch1]
|
N14CCC[C@@]2(CCN5C2)C1.CC[C@H](C)CC4=O.c16ncoc17.C7(F)(F)F.C56=O
|
C[C@H](C(=O)NC12CC(C(=O)N[C@@H](C3CC3)[C@@H](O)CO)(C1)C2)[C@@H]1CCOC1
|
C[C@H]C=O)NCCCC=O)N[C@@H]CCC3)))[C@@H]O)CO))))))C4)C4))))))[C@@H]CCOC5
|
[C][C@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@@H1][Branch1][C][O][C][O][Branch1][Ring2][C][Ring1][#C][C][Ring1][S][C@@H1][C][C][O][C][Ring1][Branch1]
|
C127CC8(C1)C2.[C@H]6%10[C@@H](O)CO.C[C@@H]9C4=O.[C@@H]19CCOC1.C58=O.C1%10CC1.N47.N56
|
CCC[C@H](C#N)C(=O)Nc1nnc(-c2ccccc2Cl)s1
|
CCC[C@H]C#N))C=O)Ncnnc-cccccc6Cl)))))))s5
|
[C][C][C][C@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C][=N][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][S][Ring1][N]
|
CCC[C@H](C#N)C3=O.c15ccccc1Cl.c14nnc5s1.N34
|
COc1ncc(-c2cn(C[C@@H]3CN(C(=O)[C@H](C)n4cncn4)CCO3)nn2)cn1
|
COcncc-ccnC[C@@H]CNC=O)[C@H]C)ncncn5)))))))CCO6)))))))nn5)))))cn6
|
[C][O][C][=N][C][=C][Branch2][Ring2][=Branch1][C][=C][N][Branch2][Ring1][O][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=N][C][=N][Ring1][Branch1][C][C][O][Ring1][#C][N][=N][Ring2][Ring1][Branch1][C][=N][Ring2][Ring1][O]
|
c16ncc%10cn1.[C@@H]19CN5CCO1.c1%10cn7nn1.C5(=O)[C@@H]8C.n18cncn1.CO6.C79
|
CC1(C)CC2(C[C@@H]2C(=O)N2CC[C@H]3CN(C(=O)c4ccon4)[C@H]3C2)C1
|
CCC)CCC[C@@H]3C=O)NCC[C@H]CNC=O)cccon5))))))[C@H]4C8)))))))))))C4
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][C][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][O][N][=Ring1][Branch1][C@H1][Ring1][O][C][Ring1][#C][C][Ring2][Ring1][Branch2]
|
N15CC[C@H]2CN6[C@H]2C1.CC1(C)CC2(C[C@@H]28)C1.c17ccon1.C58=O.C67=O
|
O=S(=O)(Cc1cccnc1)N([C@@H]1CCOc2ccccc21)[C@H]1CCNCC12CC2
|
O=S=O)Cccccnc6)))))))N[C@@H]CCOcccccc6%10))))))))))[C@H]CCNCC6CC3
|
[O][=S][=Branch1][C][=O][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][N][Branch1][#C][C@@H1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C@H1][C][C][N][C][C][Ring1][=Branch1][C][C][Ring1][Ring1]
|
N34[C@@H]1CCOc2ccccc21.[C@H]14CCNCC12CC2.c15cccnc1.O=S3(=O)C5
|
CCc1noc(C(=O)NC[C@H]2CC[C@H](NC(=O)[C@H]3[C@@H]4C[C@@H]4[C@H]4C[C@@H]43)CC2)c1C
|
CCcnocC=O)NC[C@H]CC[C@H]NC=O)[C@H][C@@H]C[C@@H]3[C@H]C[C@@H]37)))))))))CC6)))))))))c5C
|
[C][C][C][=N][O][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C@@H1][C][C@@H1][Ring1][Ring1][C@H1][C][C@@H1][Ring1][Ring1][Ring1][#Branch1][C][C][Ring1][S][=C][Ring2][Ring1][=Branch2][C]
|
