SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CSCCCC(=O)NCCc1n[nH]cc1C(=O)NCC[C@@H]1CCCC[C@H]1C
|
CSCCCC=O)NCCcn[nH]cc5C=O)NCC[C@@H]CCCC[C@H]6C
|
[C][S][C][C][C][C][=Branch1][C][=O][N][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][C]
|
[C@@H]19CCCC[C@H]1C.C6CCC2=O.c18n[nH]cc17.C4C8.C37=O.C5C9.CS6.N24.N35
|
COCCCOCCC(=O)NC[C@@H]1CC(C)(C)CN1C(=O)CN(C)[C@@H]1CCSC1
|
COCCCOCCC=O)NC[C@@H]CCC)C)CN5C=O)CNC)[C@@H]CCSC5
|
[C][O][C][C][C][O][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch1][C][C][Branch1][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][N][Branch1][C][C][C@@H1][C][C][S][C][Ring1][Branch1]
|
[C@@H]1%10CC(C)(C)CN13.C6CC2=O.[C@@H]19CCSC1.C4CC5.C3(=O)C8.N89C.CO4.O56.N27.C7%10
|
Cc1ccc(OCCC(=O)N2C[C@H](CNC(=O)c3csc(C)n3)[C@@H]3C[C@H]32)cc1
|
CccccOCCC=O)NC[C@H]CNC=O)ccscC)n5))))))))[C@@H]C[C@H]36))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][Ring2][O][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][C@@H1][C][C@H1][Ring1][Ring1][Ring1][S][C][=C][Ring2][Ring1][O]
|
Cc1ccc7cc1.N14C[C@H]%10[C@@H]2C[C@H]21.c19csc(C)n1.C6CC4=O.C59=O.O67.C8%10.N58
|
C#CCOCC(=O)NCc1cc(C)c(C(=O)N2CC3(CCCN3C)C2)o1
|
C#CCOCC=O)NCcccC)cC=O)NCCCCCN5C)))))C4)))))o5
|
[C][#C][C][O][C][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][C][C][C][N][Ring1][Branch1][C][C][Ring1][=Branch2][O][Ring1][P]
|
N15CC2(CCCN2C)C1.c1%10cc(C)c9o1.C7C4=O.C#CC6.C59=O.O67.N48.C8%10
|
CN1C[C@@H](O)C[C@H]1C(=O)N1C[C@H]2C[C@@]2(CNC(=O)C2CCN(C3CC3)CC2)C1
|
CNC[C@@H]O)C[C@H]5C=O)NC[C@H]C[C@@]3CNC=O)CCCNCCC3)))CC6)))))))))C6
|
[C][N][C][C@@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@][Ring1][Ring1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][Ring1][=Branch2][C][Ring2][Ring1][Ring1]
|
CN1C[C@@H](O)C[C@H]18.N14C[C@H]2C[C@@]2%10C1.C19CCN7CC1.C48=O.C59=O.C17CC1.C6%10.N56
|
CCOC=CC(=O)N1CC(CNC(=O)C=Cc2nccn2CC)(C(N)=O)C1
|
CCOC=CC=O)NCCCNC=O)C=Ccnccn5CC))))))))))))CN)=O))C4
|
[C][C][O][C][=C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][N][Ring1][Branch1][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring2][Ring1][Ring2]
|
C=8c1nccn19.O5C=CC3=O.N13CC7%10C1.C4(=O)C=8.C7(N)=O.CC5.C6%10.N46.C9C
|
CC[C@@H](CN(C)C(=O)c1ccc2c(C)nn(C)c2n1)NC(=O)[C@H](C)CC1CC1
|
CC[C@@H]CNC)C=O)cccccC)nnC)c5n9))))))))))))NC=O)[C@H]C)CCCC3
|
[C][C][C@@H1][Branch2][Ring1][=N][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=N][N][Branch1][C][C][C][Ring1][#Branch1][=N][Ring1][O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][C][C][Ring1][Ring1]
|
c17ccc2c(C)nn(C)c2n1.C4(=O)[C@H](C)C8.CC[C@H]5C6.N36C.C37=O.C18CC1.N45
|
Cn1cc(N2CCN([C@@H](C(=O)NC3CC3)c3ccccc3Cl)CC2)cn1
|
CnccNCCN[C@@H]C=O)NCCC3)))))cccccc6Cl))))))))CC6))))))cn5
|
[C][N][C][=C][Branch2][Ring2][Ring1][N][C][C][N][Branch2][Ring1][#Branch1][C@@H1][Branch1][O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][C][Ring2][Ring1][Ring2][C][=N][Ring2][Ring1][=Branch2]
|
N16CCN5CC1.c18ccccc1Cl.Cn1cc6cn1.[C@@H]58C4=O.C17CC1.N47
|
COCc1cc(C(=O)N(C)C[C@@H](O)CN(C)C(=O)Cc2c(C)n[nH]c2C)c(C)o1
|
COCcccC=O)NC)C[C@@H]O)CNC)C=O)CccC)n[nH]c5C))))))))))))))cC)o5
|
[C][O][C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][Branch1][C][C][=N][NH1][C][=Ring1][=Branch1][C][=C][Branch1][C][C][O][Ring2][Ring1][#Branch2]
|
c19cc8c(C)o1.c1%10c(C)n[nH]c1C.C6[C@@H](O)C7.C4(=O)C%10.C38=O.N36C.N47C.CO5.C59
|
CC[C@@H](CC(C)C)C(=O)N1CCC[C@H](NC(=O)c2ccnc3c2cnn3C)C1
|
CC[C@@H]CCC)C)))C=O)NCCC[C@H]NC=O)cccncc6cnn5C))))))))))))C6
|
[C][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C][C][Ring2][Ring1][Ring1]
|
c17ccnc2c1cnn2C.CC[C@@H](CC(C)C)C4=O.N14CCC[C@H]6C1.C57=O.N56
|
C#C[C@]1(O)C[C@@H](C(=O)NCCC(C)(C)C(=O)NCC2[C@H](C)[C@H]2C)C1
|
C#C[C@]O)C[C@@H]C=O)NCCCC)C)C=O)NCC[C@H]C)[C@H]3C))))))))))))C4
|
[C][#C][C@][Branch1][C][O][C][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C@H1][Ring1][Ring2][C][C][Ring2][Ring1][=Branch1]
|
C5CC(C)(C)C4=O.C#C[C@]1(O)C[C@@H]7C1.C18[C@H](C)[C@H]1C.C37=O.N35.N46.C68
|
Ic1ccsc1CNCc1nn[nH]c1C1CC1
|
Icccsc5CNCcnn[nH]c5CCC3
|
[I][C][C][=C][S][C][=Ring1][Branch1][C][N][C][C][N][=N][NH1][C][=Ring1][Branch1][C][C][C][Ring1][Ring1]
|
Ic1ccsc14.c15nn[nH]c16.C16CC1.C24.N23.C35
|
CCN(CCNC(=O)c1cc(S(N)(=O)=O)n(C)c1)C(=O)C1Cc2ccccc2C1
|
CCNCCNC=O)cccSN)=O)=O))nC)c5)))))))))C=O)CCcccccc6C9
|
[C][C][N][Branch2][Ring1][N][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][N][Branch1][C][C][C][=Ring1][#Branch2][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2]
