SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
C[C@H]1O[C@H]2CC[C@@]1(C(=O)NCCN(C)C(=O)c1ccsc1)C2
|
C[C@H]O[C@H]CC[C@@]6C=O)NCCNC)C=O)cccsc5)))))))))))C5
|
[C][C@H1][O][C@H1][C][C][C@@][Ring1][=Branch1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
C[C@H]1O[C@H]2CC[C@@]17C2.c18ccsc1.C37=O.C5C6.N46C.C48=O.N35
|
Cc1[nH]c2ccc(Br)cc2c1C(=O)COC(=O)C1=NOC2(COC2)C1
|
Cc[nH]ccccBr)cc6c9C=O)COC=O)C=NOCCOC4)))C5
|
[C][C][NH1][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][C][=Branch1][C][=O][C][O][C][=Branch1][C][=O][C][=N][O][C][Branch1][=Branch1][C][O][C][Ring1][Ring2][C][Ring1][Branch2]
|
Cc1[nH]c2ccc(Br)cc2c15.C3(=O)C1=NOC2(COC2)C1.C5(=O)C4.O34
|
Nc1ccc(CNC(=O)Cc2csc([C@H]3CCS(=O)(=O)C3)n2)c(C(=O)O)c1
|
NccccCNC=O)Cccsc[C@H]CCS=O)=O)C5)))))n5)))))))))cC=O)O))c6
|
[N][C][=C][C][=C][Branch2][Ring1][=C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][=C][C@H1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1][=N][Ring1][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring2][Ring1][#Branch2]
|
Nc1ccc8c6c1.[C@H]19CCS(=O)(=O)C1.c17csc9n1.C4(=O)C7.C6(=O)O.C58.N45
|
Cc1cccc(C(=O)N2CCOC[C@@H]2CNC(=O)c2cn[nH]c2)c1C
|
CcccccC=O)NCCOC[C@@H]6CNC=O)ccn[nH]c5)))))))))))))))c6C
|
[C][C][=C][C][=C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][=N][NH1][C][=Ring1][Branch1][=C][Ring2][Ring1][#Branch1][C]
|
Cc1cccc6c1C.N13CCOC[C@@H]18.c17cn[nH]c1.C36=O.C47=O.C58.N45
|
CCCCS(=O)(=O)CC(=O)N[C@H]1CCCN(C(=O)CCCN2CCCC2)CC1
|
CCCCS=O)=O)CC=O)N[C@H]CCCNC=O)CCCNCCCC5)))))))))CC7
|
[C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][N][C][C][C][C][Ring1][Branch1][C][C][Ring1][P]
|
CCCCS(=O)(=O)CC3=O.[C@H]16CCCN4CC1.C4(=O)CCC5.N15CCCC1.N36
|
CC1(C)[C@H](NC(=O)CCc2cccnc2)CCN1C(=O)C1=C[C@H](O)CCC1
|
CCC)[C@H]NC=O)CCccccnc6))))))))))CCN5C=O)C=C[C@H]O)CCC6
|
[C][C][Branch1][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][N][Ring1][P][C][=Branch1][C][=O][C][=C][C@H1][Branch1][C][O][C][C][C][Ring1][#Branch1]
|
C4(=O)C1=C[C@H](O)CCC1.CC1(C)[C@H]5CCN14.c16cccnc1.C3(=O)CC6.N35
|
CC[S@@+]([O-])CC(=O)N[C@H]1COCC[C@H]1NC(=O)c1cc(C)c(-c2ccccc2)s1
|
CC[S@@+][O-])CC=O)N[C@H]COCC[C@H]6NC=O)cccC)c-cccccc6))))))s5
|
[C][C][S@@+1][Branch1][C][O-1][C][C][=Branch1][C][=O][N][C@H1][C][O][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][N]
|
CC[S@@+]([O-])CC3=O.[C@H]15COCC[C@H]16.c17cc(C)c8s1.c18ccccc1.C47=O.N35.N46
|
CCC(CC)[C@H](NC(=O)N(CCO)[C@@H]1CCC[C@H]1C)c1ccccc1
|
CCCCC))[C@H]NC=O)NCCO)))[C@@H]CCC[C@H]5C)))))))))cccccc6