c1%11noc9c1C.[C@H]1%12CC[C@H]8CC1.[C@@H]1%10[C@H]2C[C@@H]2[C@H]2C[C@@H]12.C59=O.C6%10=O.CC%11.N57.C7%12.N68
|
C[C@H](Cc1cccs1)N=c1[nH]c2c(c(=NCCn3cc(Cl)cn3)[nH]1)CCC2
|
C[C@H]Cccccs5))))))N=c[nH]ccc=NCCnccCl)cn5))))))))[nH]6))CCC5
|
[C][C@H1][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][N][=C][NH1][C][=C][Branch2][Ring1][Ring2][C][=Branch1][=C][=N][C][C][N][C][=C][Branch1][C][Cl][C][=N][Ring1][=Branch1][NH1][Ring1][#C][C][C][C][Ring1][S]
|
C[C@H](C5)N=c1[nH]c2c(c(=NCC4)[nH]1)CCC2.n14cc(Cl)cn1.c15cccs1
|
CCCSCC(=O)N1C[C@@H](NC(=O)CC2CC(C(F)F)C2)CC2(CCOCC2)C1
|
CCCSCC=O)NC[C@@H]NC=O)CCCCCF)F))C4)))))))CCCCOCC6)))))C6
|
[C][C][C][S][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][C][Branch1][=Branch1][C][Branch1][C][F][F][C][Ring1][#Branch1][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
N13C[C@@H]7CC2(CCOCC2)C1.C18CC9C1.C6C3=O.C4(=O)C8.CCC5.C9(F)F.S56.N47
|
CN[C@@H](CC(F)(F)F)C(=O)NCc1ccc(-c2cnc(O)nc2O)cc1
|
CN[C@@H]CCF)F)F)))C=O)NCcccc-ccncO)nc6O)))))))cc6
|
[C][N][C@@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][=N][C][=C][N][=C][Branch1][C][O][N][=C][Ring1][#Branch1][O][C][=C][Ring1][=C]
|
[C@H]4(CC(F)(F)F)C3=O.c17cnc(O)nc1O.c16ccc7cc1.CN4.N35.C56
|
COc1ccc(C(=O)NC[C@H](NC(=O)[C@@H]2C=C2C)C(C)C)c(F)c1
|
COccccC=O)NC[C@H]NC=O)[C@@H]C=C3C))))))CC)C))))))cF)c6
|
[C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][N][N][C][=Branch1][C][=O][C@@H1][C][=C][Ring1][Ring1][C][C][Branch1][C][C][C][C][Branch1][C][F][=C][Ring2][Ring1][=Branch1]
|
c15ccc9c(F)c1.C6[C@H]7C(C)C.[C@@H]18C=C1C.C39=O.C48=O.CO5.N36.N47
|
CC(C)CSCCNC(=O)CCCCCn1cc([C@@H]2CC23CC3)nn1
|
CCC)CSCCNC=O)CCCCCncc[C@@H]CC3CC3)))))nn5
|
[C][C][Branch1][C][C][C][S][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][N][C][=C][Branch1][#Branch2][C@@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1][N][=N][Ring1][#Branch2]
|
C4(=O)CCCCC8.n18cc9nn1.[C@@H]19CC12CC2.CC(C)C6.C7C5.S67.N45
|
CCN(CC(=O)N1C[C@@H](C)CC[C@@H]1CNC(=O)c1cscn1)C1CC1
|
CCNCC=O)NC[C@@H]C)CC[C@@H]6CNC=O)ccscn5))))))))))))))))CCC3
|
[C][C][N][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C][C@@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][S][C][=N][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
N12C[C@@H](C)CC[C@@H]19.c18cscn1.C5C2=O.N457.C38=O.C17CC1.CC4.C69.N36
|
CC(C)(C)S[C@@H]1CCC[C@@H](NCCCNC(N)=O)C1
|
CCC)C)S[C@@H]CCC[C@@H]NCCCNCN)=O)))))))C6
|