|
c19cc(S(N)(=O)=O)n(C)c1.C18Cc2ccccc2C1.N456.C6C7.C39=O.C48=O.CC5.N37
|
CCC(=O)CCC(=O)N1CCN(C(=O)[C@H](CCOC)OC)[C@H]2COC[C@H]21
|
CCC=O)CCC=O)NCCNC=O)[C@H]CCOC))))OC))))[C@H]COC[C@H]59
|
[C][C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][O][C][O][C][C@H1][C][O][C][C@H1][Ring1][Branch1][Ring2][Ring1][C]
|
N13CCN4[C@H]2COC[C@H]21.CCC(=O)CCC3=O.C4(=O)[C@@H]6CC5.O5C.O6C
|
CC[C@]1(C)C[C@H](NC(=O)c2c(C)noc2C)CN1C(=O)C(=O)NC1CC1
|
CC[C@]C)C[C@H]NC=O)ccC)noc5C))))))))CN5C=O)C=O)NCCC3
|
[C][C][C@][Branch1][C][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][O][C][=Ring1][=Branch1][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1]
|
[C@@]19(C)C[C@H]6CN14.c18c(C)noc1C.C4(=O)C5=O.C38=O.C17CC1.CC9.N36.N57
|
CN1CCC(C)(C(=O)NC[C@]2(C)CCCN2C(=O)c2cc(Cl)cs2)CC1
|
CNCCCC)C=O)NC[C@]C)CCCN5C=O)cccCl)cs5))))))))))))))CC6
|
[C][N][C][C][C][Branch1][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][S][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2]
|
CN1CCC7(C)CC1.[C@@]18(C)CCCN14.c16cc(Cl)cs1.C37=O.C46=O.N35.C58
|
CC1(C)CC[C@@H](C(=O)N2C[C@@H](NC(=O)CC3CC(=O)NC(=O)C3)CC3(CC3)C2)O1
|
CCC)CC[C@@H]C=O)NC[C@@H]NC=O)CCCC=O)NC=O)C6)))))))))CCCC3))C6)))))))O5
|
[C][C][Branch1][C][C][C][C][C@@H1][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][Ring1][Branch2][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][Ring2][O][Ring2][Ring1][N]
|
N14C[C@@H]6CC2(CC2)C1.C18CC(=O)NC(=O)C1.CC1(C)CC[C@@H]7O1.C5(=O)C8.C47=O.N56
|
C=C(C)CC(=O)N1C[C@@H](NC(=O)c2cc(C(C)(F)F)on2)[C@H](c2nccn2C)C1
|
C=CC)CC=O)NC[C@@H]NC=O)cccCC)F)F))on5)))))))[C@H]cnccn5C))))))C5
|
[C][=C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][F][F][O][N][=Ring1][=Branch2][C@H1][Branch1][=Branch2][C][=N][C][=C][N][Ring1][Branch1][C][C][Ring2][Ring1][#Branch1]
|
N13C[C@@H]5[C@H]8C1.C=C(C)CC3=O.c16cc7on1.c18nccn1C.C7(C)(F)F.C46=O.N45
|
O=C(Cc1cccnc1)NC[C@@H](O)CC(=O)NCc1cccc(Cl)c1
|
O=CCccccnc6)))))))NC[C@@H]O)CC=O)NCcccccCl)c6
|
[O][=C][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]
|
C4[C@@H](O)CC3=O.c17cccc(Cl)c1.c16cccnc1.O=C2C6.N24.N35.C57
|
Cc1cc(C(=O)N[C@@H]2CC[C@H]2NC(=O)c2ccc[n+]([O-])c2)sc1Cl
|
CcccC=O)N[C@@H]CC[C@H]4NC=O)cccc[n+][O-])c6))))))))))))))sc5Cl
|
[C][C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][N+1][Branch1][C][O-1][=C][Ring1][#Branch1][S][C][=Ring2][Ring1][=Branch1][Cl]
|
Cc1cc7sc1Cl.c18ccc[n+]([O-])c1.[C@@H]15CC[C@H]16.C37=O.C48=O.N35.N46
|
Cc1ncsc1COCC(=O)N1CC[C@@H](OCCNC(=O)COCCCF)C1
|
Ccncsc5COCC=O)NCC[C@@H]OCCNC=O)COCCCF)))))))))))C5
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][#C][O][C][C][N][C][=Branch1][C][=O][C][O][C][C][C][F][C][Ring1][P]
|
Cc1ncsc13.N12CC[C@@H]%10C1.C6C2=O.C4(=O)C8.C9CCF.C7C%11.C53.O56.O7%10.N4%11.O89
|
C[C@H](NC(=O)[C@H](O)[C@H](C)c1ccccc1F)[C@@H]1CN(C(=O)c2ccc[nH]2)CCO1
|
C[C@H]NC=O)[C@H]O)[C@H]C)cccccc6F)))))))))))[C@@H]CNC=O)cccc[nH]5))))))CCO6
|
[C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][Ring1][Branch1][C][C][O][Ring1][=N]
|
C3(=O)[C@H](O)[C@@H]8C.c18ccccc1F.[C@@H]17CN4CCO1.c16ccc[nH]1.C[C@H]57.C46=O.N35
|
COC[C@@H]1CN(C(=O)C=Cc2cc[nH]c2)CCN1C(=O)CCC(N)=O
|
COC[C@@H]CNC=O)C=Cccc[nH]c5))))))))CCN6C=O)CCCN)=O
|
[C][O][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][=C][NH1][C][=Ring1][Branch1][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][C][C][Branch1][C][N][=O]
|
[C@@H]17CN3CCN14.C4(=O)CCC(N)=O.C=6c1cc[nH]c1.C3(=O)C=6.CO5.C57
|
Cc1cc(C(=O)N2C[C@@H](F)[C@@H](N(C)C(=O)CC3CC3)C2)c2c(C)noc2n1
|
CcccC=O)NC[C@@H]F)[C@@H]NC)C=O)CCCC3))))))C5))))))ccC)noc5n9
|
[C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][F][C@@H1][Branch1][#C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring1][C][Ring1][=C][=C][C][Branch1][C][C][=N][O][C][Ring1][=Branch1][=N][Ring2][Ring1][#Branch2]
|
Cc1cc7c2c(C)noc2n1.N14C[C@@H](F)[C@@H]6C1.C5(=O)C8.C47=O.N56C.C18CC1
|
CCc1ccc(C(=O)N(CC)C[C@H](CC)NC(=O)[C@@H](C)Cn2cccn2)c(Cl)c1
|
CCccccC=O)NCC))C[C@H]CC))NC=O)[C@@H]C)Cncccn5)))))))))))))cCl)c6
|
[C][C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][C][=C][C][=N][Ring1][Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][O]
|
c1%10ccc8c(Cl)c1.C4(=O)[C@@H](C)C9.C6[C@@H]7CC.n19cccn1.C38=O.N356.CC%10.C5C.N47
|
COc1noc(C)c1C(=O)NC[C@H]1CC2(CC2)CN1C(=O)c1cc(C)nc(O)n1
|
COcnocC)c5C=O)NC[C@H]CCCC3))CN5C=O)cccC)ncO)n6
|
[C][O][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][C][Branch1][C][O][=N][Ring1][Branch2]
|