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CCC(CC)[C@H]47.[C@@H]16CCC[C@H]1C.c17ccccc1.C23=O.N356.C5CO.N24
|
C[C@H]1CC[C@@H](C(=O)NC[C@@H](O)C2CCCCC2)N1C(=O)[C@H]1[C@@H]2CCC[C@@H]21
|
C[C@H]CC[C@@H]C=O)NC[C@@H]O)CCCCCC6))))))))))N5C=O)[C@H][C@@H]CCC[C@@H]56
|
[C][C@H1][C][C][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C][C][C][C][C][Ring1][=Branch1][N][Ring1][P][C][=Branch1][C][=O][C@H1][C@@H1][C][C][C][C@@H1][Ring1][Branch1][Ring1][=Branch1]
|
C[C@H]1CC[C@@H]6N14.C18CCCCC1.[C@@H]17[C@H]2CCC[C@@H]12.C5[C@H]8O.C36=O.C47=O.N35
|
COc1ccc2nc(C(=O)NCCNC(=O)CCc3ccccc3Cl)ccc2c1
|
COccccncC=O)NCCNC=O)CCcccccc6Cl)))))))))))))))ccc6c%10
|
[C][O][C][=C][C][=C][N][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=C][C][Ring2][Ring1][#Branch1][=C][Ring2][Ring1][O]
|
c16ccc2nc9ccc2c1.c1%10ccccc1Cl.C5(=O)CC%10.C49=O.C7C8.CO6.N47.N58
|
Cc1ccc(=O)n(CC(=O)N2CC[C@H](C)N(C(=O)C(=O)NCC3CC3)CC2)c1
|
Ccccc=O)nCC=O)NCC[C@H]C)NC=O)C=O)NCCCC3)))))))CC7)))))))))c6
|
[C][C][C][=C][C][=Branch1][C][=O][N][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][C][Ring1][P][C][=Ring2][Ring1][O]
|
N14CC[C@H](C)N5CC1.Cc1ccc(=O)n8c1.C5(=O)C6=O.C8C4=O.C19CC1.N67.C79
|
CC1(C(=O)NC2CC(c3cn(C[C@](C)(F)C(C)(C)F)nn3)C2)CC2(CC(O)C2)C1
|
CCC=O)NCCCccnC[C@]C)F)CC)C)F))))nn5)))))C4))))))CCCCO)C4)))C4
|
[C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch2][C][=C][N][Branch1][P][C][C@][Branch1][C][C][Branch1][C][F][C][Branch1][C][C][Branch1][C][C][F][N][=N][Ring1][=N][C][Ring1][P][C][C][Branch1][=Branch2][C][C][Branch1][C][O][C][Ring1][Branch1][C][Ring2][Ring1][N]
|
CC16CC2(CC(O)C2)C1.C7[C@](C)(F)C(C)(C)F.c18cn7nn1.C15CC8C1.C46=O.N45
|
O=C(NCc1ncc[nH]1)[C@H]1CN(C(=O)c2cc(O)ccc2F)C2(CCC2)C1
|
O=CNCcncc[nH]5)))))))[C@H]CNC=O)cccO)ccc6F))))))))CCCC4)))C5
|
[O][=C][Branch1][#Branch2][N][C][C][=N][C][=C][NH1][Ring1][Branch1][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][F][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][C]
|
[C@H]16CN4C2(CCC2)C1.c17cc(O)ccc1F.c18ncc[nH]1.O=C36.C47=O.N35.C58
|
CC(=CC1CC1)C(=O)N[C@H](C)[C@H](C)NC(=O)c1cc(C)ccc1N
|
CC=CCCC3))))C=O)N[C@H]C)[C@H]C)NC=O)cccC)ccc6N
|
[C][C][=Branch1][#Branch1][=C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][N]
|
c16cc(C)ccc1N.CC=7C2=O.[C@@H]4(C)[C@@H]5C.C=7C1CC1.C36=O.N24.N35
|
c1cc(=NC2COCCOC2)[nH]c(NCc2ncco2)n1
|
ccc=NCCOCCOC7))))))))[nH]cNCcncco5)))))))n6
|
[C][=C][C][=Branch1][O][=N][C][C][O][C][C][O][C][Ring1][#Branch1][NH1][C][Branch1][#Branch2][N][C][C][=N][C][=C][O][Ring1][Branch1][=N][Ring2][Ring1][Branch1]