[C][C][Branch1][C][C][Branch1][C][C][S][C@@H1][C][C][C][C@@H1][Branch1][O][N][C][C][C][N][C][Branch1][C][N][=O][C][Ring1][=C]
|
[C@@H]17CCC[C@@H]6C1.CC5(C)C.C3CC4.C2(N)=O.S57.N36.N24
|
Cc1cc(C)nc(N[C@@H](CNC(=O)c2cnc[nH]2)C(C)C)n1
|
CcccC)ncN[C@@H]CNC=O)ccnc[nH]5))))))))CC)C))))n6
|
[C][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring1][#Branch1][N][C@@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][=C][N][=C][NH1][Ring1][Branch1][C][Branch1][C][C][C][=N][Ring2][Ring1][Branch1]
|
Cc1cc(C)nc6n1.[C@H]4(C5)C(C)C.c17cnc[nH]1.C37=O.N46.N35
|
CC(C)CCC(=O)N[C@H]1C[C@H](NC(=O)C2(C(F)F)CC(F)(F)C2)C1
|
CCC)CCC=O)N[C@H]C[C@H]NC=O)CCF)F))CCF)F)C4))))))C4
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][Branch1][C][F][F][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch2][C][Ring1][S]
|
CC(C)CCC3=O.C178CC(F)(F)C1.[C@H]15C[C@H]6C1.C47=O.C8(F)F.N35.N46
|
COc1ccnc(F)c1C(=O)N[C@H]1CC[C@@H](NC(=O)c2occc2F)CC1
|
COcccncF)c6C=O)N[C@H]CC[C@@H]NC=O)coccc5F))))))))CC6
|
[C][O][C][=C][C][=N][C][Branch1][C][F][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][F][C][C][Ring1][#C]
|
c15ccnc(F)c19.[C@H]16CC[C@@H]7CC1.c18occc1F.C39=O.C48=O.CO5.N36.N47
|
Cc1cc(CNC(=O)C[C@H]2CCCN2Cc2ccc(F)nc2C)n(C)n1
|
CcccCNC=O)C[C@H]CCCN5CccccF)nc6C)))))))))))))))))nC)n5
|
[C][C][C][=C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][N][Ring1][Branch1][C][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][C][N][Branch1][C][C][N][=Ring2][Ring1][=Branch2]
|
c18ccc(F)nc1C.Cc1cc7n(C)n1.[C@H]16CCCN15.C3(=O)C6.C47.N34.C58
|
CO[C@H]1C[C@@H](C(=O)NCC2(O)CN(C(=O)c3cncc(Br)c3C)C2)C1
|
CO[C@H]C[C@@H]C=O)NCCO)CNC=O)ccnccBr)c6C))))))))C4)))))))C4
|
[C][O][C@H1][C][C@@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][#Branch1]
|
c19cncc(Br)c1C.C1%10(O)CN5C1.[C@H]16C[C@@H]8C1.C48=O.C59=O.CO6.N47.C7%10
|
NC[C@]1(F)C[C@@H](NC(=O)CCN2CCCCC2=O)C1
|
NC[C@]F)C[C@@H]NC=O)CCNCCCCC6=O)))))))))))C4
|
[N][C][C@][Branch1][C][F][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][N][C][C][C][C][C][Ring1][=Branch1][=O][C][Ring1][P]
|
N15CCCCC1=O.[C@]16(F)C[C@H]4C1.C3(=O)CC5.NC6.N34
|
C#CC[C@]1(C(=O)N[C@H](CC)C(C)(C)C)CCN(C(=O)c2cc(C#N)[nH]c2C)C1
|
C#CC[C@]C=O)N[C@H]CC))CC)C)C)))))CCNC=O)cccC#N))[nH]c5C)))))))C5
|
[C][#C][C][C@][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][Branch1][Ring1][C][#N][NH1][C][=Ring1][#Branch1][C][C][Ring2][Ring1][=Branch2]
|
c17cc(C#N)[nH]c1C.[C@]168CCN4C1.[C@@H]5(CC)C(C)(C)C.C#CC8.C36=O.C47=O.N35