[C@H]19CC2(CC2)CN14.c17cc(C)nc(O)n1.c15noc(C)c18.C38=O.C47=O.CO5.N36.C69
|
CCC(CC)C(=O)NCc1cn(CCC(=O)N[C@@H]2CCN3CC[C@H]2C3)nn1
|
CCCCC))C=O)NCccnCCC=O)N[C@@H]CCNCC[C@H]7C5))))))))))))nn5
|
[C][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][=C][N][Branch2][Ring1][Ring2][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][N][C][C][C@H1][Ring1][#Branch1][C][Ring1][Branch1][N][=N][Ring2][Ring1][C]
|
[C@@H]17CCN2CC[C@H]1C2.CCC(CC)C4=O.c19cn8nn1.C8CC5=O.N46.C69.N57
|
C[C@H](C(=O)NC[C@H]1CN(C(=O)c2ccc(O)cc2)CC1(F)F)c1cc[nH]n1
|
C[C@H]C=O)NC[C@H]CNC=O)ccccO)cc6)))))))CC5F)F)))))))))ccc[nH]n5
|
[C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][C][Ring1][=C][Branch1][C][F][F][C][C][=C][NH1][N][=Ring1][Branch1]
|
[C@H]18CN4CC1(F)F.c16ccc(O)cc1.C[C@@H]7C3=O.c17cc[nH]n1.C46=O.N35.C58
|
COc1ccc(CC(=O)N2CCCN(C(=O)c3cnoc3C)[C@H](C)C2)cn1
|
COccccCC=O)NCCCNC=O)ccnoc5C)))))))[C@H]C)C7)))))))))cn6
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=N][O][C][=Ring1][Branch1][C][C@H1][Branch1][C][C][C][Ring1][S][C][=N][Ring2][Ring1][=Branch2]
|
N14CCCN5[C@H](C)C1.c16ccc8cn1.c17cnoc1C.C8C4=O.C57=O.CO6
|
O=C([C@@H]1[C@H]2C[C@H]2CN1C(=O)c1ccc(F)c(F)c1)N1CC(CC2CC2)C1
|
O=C[C@@H][C@H]C[C@H]3CN6C=O)ccccF)cF)c6)))))))))))))NCCCCCC3))))C4
|
[O][=C][Branch2][Ring1][=N][C@@H1][C@H1][C][C@H1][Ring1][Ring1][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][N][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][Branch2]
|
c16ccc(F)c(F)c1.[C@@H]15[C@H]2C[C@H]2CN14.N13CC7C1.O=C35.C46=O.C18CC1.C78
|
Cc1cc(C(=O)N2CC[C@@](NC(=O)Cn3c(C)csc3=O)(C3CC3)C2)sc1C
|
CcccC=O)NCC[C@@]NC=O)CncC)csc5=O)))))))))CCC3)))C5))))))sc5C
|
[C][C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][N][C][Branch1][C][C][=C][S][C][Ring1][=Branch1][=O][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Ring1][S][C][=Ring2][Ring1][#Branch2][C]
|
N14CC[C@@]6(C2CC2)C1.Cc1cc7sc1C.n18c(C)csc1=O.C5(=O)C8.C47=O.N56
|
Cn1cccc(C(=O)N[C@H]2CCC[C@@H](C(=O)NC3CC(O)(CO)C3)CC2)c1=O
|
CnccccC=O)N[C@H]CCC[C@@H]C=O)NCCCO)CO))C4))))))CC7)))))))))c6=O
|
[C][N][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][C][C][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][Branch1][Ring1][C][O][C][Ring1][#Branch1][C][C][Ring1][P][C][Ring2][Ring1][#Branch2][=O]
|
Cn1cccc9c1=O.[C@H]16CCC[C@@H]8CC1.C17CC%10(O)C1.C49=O.C58=O.N46.N57.C%10O
|
CNc1ncccc1C(=O)N1CCO[C@@H](CCNC(=O)[C@H](C)NC(=O)COC)C1
|
CNcncccc6C=O)NCCO[C@@H]CCNC=O)[C@H]C)NC=O)COC))))))))))C6
|
[C][N][C][=N][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][O][C][C][Ring2][Ring1][Ring1]
|
c18ncccc19.N12CCO[C@@H]%10C1.C3(=O)[C@@H]7C.C4(=O)C5.C29=O.C%10C6.CN8.N36.N47.O5C
|
Cc1cc(-c2ccc(F)c(Cl)c2)c(S(=O)(=O)N[C@H](C)c2nn[nH]n2)cc1C
|
Cccc-ccccF)cCl)c6))))))cS=O)=O)N[C@H]C)cnn[nH]n5))))))))cc6C
|
[C][C][=C][C][Branch1][#C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Branch2][Ring1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][=N][NH1][N][=Ring1][Branch1][C][=C][Ring2][Ring1][=Branch2][C]
|
Cc1cc6c(S4(=O)=O)cc1C.c16ccc(F)c(Cl)c1.c15nn[nH]n1.[C@H]35C.N34
|
CC(C)(CCNC(=O)c1cc(F)c(CO)c(F)c1)NC(=O)CN1C[C@H]2C[C@H]2C1
|
CCC)CCNC=O)cccF)cCO))cF)c6))))))))))NC=O)CNC[C@H]C[C@H]3C6
|
[C][C][Branch1][C][C][Branch2][Ring1][#Branch2][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][Ring1][C][O][C][Branch1][C][F][=C][Ring1][#Branch2][N][C][=Branch1][C][=O][C][N][C][C@H1][C][C@H1][Ring1][Ring1][C][Ring1][=Branch1]
|
c18cc(F)c9c(F)c1.CC5(C)CC6.N17C[C@H]2C[C@H]2C1.C4(=O)C7.C38=O.N36.C9O.N45
|
CC[C@H]1CN(C(=O)[C@@H]2CCC3(CCC3)C2)CCN1C(=O)c1ccc2snnc2c1
|
CC[C@H]CNC=O)[C@@H]CCCCCC4)))C5))))))CCN6C=O)ccccsnnc5c9
|
[C][C][C@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][Branch2][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][C][=C][S][N][=N][C][Ring1][Branch1][=C][Ring1][=Branch2]
|
c17ccc2snnc2c1.[C@H]18CN4CCN15.[C@@H]16CCC2(CCC2)C1.C46=O.C57=O.CC8
|
COC[C@@H](CC(=O)NC[C@H](C)CC1CCC1)NC(=O)[C@@H]1CC(=O)C12CCC2
|
COC[C@@H]CC=O)NC[C@H]C)CCCCC4))))))))))NC=O)[C@@H]CC=O)C4CCC4
|
[C][O][C][C@@H1][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C][C][C][C][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][C][Ring1][Branch1][C][C][C][Ring1][Ring2]
|
[C@@H]18CC(=O)C12CCC2.C5[C@H]6CC3=O.C7[C@H](C)C9.C19CCC1.C48=O.CO5.N37.N46
|
CC(C)S[C@H](C)C(=O)N1CC[C@@]1(C)CC(=O)NCCCN1CCCCC1
|
CCC)S[C@H]C)C=O)NCC[C@@]4C)CC=O)NCCCNCCCCC6
|
[C][C][Branch1][C][C][S][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@][Ring1][Ring2][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][N][C][C][C][C][C][Ring1][=Branch1]