|
c1cc(=NC2COCCOC2)[nH]c4n1.c15ncco1.N34.C35
|
CNc1scnc1C(=O)NC1(CCC(=O)NCC2CN(C(N)=O)C2)CCC1
|
CNcscnc5C=O)NCCCC=O)NCCCNCN)=O))C4)))))))))CCC4
|
[C][N][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring1][#Branch1][C][C][C][Ring1][P]
|
c18scnc19.C16%10CCC1.C%10CC4=O.C1%11CN5C1.C39=O.C5(N)=O.CN8.N36.N47.C7%11
|
CCN(C(=O)c1cc(Br)ccc1C)[C@@H]1CCN(C(=O)CCOC2CC2)C1
|
CCNC=O)cccBr)ccc6C))))))))[C@@H]CCNC=O)CCOCCC3)))))))C5
|
[C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][C][C@@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][O][C][C][C][Ring1][Ring1][C][Ring1][=N]
|
c19cc(Br)ccc1C.[C@@H]18CCN4C1.C4(=O)CC5.N378.C39=O.C16CC1.CC7.O56
|
C[C@@H]1CC[C@H](CNC(=O)C=C2CCC2)CN1C(=O)c1nccc2c(F)cccc12
|
C[C@@H]CC[C@H]CNC=O)C=CCCC4))))))))CN6C=O)cnccccF)cccc%106
|
[C][C@@H1][C][C][C@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Ring2][C][N][Ring1][#C][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][O][Ring1][#Branch1]
|
c16nccc2c(F)cccc12.C[C@@H]1CC[C@H]8CN14.C3(=O)C=7.C1=7CCC1.C46=O.C58.N35
|
CC(C)c1ccc(S(=O)(=O)N2C[C@H](O)C[C@H]2C(=O)N[C@@H]2CCC(=O)NC2)cc1
|
CCC)ccccS=O)=O)NC[C@H]O)C[C@H]5C=O)N[C@@H]CCC=O)NC6))))))))))))))cc6
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][C][=C][Ring2][Ring1][=Branch2]
|
c17ccc(S4(=O)=O)cc1.N14C[C@H](O)C[C@H]16.[C@@H]15CCC(=O)NC1.CC7C.C36=O.N35
|
CCC(F)(F)CN(C)[C@H](C(=O)NCc1nnn(C)n1)c1nc(C)ccc1F
|
CCCF)F)CNC)[C@H]C=O)NCcnnnC)n5))))))))cncC)ccc6F
|
[C][C][C][Branch1][C][F][Branch1][C][F][C][N][Branch1][C][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][N][=N][N][Branch1][C][C][N][=Ring1][=Branch1][C][=N][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][F]
|
c16nc(C)ccc1F.CCC(F)(F)C3.c17nnn(C)n1.[C@H]46C2=O.N34C.N25.C57
|
CSc1ncc(C#N)c(N2CCO[C@@H](C(=O)NCC3CCSCC3)C2)n1
|
CScnccC#N))cNCCO[C@@H]C=O)NCCCCSCC6)))))))))C6))))))n6
|
[C][S][C][=N][C][=C][Branch1][Ring1][C][#N][C][Branch2][Ring1][=Branch2][N][C][C][O][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C][C][C][C][S][C][C][Ring1][=Branch1][C][Ring1][S][=N][Ring2][Ring1][Branch2]
|
c19ncc(C#N)c6n1.N16CCO[C@@H]7C1.C18CCSCC1.C47=O.CS9.N45.C58
|
N#C[C@]1(C(=O)NC[C@H](NC(=O)c2csc3nccn23)C2CCCC2)CC12CCC2
|
N#C[C@]C=O)NC[C@H]NC=O)ccscnccn85))))))))))CCCCC5)))))))))CC3CCC4
|
[N][#C][C@][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][S][C][=N][C][=C][N][Ring1][Branch2][Ring1][Branch1][C][C][C][C][C][Ring1][Branch1][C][C][Ring2][Ring1][Branch2][C][C][C][Ring1][Ring2]