|
CC[C@@H](C)C[C@H](CO)NC(=O)c1c(CNC(=O)COCC(F)F)cnn1C
|
CC[C@@H]C)C[C@H]CO))NC=O)ccCNC=O)COCCF)F))))))))cnn5C
|
[C][C][C@@H1][Branch1][C][C][C][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][Branch1][#C][C][N][C][=Branch1][C][=O][C][O][C][C][Branch1][C][F][F][C][=N][N][Ring1][#C][C]
|
CC[C@@H](C)C[C@@H]6CO.c18c9cnn1C.C3(=O)C4.C5C(F)F.C28=O.N26.C79.N37.O45
|
CCCC(C)=CC(=O)N1C[C@@H]2CCN(C(=O)[C@@H](SC)c3cccs3)C[C@@H]21
|
CCCCC)=CC=O)NC[C@@H]CCNC=O)[C@@H]SC))ccccs5)))))))C[C@@H]68
|
[C][C][C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][S][C][C][=C][C][=C][S][Ring1][Branch1][C][C@@H1][Ring1][S][Ring2][Ring1][C]
|
N14C[C@@H]2CCN5C[C@@H]21.CCCC=7C.C5(=O)[C@@H]68.c18cccs1.C=7C4=O.S6C
|
Cc1cc[nH]c1C(=O)NC[C@H](CC(C)C)C(=O)N1C[C@@]2(CO)C[C@@]2(CO)C1
|
Cccc[nH]c5C=O)NC[C@H]CCC)C)))C=O)NC[C@@]CO))C[C@@]3CO))C6
|
[C][C][C][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@][Branch1][Ring1][C][O][C][C@@][Ring1][Branch1][Branch1][Ring1][C][O][C][Ring1][#Branch2]
|
C5[C@H](CC(C)C)C4=O.N14C[C@@]27C[C@@]28C1.Cc1cc[nH]c16.C36=O.N35.C7O.C8O
|
Cc1c(NC(=O)C(=O)N[C@H](C)CC2C[C@H]3CC[C@@H](C2)N3)cnn1C1CCOCC1
|
CccNC=O)C=O)N[C@H]C)CCC[C@H]CC[C@@H]C7)N5)))))))))))))cnn5CCCOCC6
|
[C][C][=C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=N][N][Ring2][Ring1][=Branch1][C][C][C][O][C][C][Ring1][=Branch1]
|
C18C[C@H]2CC[C@@H](C1)N2.Cc1c7cnn19.C19CCOCC1.C4(=O)C5=O.[C@@H]6(C)C8.N47.N56
|
C=CCC(=O)N1C[C@@H]2CN(C(=O)CSc3nnnn3C)CC[C@]2(CO)C1
|
C=CCC=O)NC[C@@H]CNC=O)CScnnnn5C)))))))))CC[C@]6CO))C9
|
[C][=C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][S][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C@][Ring1][S][Branch1][Ring1][C][O][C][Ring2][Ring1][Branch1]
|
N14C[C@@H]2CN5CC[C@]27C1.c18nnnn1C.C=CCC4=O.C5(=O)C6.S68.C7O
|
CC[S@@+]([O-])CC(=O)NC1(CNC(=O)COC2(C)CCCC2)CCCCCC1
|
CC[S@@+][O-])CC=O)NCCNC=O)COCC)CCCC5))))))))))CCCCCC7
|
[C][C][S@@+1][Branch1][C][O-1][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][C][Ring1][=Branch1][C][C][C][C][C][C][Ring2][Ring1][Ring1]
|
C179CCCCCC1.CC[S@@+]([O-])CC3=O.C16(C)CCCC1.C4(=O)C5.N37.C89.N48.O56
|
CCc1cc(CCN[C@H](c2cn(C)nn2)c2nnnn2C2CCCCCC2)on1
|
CCcccCCN[C@H]ccnC)nn5)))))cnnnn5CCCCCCC7))))))))))))))))on5
|
[C][C][C][C][=C][Branch2][Ring1][P][C][C][N][C@H1][Branch1][O][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C][C][C][C][Ring1][#Branch1][O][N][=Ring2][Ring1][O]
|