|
N12CC[C@]18C.N15CCCCC1.[C@@H]7(C)C2=O.C8C3=O.C4CC5.CC6C.S67.N34
|
CCN(CC)CC(=O)NC[C@](C)(CC)C(=O)N1CC[C@@](C)(COC)C1
|
CCNCC))CC=O)NC[C@]C)CC))C=O)NCC[C@@]C)COC)))C5
|
[C][C][N][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch1][Ring2][C][O][C][C][Ring1][=Branch2]
|
C8[C@](C)(CC)C3=O.N13CC[C@]9(C)C1.C7C2=O.N567.CC5.C6C.N28.C49.O4C
|
C[C@H](N=c1[nH]nc(CO)s1)[C@@H]1CN(C(=O)CCCOc2ccccc2F)CCO1
|
C[C@H]N=c[nH]ncCO))s5))))))[C@@H]CNC=O)CCCOcccccc6F))))))))))))CCO6
|
[C][C@H1][Branch1][=N][N][=C][NH1][N][=C][Branch1][Ring1][C][O][S][Ring1][#Branch1][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][O][Ring2][Ring1][Ring1]
|
C[C@@H]6N=c1[nH]nc7s1.[C@@H]16CN3CCO1.c15ccccc1F.C3(=O)CCC4.C7O.O45
|
NC[C@@H]1CC[C@@H]1C(=O)N1CCC[C@@H](C(=O)N2CCNCC2)C1
|
NC[C@@H]CC[C@@H]4C=O)NCCC[C@@H]C=O)NCCNCC6)))))))C6
|
[N][C][C@@H1][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][=N][C][=Branch1][C][=O][N][C][C][N][C][C][Ring1][=Branch1][C][Ring1][=C]
|
N13CCC[C@@H]6C1.N14CCNCC1.[C@@H]17CC[C@@H]15.C35=O.C46=O.NC7
|
C[S@+]([O-])CCC(=O)NCCN1CCN(C(=O)c2ccc3c(c2)COC(=O)N3)CC1
|
C[S@+][O-])CCC=O)NCCNCCNC=O)cccccc6)COC=O)N6))))))))))CC6
|
[C][S@+1][Branch1][C][O-1][C][C][C][=Branch1][C][=O][N][C][C][N][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][O][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][Ring2][Ring1][Ring1]
|
c18ccc2c(c1)COC(=O)N2.C[S@+]([O-])CCC4=O.N17CCN5CC1.C6C7.C58=O.N46
|
CC(C)N1C(=O)CC[C@H]1C(=O)N[C@@H]1C[C@@H](C)N(C(=O)c2ccc(F)c(C#N)c2)C1
|
CCC)NC=O)CC[C@H]5C=O)N[C@@H]C[C@@H]C)NC=O)ccccF)cC#N))c6)))))))C5
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Branch1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][Ring1][C][#N][=C][Ring1][=Branch2][C][Ring1][P]
|
c17ccc(F)c(C#N)c1.N18C(=O)CC[C@H]16.[C@@H]15C[C@@H](C)N4C1.CC8C.C36=O.C47=O.N35
|
CCOc1ccc(C(=O)N2C[C@@H](CN=c3[nH]cnc(Cl)c3Br)C[C@@H]2C)cn1
|
CCOccccC=O)NC[C@@H]CN=c[nH]cncCl)c6Br)))))))))C[C@@H]5C)))))))cn6
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#C][C][N][=C][NH1][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][Br][C][C@@H1][Ring1][#C][C][C][=N][Ring2][Ring1][Branch2]
|
C8N=c1[nH]cnc(Cl)c1Br.c16ccc7cn1.N14C[C@@H]8C[C@@H]1C.C47=O.CC5.O56
|
CC[C@H](C(=O)NC(C)(C)CN1CCN(C(=O)c2cc(Cl)ncc2F)CC1)N(C)C
|
CC[C@H]C=O)NCC)C)CNCCNC=O)cccCl)ncc6F))))))))CC6))))))))))NC)C
|
[C][C][C@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][F][C][C][Ring1][S][N][Branch1][C][C][C]
|
c18cc(Cl)ncc1F.N17CCN4CC1.CC[C@@H]5C3=O.C6(C)(C)C7.C48=O.N5(C)C.N36
|
CCO[C@@H](C(=O)NC1CC(C)(NC(=O)Cn2ccnc2C)C1)C1CC1
|
CCO[C@@H]C=O)NCCCC)NC=O)Cnccnc5C)))))))))C4))))))CCC3
|
[C][C][O][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][N][C][=C][N][=C][Ring1][Branch1][C][C][Ring1][#C][C][C][C][Ring1][Ring1]
|
C18CC7(C)C1.n19ccnc1C.[C@@H]6%10C3=O.C4(=O)C9.C1%10CC1.CC5.O56.N38.N47
|
CCN(CCNC(=O)C1=CCC(F)(F)CC1)C(=O)CCc1cccc(OC)c1F
|
CCNCCNC=O)C=CCCF)F)CC6))))))))))C=O)CCcccccOC))c6F
|
[C][C][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][F]
|
C2(=O)C1=CCC(F)(F)CC1.c18cccc4c1F.C3(=O)CC8.N356.C6C7.CC5.N27.O4C
|
Cc1cncnc1N1CC[C@@H](NC(=O)C2(Br)CC2)[C@@H](O)C1
|
Cccncnc6NCC[C@@H]NC=O)CBr)CC3)))))[C@@H]O)C6
|
[C][C][=C][N][=C][N][=C][Ring1][=Branch1][N][C][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][Br][C][C][Ring1][Ring2][C@@H1][Branch1][C][O][C][Ring1][=C]
|
N14CC[C@@H]5[C@@H](O)C1.Cc1cncnc14.C16(Br)CC1.C36=O.N35
|
C[C@H]1CC(C(=O)N2CCC([C@@H]3C[C@H]3NC(=O)c3ccccc3Br)CC2)=NO1
|
C[C@H]CCC=O)NCCC[C@@H]C[C@H]3NC=O)cccccc6Br))))))))))))CC6)))))))=NO5
|
[C][C@H1][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][C@@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][C][C][Ring2][Ring1][Ring1][=N][O][Ring2][Ring1][#Branch2]
|
N14CCC([C@@H]2C[C@H]26)CC1.C[C@H]1CC(C4=O)=NO1.c17ccccc1Br.C57=O.N56
|
COCC=CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(C)c(C)[nH]1)C[C@H](C)O2
|
COCC=CC=O)NCC[C@@]C5)CNC=O)cccC)cC)[nH]5))))))C[C@H]C)O6
|
[C][O][C][C][=C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][NH1][Ring1][#Branch1][C][C@H1][Branch1][C][C][O][Ring1][P]
|
N13CC[C@@]2(C1)CN4C[C@H](C)O2.c16cc(C)c(C)[nH]1.C=7C3=O.C5C=7.C46=O.CO5
|
CC(=O)O[C@@H](C)C(=O)N1CCOC[C@H]1CCNC(=O)C[C@@H]1C=CCCC1
|
CC=O)O[C@@H]C)C=O)NCCOC[C@H]6CCNC=O)C[C@@H]C=CCCC6
|
[C][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][C@@H1][C][=C][C][C][C][Ring1][=Branch1]
|