|
N#C[C@]19CC12CCC2.c18csc2nccn12.C1%10CCCC1.C6[C@H]7%10.C49=O.C58=O.N46.N57
|
CC(C)(C)[C@@H](CO)NC(=O)[C@@H]1CCC2(CN(C(=O)[C@@H]3CCCS3)C2)O1
|
CCC)C)[C@@H]CO))NC=O)[C@@H]CCCCNC=O)[C@@H]CCCS5))))))C4)))O5
|
[C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][C][C][C][Branch2][Ring1][Ring1][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][S][Ring1][Branch1][C][Ring1][O][O][Ring1][#C]
|
[C@@H]17CCC2(CN5C2)O1.CC(C)(C)[C@H]6CO.[C@@H]18CCCS1.C47=O.C58=O.N46
|
CC(C)COCC(=O)N[C@H](C)[C@H]1CCN(C(=O)/C=C/CNC(=O)OC(C)(C)C)C1
|
CCC)COCC=O)N[C@H]C)[C@H]CCNC=O)/C=C/CNC=O)OCC)C)C)))))))))C5
|
[C][C][Branch1][C][C][C][O][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][/C][=C][/C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][C]
|
[C@H]14CCN6C1.CC(C)C8.C9C5=O.C6(=O)C=3.C%10(C)(C)C.[C@H]%114C.C=3C%12.C27=O.O89.N5%11.N7%12.O2%10
|
COC1CC(CNC(=O)c2ccn(C)n2)(NC(=O)Cc2cccc(C)c2C)C1
|
COCCCCNC=O)cccnC)n5))))))))NC=O)CcccccC)c6C))))))))))C4
|
[C][O][C][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][#Branch2]
|
c1%10cccc(C)c1C.C15CC69C1.c18ccn(C)n1.C4(=O)C%10.C38=O.CO5.C79.N37.N46
|
C#CC[C@H](CC(=O)N[C@H]1CCOCC12CCC2)NC(=O)c1ccnn1CC
|
C#CC[C@H]CC=O)N[C@H]CCOCC6CCC4))))))))))))NC=O)cccnn5CC
|
[C][#C][C][C@H1][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C][C][Ring1][=Branch1][C][C][C][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C]
|
[C@H]16CCOCC12CCC2.C#CC[C@@H]5CC3=O.c17ccnn18.C47=O.N36.N45.C8C
|
C[C@]1(CC(=O)N2[C@H]3CC[C@H]2CN(C(=O)[C@H]2CCCc4ncnn42)CC3)CC1(Cl)Cl
|
C[C@]CC=O)N[C@H]CC[C@H]5CNC=O)[C@H]CCCcncnn59))))))))))CC8)))))))))))CC3Cl)Cl
|
[C][C@][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C][C][C][=N][C][=N][N][Ring1][Branch1][Ring1][=Branch2][C][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][#Branch2][Branch1][C][Cl][Cl]
|
C6(=O)[C@H]1CCCc2ncnn21.N15[C@H]2CC[C@H]1CN6CC2.C[C@]17CC1(Cl)Cl.C7C5=O
|
CC[C@](C)(O)C(=O)NCCCN(C(=O)c1cncc(C(N)=O)c1)C1CC1
|
CC[C@]C)O)C=O)NCCCNC=O)ccnccCN)=O))c6)))))))CCC3
|
[C][C][C@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][=Branch2][C][C][C][Ring1][Ring1]
|
CC[C@](C)(O)C2=O.c17cncc8c1.C4CC5.N356.C37=O.C8(N)=O.C16CC1.N24
|
CCC1(C#CC(=O)N2CCC[C@@H](N(C)C(=O)c3cc(F)ccc3C)CC2)COC1
|
CCCC#CC=O)NCCC[C@@H]NC)C=O)cccF)ccc6C)))))))))CC7))))))))))COC4
|
[C][C][C][Branch2][Ring2][Branch2][C][#C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][C][C][Ring2][Ring1][Ring1][C][O][C][Ring2][Ring1][O]