C19CCCCCC1.c15cc6on1.c17cn(C)nn1.c18nnnn19.C6C3.[C@@H]478.CC5.N34
|
O=C(NCc1ccc(Br)cc1)NC[C@@H](O)c1ccc(Cl)cc1Cl
|
O=CNCccccBr)cc6))))))))NC[C@@H]O)ccccCl)cc6Cl
|
[O][=C][Branch1][=C][N][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][C][C@@H1][Branch1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
|
c17ccc(Cl)cc1Cl.c16ccc(Br)cc1.C5[C@H]7O.O=C23.N24.C46.N35
|
CCn1cccc1C(=O)N1CCCN(CCNC(=O)/C=C/C(C)(C)C)CC1
|
CCncccc5C=O)NCCCNCCNC=O)/C=C/CC)C)C))))))))CC7
|
[C][C][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][/C][=C][/C][Branch1][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][C]
|
N12CCCN4CC1.n18cccc16.C=7C(C)(C)C.C3(=O)C=7.C26=O.C4C5.CC8.N35
|
CCCN(CCC)C(=O)CCC(=O)N[C@H](CO)CNC(=O)c1cc(C)c(O)nn1
|
CCCNCCC)))C=O)CCC=O)N[C@H]CO))CNC=O)cccC)cO)nn6
|
[C][C][C][N][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][O][N][=N][Ring1][Branch2]
|
c19cc(C)c(O)nn1.C2(=O)CCC3=O.[C@H]7(C8)CO.CCC5.N256.C6CC.C49=O.N37.N48
|
COc1ccc(CC(=O)NC[C@H](NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)C2CCC2)cc1F
|
COccccCC=O)NC[C@H]NC=O)[C@H][C@@H]CCC[C@@H]56))))))))CCCC4)))))))))cc6F
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@H1][C@@H1][C][C][C][C@@H1][Ring1][Branch1][Ring1][=Branch1][C][C][C][C][Ring1][Ring2][C][=C][Ring2][Ring1][=Branch2][F]
|
c16ccc%11cc1F.[C@@H]19[C@H]2CCC[C@@H]12.C%11C4=O.C7[C@H]8%10.C1%10CCC1.C59=O.CO6.N47.N58
|
CC=C(C)C(=O)N[C@@H]1CN(C(=O)c2c(C)nn(C(C)(C)C)c2C)CC2(CCC2)C1
|
CC=CC)C=O)N[C@@H]CNC=O)ccC)nnCC)C)C))c5C)))))))CCCCC4)))C6
|
[C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][#Branch2][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][=Branch1]
|
[C@@H]15CN4CC2(CCC2)C1.c16c(C)nn8c1C.C=7(C)C3=O.C8(C)(C)C.C46=O.CC=7.N35
|
CSc1ncc(Br)c(N(C(=O)CCn2cncn2)[C@@H]2CCCNCC2)n1
|
CScnccBr)cNC=O)CCncncn5))))))))[C@@H]CCCNCC7))))))))n6
|
[C][S][C][=N][C][=C][Branch1][C][Br][C][Branch2][Ring1][#Branch2][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][C][=N][C][=N][Ring1][Branch1][C@@H1][C][C][C][N][C][C][Ring1][#Branch1][=N][Ring2][Ring1][Branch2]
|
c17ncc(Br)c4n1.[C@@H]15CCCNCC1.C3(=O)CC6.n16cncn1.N345.CS7
|
CO[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H]2C[C@H](CNC(=O)COC(C)C)CC[C@@H]2C1
|
CO[C@@H]CCC[C@@H]5C=O)NCC[C@@H]C[C@H]CNC=O)COCC)C)))))))CC[C@@H]6C%10
|
[C][O][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][C@@H1][Ring1][#C][C][Ring2][Ring1][Ring1]
|