N13CCOC[C@H]17.[C@@H]18C=CCCC1.[C@H]5(C)C3=O.C4(=O)C8.CC2=O.C7C6.O25.N46
|
CC=CCCC(=O)N1CCCC[C@H](CNC(=O)c2ccc(C(F)(F)F)cc2C)C1
|
CC=CCCC=O)NCCCC[C@H]CNC=O)ccccCF)F)F))cc6C))))))))))C7
|
[C][C][=C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][C][Ring2][Ring1][=Branch1]
|
N13CCCC[C@H]8C1.c16ccc9cc1C.C=7CCC3=O.C9(F)(F)F.C46=O.CC=7.C58.N45
|
CC[C@@H]1CN(C(=O)[C@H](F)C2CCC2)CC[C@@H]1NC(=O)CCn1cccn1
|
CC[C@@H]CNC=O)[C@H]F)CCCC4))))))CC[C@@H]6NC=O)CCncccn5
|
[C][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][C][C][C][Ring1][Ring2][C][C][C@@H1][Ring1][=C][N][C][=Branch1][C][=O][C][C][N][C][=C][C][=N][Ring1][Branch1]
|
[C@@H]17CN3CC[C@@H]15.C3(=O)[C@@H]8F.C4(=O)CC6.n16cccn1.C18CCC1.CC7.N45
|
Cc1ccc(CN=c2nc3sccc3c(NCCCc3scnc3C)[nH]2)cc1F
|
CccccCN=cncsccc5cNCCCcscnc5C))))))))))[nH]9)))))))))))cc6F
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][N][=C][N][=C][S][C][=C][C][Ring1][Branch1][=C][Branch1][=N][N][C][C][C][C][S][C][=N][C][=Ring1][Branch1][C][NH1][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][O][F]
|
C7N=c1nc2sccc2c5[nH]1.Cc1ccc7cc1F.c16scnc1C.C4CC6.N45
|
CC(C)(C)[C@@H](C#N)C(=O)N1C[C@@H]2[C@H](C1)[C@H]2C(=O)NCCCN1CC[C@@H](O)C1
|
CCC)C)[C@@H]C#N))C=O)NC[C@@H][C@H]C5)[C@H]3C=O)NCCCNCC[C@@H]O)C5
|
[C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][Ring1][C][#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][C][C][N][C][C][C@@H1][Branch1][C][O][C][Ring1][=Branch1]
|
CC(C)(C)[C@@H](C#N)C3=O.N13C[C@@H]2[C@@H]7[C@@H]2C1.N16CC[C@@H](O)C1.C5CC6.C47=O.N45
|
O=C(Nc1ccc2nsnc2c1)[C@H]1C[C@H](F)CN1C(=O)c1ccc(=O)oc1
|
O=CNccccnsnc5c9))))))))))[C@H]C[C@H]F)CN5C=O)cccc=O)oc6
|
[O][=C][Branch1][#C][N][C][C][=C][C][=N][S][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C@H1][C][C@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][O][C][=Ring1][#Branch1]
|
c15ccc2nsnc2c1.[C@H]16C[C@H](F)CN14.c17ccc(=O)oc1.O=C36.C47=O.N35
|
C[C@@H](CNC(=O)C1=C(F)CN(C(=O)c2ccc(C#N)cc2)CC1)C(F)F
|
C[C@@H]CNC=O)C=CF)CNC=O)ccccC#N))cc6)))))))CC6)))))))))CF)F
|
[C][C@@H1][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][C][Ring1][P][C][Branch1][C][F][F]
|
C3(=O)C1=C(F)CN4CC1.c16ccc(C#N)cc1.C[C@@H](C5)C(F)F.C46=O.N35
|
C=C/C(C)=C\C(=O)N[C@H]1CCC[C@@H](NC(=O)c2ccc3c(c2)OCC3)C1
|
C=C/CC)=C\C=O)N[C@H]CCC[C@@H]NC=O)cccccc6)OCC5))))))))))C6
|
[C][=C][/C][Branch1][C][C][=C][\C][=Branch1][C][=O][N][C@H1][C][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
c18ccc2c(c1)OCC2.[C@H]16CCC[C@@H]7C1.C=CC=9C.C=9C4=O.C58=O.N46.N57
|
CC(C)=C(F)C(=O)N[C@@H]1CN(C(=O)c2c[nH]c3ccc(F)cc23)CC[C@H]1O
|
CCC)=CF)C=O)N[C@@H]CNC=O)cc[nH]ccccF)cc96))))))))))CC[C@H]6O
|
[C][C][Branch1][C][C][=C][Branch1][C][F][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][C][C@H1][Ring2][Ring1][C][O]
|
c17c[nH]c2ccc(F)cc12.[C@@H]16CN5CC[C@H]1O.C=8(F)C4=O.CC=8C.C57=O.N46
|
C#CC[C@@H](C)C(=O)N[C@@H]1COC2(C1)CN(C(=O)c1cc(C)n(C3CC3)n1)C2
|
C#CC[C@@H]C)C=O)N[C@@H]COCC5)CNC=O)cccC)nCCC3)))n5))))))C4
|
[C][#C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][=Ring1][=Branch2][C][Ring1][S]
|
[C@@H]16COC2(C1)CN5C2.C#CC[C@@H](C)C4=O.c17cc(C)n8n1.C57=O.C18CC1.N46
|
C=C1CC(C(=O)N2CC[C@@]3(CCN(C(=O)[C@]45CC[C@H](CC4=O)C5(C)C)C3)C2)C1
|
C=CCCC=O)NCC[C@@]CCNC=O)[C@]CC[C@H]CC6=O)))C5C)C)))))))C5))))C5))))))C4
|
[C][=C][C][C][Branch2][Ring2][#C][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][S][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@][C][C][C@H1][Branch1][=Branch1][C][C][Ring1][=Branch1][=O][C][Ring1][Branch2][Branch1][C][C][C][C][Ring1][P][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][O]
|
N16CC[C@@]2(CCN7C2)C1.[C@]129CC[C@H](CC1=O)C2(C)C.C=C1CC8C1.C68=O.C79=O
|
CC[C@@H](C(=O)NC(C)(C)CCNC(=O)CCc1c[nH]c2cc(C)ccc12)[C@@H](C)O
|
CC[C@@H]C=O)NCC)C)CCNC=O)CCcc[nH]cccC)ccc96))))))))))))))))))[C@@H]C)O
|
[C][C][C@@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][C][=C][NH1][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C@@H1][Branch1][C][C][O]
|
c17c[nH]c2cc(C)ccc12.CC[C@@H](C3=O)[C@@H](C)O.C5(C)(C)CC6.C4(=O)CC7.N35.N46
|
C=CC/C=C/CCC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(C(=O)CNC(=O)CCC)C[C@H]21
|
C=CC/C=C/CCC=O)NC[C@H]CC[C@H]6[C@@H]CNC=O)CNC=O)CCC)))))))C[C@H]95
|
[C][=C][C][/C][=C][/C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Ring1][=Branch1][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][C][C@H1][Ring2][Ring1][C][Ring1][=C]
|
N13C[C@H]2CC[C@H]1[C@@H]1CN4C[C@H]21.C=7CCC3=O.C5(=O)CCC.C=CCC=7.C4(=O)C6.N56
|