|
C18(C#CC4=O)COC1.N14CCC[C@@H]6CC1.c17cc(F)ccc1C.N56C.C57=O.CC8
|
C[C@H]1CCN(C(=O)C#CC(=O)N(C)C)C[C@H]1CNC(=O)c1c2c(nn1C)CCC2
|
C[C@H]CCNC=O)C#CC=O)NC)C))))))C[C@H]6CNC=O)cccnn5C)))CCC5
|
[C][C@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][#C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C@H1][Ring1][#C][C][N][C][=Branch1][C][=O][C][=C][C][=Branch1][=Branch1][=N][N][Ring1][Branch1][C][C][C][C][Ring1][Branch2]
|
c17c2c(nn1C)CCC2.C[C@H]1CCN3C[C@H]18.C3(=O)C#CC4=O.N4(C)C.C57=O.C68.N56
|
CCN(C)CCC(=O)NCC[C@@H]1CCCCN1C(=O)C12COC(CF)(C1)C2
|
CCNC)CCC=O)NCC[C@@H]CCCCN6C=O)CCOCCF))C5)C5
|
[C][C][N][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][O][C][Branch1][Ring1][C][F][Branch1][Ring2][C][Ring1][#Branch1][C][Ring1][Branch2]
|
[C@@H]19CCCCN14.C128COC%10(C1)C2.C6CC3=O.N56C.C7C9.C48=O.CC5.N37.C%10F
|
C#CCC(C)(C)C(=O)N[C@@H]1CC[C@@](C)(CNC(=O)C(=O)N=S(C)(C)=O)C1
|
C#CCCC)C)C=O)N[C@@H]CC[C@@]C)CNC=O)C=O)N=SC)C)=O)))))))C5
|
[C][#C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@@][Branch1][C][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][=S][Branch1][C][C][Branch1][C][C][=O][C][Ring1][P]
|
C3(=O)C(=O)N=S(C)(C)=O.C#CCC(C)(C)C2=O.[C@@H]15CC[C@]6(C)C1.N25.C46.N34
|
COC(=O)COCC(=O)NC1CCN(C(=O)C2=C[C@@H]3CCC[C@@H]23)CC1
|
COC=O)COCC=O)NCCCNC=O)C=C[C@@H]CCC[C@@H]75))))))))CC6
|
[C][O][C][=Branch1][C][=O][C][O][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C@@H1][C][C][C][C@@H1][Ring1][#Branch1][Ring1][Branch1][C][C][Ring1][#C]
|
C6(=O)C1=C[C@@H]2CCC[C@@H]12.C19CCN6CC1.C4(=O)C7.C8C5=O.CO4.O78.N59
|
COCCC(=O)N1CC(OCCNC(=O)Cc2c[nH]c3c(C)cccc23)C1
|
COCCC=O)NCCOCCNC=O)Ccc[nH]ccC)cccc96)))))))))))))))C4
|
[C][O][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch2][O][C][C][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][Ring2][Ring1][Branch1]
|
c1%10c[nH]c2c(C)cccc12.C6CC4=O.N14CC8C1.C5(=O)C%10.C7C9.CO6.O78.N59
|
CCCC(C)(C)CC(=O)N(CC)CCC(=O)N1CCN(C(=O)NC)CC1
|
CCCCC)C)CC=O)NCC))CCC=O)NCCNC=O)NC)))CC6
|
[C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Ring1][#Branch2]
|
CCCC(C)(C)CC2=O.N13CCN4CC1.C7CC3=O.N267.C45=O.C6C.N5C
|
Cc1cc(C)c(C(=O)N2CC3=C(C2)CN(C(=O)[C@H]2Cc4ccccc4O2)C3)[nH]1
|
CcccC)cC=O)NCC=CC5)CNC=O)[C@H]Ccccccc6O9))))))))))C5))))))))[nH]5
|
[C][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][=C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][C][Ring1][P][NH1][Ring2][Ring1][O]
|
N15CC2=C(C1)CN6C2.[C@H]17Cc2ccccc2O1.Cc1cc(C)c8[nH]1.C58=O.C67=O