N13CC[C@@H]2C[C@H]%10CC[C@@H]2C1.[C@@H]17CCC[C@@H]19.C4(=O)C5.C39=O.C6(C)C.CO7.C8%10.N48.O56
|
Cc1nsc(C(=O)N[C@H]2CCC[C@H](C(=O)N3CC(CN=[N+]=[N-])C3)CC2)c1N
|
CcnscC=O)N[C@H]CCC[C@H]C=O)NCCCN=[N+]=[N-]))))C4)))))CC7)))))))))c5N
|
[C][C][=N][S][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][Branch1][Branch1][C][N][=N+1][=N-1][C][Ring1][Branch2][C][C][Ring1][P][=C][Ring2][Ring1][=Branch2][N]
|
[C@H]16CCC[C@H]8CC1.Cc1nsc7c1N.N15CC9C1.C9N=[N+]=[N-].C47=O.C58=O.N46
|
CSCC[C@@H](O)CC(=O)N1CCCC12CCN(C(=O)C(C)(C)c1ccns1)CC2
|
CSCC[C@@H]O)CC=O)NCCCC5CCNC=O)CC)C)cccns5)))))))CC6
|
[C][S][C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=N][S][Ring1][Branch1][C][C][Ring1][S]
|
N13CCCC12CCN4CC2.C5C[C@@H](O)CC3=O.C4(=O)C6(C)C.c16ccns1.CS5
|
C=C(Cl)CN=C(NC[C@H]1CCCN(C(C)=O)C1)NC[C@H]1CCCN1CC
|
C=CCl)CN=CNC[C@H]CCCNCC)=O))C6))))))))NC[C@H]CCCN5CC
|
[C][=C][Branch1][C][Cl][C][N][=C][Branch2][Ring1][C][N][C][C@H1][C][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][Ring1][=Branch2][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][C]
|
C=C(Cl)CN=C(N3)N4.[C@H]17CCCN2C1.[C@H]16CCCN15.C2(C)=O.C37.C46.C5C
|
CCCc1nc(C(=O)N2C[C@H](C)[C@H](NC(=O)COc3c(C)cccc3C)C2)co1
|
CCCcncC=O)NC[C@H]C)[C@H]NC=O)COccC)cccc6C)))))))))))C5))))))co5
|
[C][C][C][C][=N][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][O][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][Ring1][=C][O][Ring2][Ring1][#Branch2]
|
c17c(C)cccc1C.N14C[C@@H]8[C@@H](C)C1.c1%10nc9co1.C5(=O)C6.CCC%10.C49=O.N58.O67
|
Cc1ccc(CCCN2CC[C@@](C)(NC(=O)c3ccc(C)o3)C2)cc1
|
CccccCCCNCC[C@@]C)NC=O)ccccC)o5)))))))C5))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][C][C][N][C][C][C@@][Branch1][C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][O][Ring1][=Branch1][C][Ring1][#C][C][=C][Ring2][Ring1][Branch2]
|
Cc1ccc8cc1.N15CC[C@]6(C)C1.c17ccc(C)o1.C8CC5.C47=O.N46
|
CCN(C[C@@H](C)NC(=O)C12C3C4C1C1C2C3C41C)C(=O)c1cnc(C)[nH]1
|
CCNC[C@@H]C)NC=O)CCCC4CC6C6C64C)))))))))))))C=O)ccncC)[nH]5
|
[C][C][N][Branch2][Ring1][=C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][NH1][Ring1][=Branch1]
|
C12%11C3C4C1C1C2C3C41C.c1%10cnc(C)[nH]1.C8[C@H]9C.N678.C5%11=O.C6%10=O.CC7.N59
|
C[C@@H]1CN(C(=O)[C@H]2CCCC[C@H]2C(C)(C)C)C[C@H]1CCNC(=O)c1cnccn1
|
C[C@@H]CNC=O)[C@H]CCCC[C@H]6CC)C)C)))))))))C[C@H]5CCNC=O)ccnccn6
|
[C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][C][C@H1][Ring1][P][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1]