O=C(c1ccc(O)cc1)N1CC2=C(C1)CN(C(=O)c1c[nH]nc1C(F)F)C2
|
O=CccccO)cc6))))))NCC=CC5)CNC=O)cc[nH]nc5CF)F))))))))C5
|
[O][=C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][C][=C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C][Branch1][C][F][F][C][Ring1][S]
|
N13CC2=C(C1)CN4C2.c15ccc(O)cc1.c16c[nH]nc17.O=C35.C46=O.C7(F)F
|
CN1CC[C@@H](C(=O)N2CCN(C(=O)c3nn(C)c(Cl)c3Cl)C[C@H](O)C2)C1=O
|
CNCC[C@@H]C=O)NCCNC=O)cnnC)cCl)c5Cl)))))))C[C@H]O)C7))))))))C5=O
|
[C][N][C][C][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][C@H1][Branch1][C][O][C][Ring2][Ring1][C][C][Ring2][Ring1][=Branch2][=O]
|
N14CCN5C[C@H](O)C1.c16nn(C)c(Cl)c1Cl.CN1CC[C@@H]7C1=O.C47=O.C56=O
|
CC1CC(C(=O)NCCCN(CCO)C(=O)CN2CCC(C(N)=O)CC2)C1
|
CCCCC=O)NCCCNCCO)))C=O)CNCCCCN)=O))CC6))))))))))))))C4
|
[C][C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C][N][C][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2][C][Ring2][Ring1][#Branch2]
|
N18CCC%10CC1.CC1CC9C1.C5CC6.C4(=O)C8.C39=O.N467.C7CO.C%10(N)=O.N35
|
C=CC[C@]1(NC(=O)CCc2cnn[nH]2)CCCN(C(=O)[C@]2(C)CCCNC2=O)C1
|
C=CC[C@]NC=O)CCccnn[nH]5)))))))))CCCNC=O)[C@]C)CCCNC6=O))))))))C6
|
[C][=C][C][C@][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][=C][N][=N][NH1][Ring1][Branch1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][N][C][Ring1][#Branch1][=O][C][Ring2][Ring1][#Branch2]
|
[C@]158CCCN4C1.[C@@]16(C)CCCNC1=O.C3(=O)CC7.c17cnn[nH]1.C=CC8.C46=O.N35
|
Cn1cc([N+](=O)[O-])cc1C(=O)NCC1=NO[C@@H]2CN(C(=O)C3(CF)COC3)C[C@@H]12
|
Cncc[N+]=O)[O-]))cc5C=O)NCC=NO[C@@H]CNC=O)CCF))COC4)))))C[C@@H]85
|
[C][N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][=N][O][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][O][C][Ring1][=Branch1][C][C@@H1][Ring1][S][Ring1][=N]
|
C6C1=NO[C@@H]2CN5C[C@@H]12.Cn1cc([N+](=O)[O-])cc17.C189COC1.C47=O.C58=O.N46.C9F
|
C[C@]1(CNC(=O)C2=CCOCC2)CCCN1C(=O)c1ccc2c(n1)CCOC2
|
C[C@]CNC=O)C=CCOCC6)))))))))CCCN5C=O)cccccn6)CCOC6
|
[C][C@][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][O][C][C][Ring1][=Branch1][C][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][C][C][O][C][Ring1][#Branch1]
|
c16ccc2c(n1)CCOC2.C3(=O)C1=CCOCC1.C[C@]17CCCN14.C46=O.C57.N35
|
Cc1nc(O)cc(C(=O)N2CC[C@]3(CCCN3C(=O)[C@@H]3C[C@H]3F)C2)n1
|
CcncO)ccC=O)NCC[C@]CCCN5C=O)[C@@H]C[C@H]3F)))))))))C5))))))n6
|
[C][C][=N][C][Branch1][C][O][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C@][Branch1][P][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][F][C][Ring1][#C][=N][Ring2][Ring1][Branch2]
|
N14CC[C@]2(CCCN25)C1.Cc1nc6cc(O)n1.[C@@H]17C[C@H]1F.C46=O.C57=O
|
CCc1cnoc1C(=O)N1CCSC[C@@H]1CCNC(=O)[C@H](OC)c1ccccc1
|
CCccnoc5C=O)NCCSC[C@@H]6CCNC=O)[C@H]OC))cccccc6
|
[C][C][C][C][=N][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][S][C][C@@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
N12CCSC[C@@H]17.c18cnoc16.c19ccccc1.C3(=O)[C@H]49.C26=O.C7C5.CC8.N35.O4C
|
O=C(COC1CC(F)(F)C1)NC1CCN([C@@H]2CCN(C(=O)[C@H](O)C3CC3)C2)CC1
|
O=CCOCCCF)F)C4))))))NCCCN[C@@H]CCNC=O)[C@H]O)CCC3)))))C5)))))CC6
|
[O][=C][Branch1][#C][C][O][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][N][C][C][C][N][Branch2][Ring1][#Branch1][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][Ring1][Ring1][C][Ring1][N][C][C][Ring2][Ring1][C]
|
C18CCN9CC1.C17CC(F)(F)C1.[C@@H]19CCN5C1.C5(=O)[C@@H]%10O.O=C4C6.C1%10CC1.O67.N48
|
Cc1ocnc1C(=O)N1C[C@H](CNC(=O)c2ccc(S(N)(=O)=O)o2)[C@H]2C[C@H]21
|
Ccocnc5C=O)NC[C@H]CNC=O)ccccSN)=O)=O))o5))))))))[C@H]C[C@H]36
|
[C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][O][Ring1][=Branch2][C@H1][C][C@H1][Ring1][Ring1][Ring2][Ring1][Ring1]
|
c17ccc(S(N)(=O)=O)o1.N13C[C@H]8[C@H]2C[C@H]21.Cc1ocnc16.C36=O.C47=O.C58.N45
|
CCNC(=O)CC(=O)NC(C)(C)CCNC(=O)c1ccc(OC)c(Cl)n1
|
CCNC=O)CC=O)NCC)C)CCNC=O)ccccOC))cCl)n6
|
[C][C][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][C][Cl][=N][Ring1][=Branch2]
|
c19ccc5c(Cl)n1.C2(=O)CC3=O.C7(C)(C)CC8.C49=O.CC6.N26.N37.N48.O5C
|
Cn1cnnc1CC(=O)N1CC[C@@H](NC(=O)CC2CCC(F)(F)CC2)[C@@H]1C1CC1
|
Cncnnc5CC=O)NCC[C@@H]NC=O)CCCCCF)F)CC6)))))))))[C@@H]5CCC3
|
[C][N][C][=N][N][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C@@H1][Ring1][P][C][C][C][Ring1][Ring1]
|
C17CCC(F)(F)CC1.N13CC[C@@H]5[C@@H]18.Cn1cnnc16.C6C3=O.C4(=O)C7.C18CC1.N45
|
CCC(CC)CCCC(=O)N1C[C@@H](C(F)(F)F)C[C@H]1CNC(=O)C(F)(F)[C@@H](C)O
|
CCCCC))CCCC=O)NC[C@@H]CF)F)F))C[C@H]5CNC=O)CF)F)[C@@H]C)O
|