|
CC[C@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1[C@@H](NC(=O)C[C@@H]1CCSC1)C2)C(=O)OC
|
CC[C@H]C=O)N[C@@H]C[C@H]CC[C@@H]6[C@@H]NC=O)C[C@@H]CCSC5))))))))C6))))))))))C=O)OC
|
[C][C][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C@@H1][C][C][S][C][Ring1][Branch1][C][Ring1][#C][C][=Branch1][C][=O][O][C]
|
[C@@H]16C[C@H]2CC[C@@H]1[C@@H]7C2.CC[C@@H](C3=O)C4=O.[C@@H]18CCSC1.C5(=O)C8.N46.N57.O3C
|
CC(C)(NS(C)(=O)=O)C(=O)N[C@H]1COC2(C1)CN(C(=O)C1(F)CC1)C2
|
CCC)NSC)=O)=O)))C=O)N[C@H]COCC5)CNC=O)CF)CC3))))C4
|
[C][C][Branch1][C][C][Branch1][#Branch2][N][S][Branch1][C][C][=Branch1][C][=O][=O][C][=Branch1][C][=O][N][C@H1][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][F][C][C][Ring1][Ring2][C][Ring1][O]
|
[C@H]17COC2(C1)CN4C2.CC5(C)C3=O.S6(C)(=O)=O.C18(F)CC1.C48=O.N56.N37
|
Cc1ccc(N2CCC[C@@H](C(=O)N3CCCN(C(=O)CC(C)(C)O)CC3)C2)nc1
|
CccccNCCC[C@@H]C=O)NCCCNC=O)CCC)C)O))))CC7))))))))C6))))))nc6
|
[C][C][=C][C][=C][Branch2][Ring2][=Branch2][N][C][C][C][C@@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][O][C][C][Ring1][=C][C][Ring2][Ring1][=Branch1][N][=C][Ring2][Ring1][N]
|
N14CCCN5CC1.Cc1ccc6nc1.N16CCC[C@@H]7C1.C5(=O)CC(C)(C)O.C47=O
|
O=C(N[C@@H]1CN(C(=O)c2cn3cnnc3cn2)C[C@H]1O)c1cccc2nonc12
|
O=CN[C@@H]CNC=O)ccncnnc5cn9))))))))))C[C@H]5O)))))))cccccnonc95
|
[O][=C][Branch2][Ring1][=C][N][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][N][C][=N][N][=C][Ring1][Branch1][C][=N][Ring1][=Branch2][C][C@H1][Ring1][S][O][C][=C][C][=C][C][=N][O][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
c17cn2cnnc2cn1.c18cccc2nonc12.[C@@H]16CN5C[C@H]1O.O=C48.C57=O.N46
|
Cn1nccc1CC(=O)N[C@H](C(=O)N[C@H]1CNC(=O)C12CC2)[C@@H]1CC=CCC1
|
Cnnccc5CC=O)N[C@H]C=O)N[C@H]CNC=O)C5CC3)))))))))[C@@H]CC=CCC6
|
[C][N][N][=C][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@H1][C][N][C][=Branch1][C][=O][C][Ring1][=Branch1][C][C][Ring1][Ring1][C@@H1][C][C][=C][C][C][Ring1][=Branch1]
|
[C@H]16CNC(=O)C12CC2.Cn1nccc17.[C@@H]18CC=CCC1.[C@H]58C4=O.C7C3=O.N35.N46
|
CCC(CC)C(=O)N1C[C@H]2CN(C(=O)/C=C/c3cnc[nH]3)C[C@H]21
|
CCCCC))C=O)NC[C@H]CNC=O)/C=C/ccnc[nH]5))))))))C[C@H]57
|
[C][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][/C][=C][/C][=C][N][=C][NH1][Ring1][Branch1][C][C@H1][Ring1][=C][Ring1][S]
|
N14C[C@H]2CN5C[C@H]21.CCC(CC)C4=O.C=6c1cnc[nH]1.C5(=O)C=6
|
CN(C(=O)CCF)[C@H]1CC[C@H](CNC(=O)[C@@H]2C[C@@H]3CCCCC[C@@H]32)CC1
|
CNC=O)CCF))))[C@H]CC[C@H]CNC=O)[C@@H]C[C@@H]CCCCC[C@@H]79))))))))))))CC6
|