|
C[C@@H]1CN3C[C@H]19.[C@H]17CCCC[C@H]18.c16cnccn1.C8(C)(C)C.C37=O.C9C5.C46=O.N45
|
CC(C)n1cc(C(=O)NC[C@H](C)NC(=O)c2cccc3c2CCC3)nn1
|
CCC)nccC=O)NC[C@H]C)NC=O)cccccc6CCC5)))))))))))))))nn5
|
[C][C][Branch1][C][C][N][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Branch1][N][=N][Ring2][Ring1][#Branch1]
|
c19cccc2c1CCC2.n1%10cc8nn1.C6[C@@H]7C.CC%10C.C48=O.C59=O.N46.N57
|
CC[C@H](CC#N)N1CCN(C(=O)[C@@H]2CN(C)C(=O)CCO2)CC1
|
CC[C@H]CC#N)))NCCNC=O)[C@@H]CNC)C=O)CCO7))))))))CC6
|
[C][C][C@H1][Branch1][Ring2][C][C][#N][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@@H1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][O][Ring1][=Branch2][C][C][Ring1][P]
|
[C@@H]15CN(C)C(=O)CCO1.N14CCN3CC1.CC[C@@H]4CC#N.C35=O
|
O=C(C[C@H]1CCCC12CC2)N1CCN(C(=O)C2CC(C(F)(F)F)C2)[C@H](CCO)C1
|
O=CC[C@H]CCCC5CC3))))))))NCCNC=O)CCCCF)F)F))C4)))))[C@H]CCO)))C6
|
[O][=C][Branch1][=N][C][C@H1][C][C][C][C][Ring1][Branch1][C][C][Ring1][Ring1][N][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][Branch2][C@H1][Branch1][Ring2][C][C][O][C][Ring2][Ring1][Ring1]
|
N13CCN4[C@H]6C1.[C@H]17CCCC12CC2.C15CC8C1.O=C3C7.C8(F)(F)F.C45=O.C6CO
|
CC[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CC[C@@H](C)N(C(=O)c2ccc(N)cc2O)C1
|
CC[C@@H]OCC[C@@H]5C=O)N[C@H]CC[C@@H]C)NC=O)ccccN)cc6O))))))))C6
|
[C][C][C@@H1][O][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][O][C][Ring1][P]
|
[C@H]15CC[C@@H](C)N4C1.c17ccc(N)cc1O.[C@@H]18OCC[C@@H]16.C36=O.C47=O.CC8.N35
|
CCC(CC)n1nc(C)cc1C(=O)N[C@H]1C[C@H](NC(=O)c2cc(O)nc(O)c2)C1
|
CCCCC))nncC)cc5C=O)N[C@H]C[C@H]NC=O)cccO)ncO)c6))))))))C4
|
[C][C][C][Branch1][Ring1][C][C][N][N][=C][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][#C]
|
c18cc(O)nc(O)c1.n19nc(C)cc17.CCC9CC.[C@H]15C[C@H]6C1.C37=O.C48=O.N35.N46
|
Cc1cc(CC(=O)N2CC[C@@H](O)[C@H]2C(=O)Nc2cncc(C(F)(F)F)c2)nn1C
|
CcccCC=O)NCC[C@@H]O)[C@H]5C=O)NccnccCF)F)F))c6)))))))))))))))nn5C
|
[C][C][=C][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][O][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][N][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][=N][N][Ring2][Ring1][O][C]
|
Cc1cc7nn1C.N13CC[C@@H](O)[C@H]16.c15cncc8c1.C7C3=O.C8(F)(F)F.C46=O.N45
|
C=CCC(CC=C)NC(=O)[C@@H]1CC(C)(C)CCN1C(=O)[C@H](CCC)OC
|
C=CCCCC=C)))NC=O)[C@@H]CCC)C)CCN6C=O)[C@H]CCC)))OC
|