[C][C][C][Branch1][Ring1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C@H1][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C@@H1][Branch1][C][C][O]
|
CCC(CC)CCCC2=O.C3(=O)C(F)(F)[C@@H](C)O.N12C[C@@H]6C[C@H]15.C6(F)(F)F.C45.N34
|
C=C[C@H]1CCC[C@H](Nc2ccc(S(=O)(=O)N[C@@H](C)c3cn(C)nn3)cc2F)C1
|
C=C[C@H]CCC[C@H]NccccS=O)=O)N[C@@H]C)ccnC)nn5))))))))cc6F))))))))C6
|
[C][=C][C@H1][C][C][C][C@H1][Branch2][Ring2][Branch1][N][C][=C][C][=C][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1][C][=C][Ring2][Ring1][C][F][C][Ring2][Ring1][#Branch2]
|
c16ccc(S5(=O)=O)cc1F.C=C[C@H]1CCC[C@H]7C1.c18cn(C)nn1.[C@@H]48C.N67.N45
|
O=C1C[C@H]2C[C@@H]1C[C@H]2C(=O)NCc1cc(C2CC2)n[nH]1
|
O=CC[C@H]C[C@@H]5C[C@H]5C=O)NCcccCCC3)))n[nH]5
|
[O][=C][C][C@H1][C][C@@H1][Ring1][Branch1][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][NH1][Ring1][Branch2]
|
O=C1C[C@H]2C[C@@H]1C[C@H]25.c16cc7n[nH]1.C35=O.C17CC1.N34.C46
|
COCc1ccoc1C(=O)NC[C@@H](Nc1nc(OC)ccc1[N+](=O)[O-])C1CCC1
|
COCcccoc5C=O)NC[C@@H]NcncOC))ccc6[N+]=O)[O-])))))))))CCCC4
|
[C][O][C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring1][N][C][=N][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][Branch2][N+1][=Branch1][C][=O][O-1][C][C][C][C][Ring1][Ring2]
|
c17nc4ccc1[N+](=O)[O-].c1%10ccoc18.C5[C@@H]69.C19CCC1.C28=O.CO3.C3%10.N25.N67.O4C
|
CCOCc1nc(C)c(C(=O)NC[C@H](O)CNC(=O)[C@H]2CS(=O)(=O)CC23CC3)s1
|
CCOCcncC)cC=O)NC[C@H]O)CNC=O)[C@H]CS=O)=O)CC5CC3))))))))))))))s5
|
[C][C][O][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C@H1][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][#Branch1][C][C][Ring1][Ring1][S][Ring2][Ring1][=Branch2]
|
[C@H]1%11CS(=O)(=O)CC12CC2.c1%12nc(C)c%10s1.C8[C@H](O)C9.C4%10=O.C5%11=O.CC6.O67.C7%12.N48.N59
|
Cc1cc(C2(C(=O)N3CC4(CCN(C(=O)C5=CCCCO5)CC4)C3)CC2)on1
|
CcccCC=O)NCCCCNC=O)C=CCCCO6)))))))CC6)))))C4)))))CC3)))on5
|
[C][C][C][=C][Branch2][Ring2][N][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][C][C][O][Ring1][=Branch1][C][C][Ring1][=C][C][Ring1][P][C][C][Ring2][Ring1][=Branch1][O][N][=Ring2][Ring1][O]
|
N16CC2(CCN7CC2)C1.C7(=O)C1=CCCCO1.Cc1cc9on1.C189CC1.C68=O
|
C=CCSCC(=O)N1C[C@@H](C)CN(C(=O)c2ccc(Br)cc2C)[C@H](C)C1
|
C=CCSCC=O)NC[C@@H]C)CNC=O)ccccBr)cc6C))))))))[C@H]C)C7
|
[C][=C][C][S][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C@H1][Branch1][C][C][C][Ring2][Ring1][Ring1]
|
N13C[C@@H](C)CN4[C@H](C)C1.c17ccc(Br)cc1C.C6C3=O.C=CC5.C47=O.S56
|
Cn1ccc(C(=O)N2CCSC[C@@H]2C(=O)N2CCCNC(=O)C2)cc1=O
|
CncccC=O)NCCSC[C@@H]6C=O)NCCCNC=O)C7)))))))))))))))cc6=O
|
[C][N][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][S][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][Ring1][Branch2][=C][C][Ring2][Ring1][Branch2][=O]
|
Cn1ccc6cc1=O.N14CCCNC(=O)C1.N13CCSC[C@@H]15.C36=O.C45=O
|
COC[C@H](C)C(=O)NCc1nnc2n1CCN(C(=O)c1cscc1S(C)(=O)=O)C2
|
COC[C@H]C)C=O)NCcnncn5CCNC=O)ccscc5SC)=O)=O))))))))C6
|
[C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=N][N][=C][N][Ring1][Branch1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][P]
|
c18nnc2n1CCN4C2.c17cscc1S(C)(=O)=O.C5[C@H](C)C3=O.C47=O.CO5.N36.C68
|
O=C(N[C@@H](CNC(=O)[C@@H](CO)c1ccccc1)C1CC1)C1=CCCCO1
|
O=CN[C@@H]CNC=O)[C@@H]CO))cccccc6))))))))))CCC3)))))C=CCCCO6
|
[O][=C][Branch2][Ring1][=C][N][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][=C][C][C][C][O][Ring1][=Branch1]
|
O=C2C1=CCCCO1.C3(=O)[C@H]7CO.c17ccccc1.[C@@H]46C5.C16CC1.N24.N35
|
CC(=O)N(C)CCCC(=O)N(C)CC1(NC(=O)[C@H]2CN3CCC[C@H]3CO2)CC1
|
CC=O)NC)CCCC=O)NC)CCNC=O)[C@H]CNCCC[C@H]5CO9)))))))))))CC3
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][N][C][C][C][C@H1][Ring1][Branch1][C][O][Ring1][=Branch2][C][C][Ring1][#C]
|
[C@H]1%10CN2CCC[C@H]2CO1.C7CCC5=O.C19%11CC1.CC4=O.N47C.N58C.C6%10=O.C8%11.N69
|
COc1ccc([N+](=O)[O-])cc1CN=c1cccc(S(=O)(=O)N2C[C@@H]3[C@@H](C)[C@@H]3C2)[nH]1
|
COcccc[N+]=O)[O-]))cc6CN=cccccS=O)=O)NC[C@@H][C@@H]C)[C@@H]3C6)))))))[nH]6
|
[C][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][N][=C][C][=C][C][=C][Branch2][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@@H1][C@@H1][Branch1][C][C][C@@H1][Ring1][Ring2][C][Ring1][#Branch1][NH1][Ring1][S]
|
C6N=c1cccc(S5(=O)=O)[nH]1.c14ccc([N+](=O)[O-])cc16.N15C[C@@H]2[C@@H](C)[C@@H]2C1.CO4
|
COC[C@H](Cc1ccc(Cl)cc1)C(=O)NC[C@H](C)CNC(=O)CCOCC(C)C
|
COC[C@H]CccccCl)cc6)))))))C=O)NC[C@H]C)CNC=O)CCOCCC)C
|
[C][O][C][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][O][C][C][Branch1][C][C][C]
|
C4[C@H](C9)C2=O.c19ccc(Cl)cc1.C7[C@H](C)C8.C3(=O)CC5.C6C(C)C.CO4.N27.N38.O56
|