[C][=C][C][C][Branch1][Ring2][C][C][=C][N][C][=Branch1][C][=O][C@@H1][C][C][Branch1][C][C][Branch1][C][C][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C@H1][Branch1][Ring2][C][C][C][O][C]
|
[C@@H]16CC(C)(C)CCN13.C=CCC5CC=C.C3(=O)[C@@H]4CCC.C26=O.N25.O4C
|
O=C([C@H](CO)C(F)(F)F)N1CC[C@@]2(CCN(C(=O)C3(O)CCSCC3)C2)C1
|
O=C[C@H]CO))CF)F)F)))NCC[C@@]CCNC=O)CO)CCSCC6)))))))C5))))C5
|
[O][=C][Branch1][=C][C@H1][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F][N][C][C][C@@][Branch2][Ring1][Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][O][C][C][S][C][C][Ring1][#Branch1][C][Ring1][=C][C][Ring2][Ring1][C]
|
N14CC[C@@]2(CCN5C2)C1.O=C4[C@H](CO)C(F)(F)F.C16(O)CCSCC1.C56=O
|
CN(C)CCCCC(=O)N[C@H]1[C@@H]2CN(C(=O)c3cnc4cccnc4c3)C[C@@H]21
|
CNC)CCCCC=O)N[C@H][C@@H]CNC=O)ccnccccnc6c%10)))))))))))C[C@@H]56
|
[C][N][Branch1][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][C][=C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C@@H1][Ring1][P][Ring2][Ring1][C]
|
c19cnc2cccnc2c1.C7CCCC5=O.[C@@H]18[C@H]2CN6C[C@@H]12.CN7C.C69=O.N58
|
C=CC[C@H](CC(F)F)NC(=O)[C@H](CCSC)NC(=O)c1cc2cc[nH]c2cn1
|
C=CC[C@H]CCF)F)))NC=O)[C@H]CCSC))))NC=O)ccccc[nH]c5cn9
|
[C][=C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C][=C][C][C][=C][NH1][C][=Ring1][Branch1][C][=N][Ring1][=Branch2]
|
c18cc2cc[nH]c2cn1.C=CC[C@@H]5CC(F)F.C3(=O)[C@@H]6CC7.C48=O.N35.S7C.N46
|
CCc1c(C(=O)N2CC3(CC[C@@H]3NC(=O)C[C@H](C)SC)C2)nnn1C
|
CCccC=O)NCCCC[C@@H]4NC=O)C[C@H]C)SC)))))))))C4)))))nnn5C
|
[C][C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][S][C][C][Ring1][#C][N][=N][N][Ring2][Ring1][=Branch1][C]
|
N14CC2(CC[C@@H]27)C1.c19c8nnn1C.C5(=O)C[C@@H]6C.C48=O.CC9.N57.S6C
|
CCCn1nccc1C(=O)N[C@@H]1CCCN([C@H]2CCN(C(C)C)C2=O)C1
|
CCCnnccc5C=O)N[C@@H]CCCN[C@H]CCNCC)C))C5=O))))))C6
|
[C][C][C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch1][S][C@H1][C][C][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring1][Branch2][=O][C][Ring1][#C]
|
[C@@H]14CCCN5C1.[C@H]15CCN8C1=O.n17nccc16.CCC7.C36=O.C8(C)C.N34
|
COC(=O)c1cnc(C)[nH]c1=NCCN(C)C(=O)c1cn(CCC(C)C)nn1
|
COC=O)ccncC)[nH]c6=NCCNC)C=O)ccnCCCC)C))))nn5
|
[C][O][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][NH1][C][Ring1][#Branch1][=N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][Branch1][Branch2][C][C][C][Branch1][C][C][C][N][=N][Ring1][#Branch2]
|
c16cnc(C)[nH]c1=NCC4.c15cn7nn1.C7CC(C)C.C26=O.N34C.C35=O.CO2
|
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