COCC[C@H](CNC(=O)C=Cc1ccccn1)NC(=O)Cc1n[nH]cc1Br
|
COCC[C@H]CNC=O)C=Ccccccn6)))))))))))NC=O)Ccn[nH]cc5Br
|
[C][O][C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=N][NH1][C][=C][Ring1][Branch1][Br]
|
C=7c1ccccn1.C4C[C@@H]5C6.c18n[nH]cc1Br.C2(=O)C=7.C3(=O)C8.CO4.N26.N35
|
CCc1ncc(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)C(C)(C)c2cccnc2)s1
|
CCcnccC=O)N[C@@H]CCOC[C@@H]6NC=O)CC)C)ccccnc6)))))))))))))))))s5
|
[C][C][C][=N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C][O][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][S][Ring2][Ring1][#Branch2]
|
[C@@H]15CCOC[C@@H]16.c18ncc7s1.C4(=O)C9(C)C.c19cccnc1.C37=O.CC8.N35.N46
|
C=CC1(CC(=O)N2C[C@H]3C[C@H]2CC3=C)CN(C(=O)[C@@H]2[C@@H]3CC[C@H](F)[C@@H]32)C1
|
C=CCCC=O)NC[C@H]C[C@H]5CC5=C))))))))))CNC=O)[C@@H][C@@H]CC[C@H]F)[C@@H]56)))))))C4
|
[C][=C][C][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][C][Ring1][Branch1][=C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C@@H1][C][C][C@H1][Branch1][C][F][C@@H1][Ring1][=Branch1][Ring1][#Branch1][C][Ring2][Ring1][Branch2]
|
N14C[C@H]2C[C@H]1CC2=C.C=CC17CN5C1.[C@@H]16[C@@H]2CC[C@H](F)[C@H]12.C7C4=O.C56=O
|
CCC(=CC(=O)NCCN(CCOCCO)C(=O)c1nn(C)cc1SC)CC
|
CCC=CC=O)NCCNCCOCCO))))))C=O)cnnC)cc5SC))))))))))))))CC
|
[C][C][C][=Branch2][Ring2][C][=C][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C][O][C][C][O][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][S][C][C][C]
|
c1%10nn(C)cc13.CCC=%11CC.C=%11C2=O.C7C8.N489.C9C5.C6CO.C4%10=O.N27.O56.S3C
|
CCCc1cc(C(=O)N(C)C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3F)C2)ccc1Cl
|
CCCcccC=O)NC)C[C@@H]CCNC=O)[C@@H]C[C@H]3F)))))C5))))))))ccc6Cl
|
[C][C][C][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][C][N][Branch1][O][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][F][C][Ring1][O][=C][C][=C][Ring2][Ring1][=Branch1][Cl]
|
c1%10cc8ccc1Cl.[C@@H]19CCN5C1.[C@@H]17C[C@H]1F.CCC%10.C48=O.N46C.C57=O.C69
|
C=CCCC(=O)N1CCC[C@H]1C(C)(C)NC(=O)CC1(n2cccn2)CC1
|
C=CCCC=O)NCCC[C@H]5CC)C)NC=O)CCncccn5)))))CC3
|
[C][=C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][C][C][Ring1][Branch2]
|
C=CCCC3=O.N13CCC[C@H]16.n18cccn1.C56(C)C.C4(=O)C7.C178CC1.N45
|
CCCC[C@H](F)C(=O)N1CC[C@@]2(CCCCN(C(=O)C(C)(C)[C@@H]3CCOC3)C2)C1
|
CCCC[C@H]F)C=O)NCC[C@@]CCCCNC=O)CC)C)[C@@H]CCOC5)))))))C7))))))C5
|
[C][C][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][=C][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring1][P][C][Ring2][Ring1][Branch1]
|
N14CC[C@@]2(CCCCN5C2)C1.CCCC[C@H](F)C4=O.C5(=O)C6(C)C.[C@@H]16CCOC1
|
CCN(C[C@@H]1CCCN(C(=O)Cn2nnc(=N)[nH]2)C1)C(=O)CCC1(C)CC1
|
CCNC[C@@H]CCCNC=O)Cnnnc=N)[nH]5)))))))C6)))))))C=O)CCCC)CC3
|
[C][C][N][Branch2][Ring1][O][C][C@@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][N][N][=N][C][=Branch1][C][=N][NH1][Ring1][=Branch1][C][Ring1][#C][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][C][Ring1][Ring2]
|
[C@@H]18CCCN3C1.n17nnc(=N)[nH]1.C4(=O)CC9.C3(=O)C7.C19(C)CC1.N456.CC5.C68
|
CC(C)COCCc1nc(-c2ccco2)nn1[C@@H](C)c1ccc(Br)cc1
|
CCC)COCCcnc-cccco5)))))nn5[C@@H]C)ccccBr)cc6
|
[C][C][Branch1][C][C][C][O][C][C][C][=N][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][N][Ring1][#Branch2][C@@H1][Branch1][C][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1]
|
c16nc8nn15.c17ccc(Br)cc1.c18ccco1.CC(C)C3.C4C6.[C@@H]57C.O34
|
CCOc1ccc(C(=O)NC[C@@H]2C=CCN2C(=O)[C@@H](C)NC(C)=O)cc1Cl
|
CCOccccC=O)NC[C@@H]C=CCN5C=O)[C@@H]C)NCC)=O)))))))))))))cc6Cl
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][Branch1][C][C][=O][C][=C][Ring2][Ring1][#Branch1][Cl]
|
c17ccc%10cc1Cl.[C@@H]1%11C=CCN14.C4(=O)[C@H]9C.C3%10=O.C5(C)=O.CC6.O67.N38.C8%11.N59
|
CCc1c(C)cccc1C(=O)N[C@@H]1C[C@H](CNC(=O)Cc2ccno2)C1(C)C
|
CCccC)cccc6C=O)N[C@@H]C[C@H]CNC=O)Ccccno5)))))))))C4C)C
|
[C][C][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][=C][C][=N][O][Ring1][Branch1][C][Ring1][=C][Branch1][C][C][C]
|
c1%10c7cccc1C.[C@@H]16C[C@H]9C1(C)C.c18ccno1.C4(=O)C8.C37=O.CC%10.N36.C59.N45
|
CN(CCCNC(=O)C[C@H]1CCc2ncc(Br)n2C1)C(=O)[C@@H]1CCC(=O)N1
|
CNCCCNC=O)C[C@H]CCcnccBr)n5C9)))))))))))))))C=O)[C@@H]CCC=O)N5
|
[C][N][Branch2][Ring1][#Branch2][C][C][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][=N][C][=C][Branch1][C][Br][N][Ring1][=Branch1][C][Ring1][#Branch2][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1]
|
[C@H]18CCc2ncc(Br)n2C1.[C@@H]17CCC(=O)N1.C5CC6.C3(=O)C8.CN45.C47=O.N36
|
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