[C][N][Branch1][Branch2][C][=Branch1][C][=O][C][C][F][C@H1][C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][C][C][C][C][C][C@@H1][Ring1][#Branch1][Ring1][=Branch2][C][C][Ring2][Ring1][Ring1]
|
[C@@H]18C[C@@H]2CCCCC[C@@H]21.[C@H]17CC[C@H]9CC1.C4(=O)CCF.CN47.C58=O.C69.N56
|
C=C[C@H](C)CC(=O)N1C[C@@H]2C[C@H]1[C@H]2NC(=O)c1cc(C(F)(F)F)ncc1OC
|
C=C[C@H]C)CC=O)NC[C@@H]C[C@H]5[C@H]4NC=O)cccCF)F)F))ncc6OC
|
[C][=C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Ring1][Branch1][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][=C][Ring1][#Branch2][O][C]
|
c17cc8ncc15.C=C[C@H](C)CC3=O.N13C[C@@H]2C[C@H]1[C@H]26.C8(F)(F)F.C47=O.N46.O5C
|
CCN(CC)CC(=O)N1CC[C@@H](C2CCN(C(=O)CC(C)(C)F)CC2)C1
|
CCNCC))CC=O)NCC[C@@H]CCCNC=O)CCC)C)F))))CC6))))))C5
|
[C][C][N][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch2][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][F][C][C][Ring1][=N][C][Ring2][Ring1][C]
|
N13CC[C@@H](C2CCN4CC2)C1.C4(=O)CC(C)(C)F.C7C3=O.N567.CC5.C6C
|
Cc1cncc(C(=O)N[C@@H](CC(N)=O)c2cn([C@@H]3CCCCC[C@H]3O)nn2)n1
|
CccnccC=O)N[C@@H]CCN)=O)))ccn[C@@H]CCCCC[C@H]7O))))))))nn5))))))))n6
|
[C][C][=C][N][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=C][N][Branch1][O][C@@H1][C][C][C][C][C][C@H1][Ring1][#Branch1][O][N][=N][Ring1][=N][=N][Ring2][Ring1][O]
|
[C@@H]18CCCCC[C@H]1O.Cc1cncc6n1.[C@@H]57CC(N)=O.c17cn8nn1.C46=O.N45
|
O=C(CC1CC1)N1CC2(CC[C@@H](C(=O)N3CCCO[C@H](CO)C3)O2)C1
|
O=CCCCC3))))NCCCC[C@@H]C=O)NCCCO[C@H]CO))C7))))))))O5))))C4
|
[O][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][C][C][Branch2][Ring1][O][C][C][C@@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][O][C@H1][Branch1][Ring1][C][O][C][Ring1][=Branch2][O][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14CC2(CC[C@@H]6O2)C1.N15CCCO[C@H]7C1.O=C4C8.C18CC1.C56=O.C7O
|
CC(C)(C)C(=O)N[C@H]1C[C@@H]2CN(C(=O)C(C)(C)C)C[C@@H]2C1
|
CCC)C)C=O)N[C@H]C[C@@H]CNC=O)CC)C)C)))C[C@@H]5C8
|
[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C@@H1][Ring1][O][C][Ring1][=C]
|
[C@H]15C[C@@H]2CN4C[C@@H]2C1.CC(C)(C)C3=O.C4(=O)C(C)(C)C.N35
|
CSc1ccc(C(=O)N2CC[C@H](C)[C@@H](CNC(=O)C[C@H](C)c3ccco3)C2)o1
|
CSccccC=O)NCC[C@H]C)[C@@H]CNC=O)C[C@H]C)cccco5))))))))))C6)))))))o5
|
[C][S][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C][=C][C][=C][O][Ring1][Branch1][C][Ring2][Ring1][Ring1][O][Ring2][Ring1][#Branch2]
|
N14CC[C@H](C)[C@@H]9C1.c1%10ccc7o1.C5(=O)C[C@@H]8C.c18ccco1.C47=O.CS%10.C69.N56
|
C[C@@H](CNC(=O)C1=C(Cl)CCC1)N(C)C(=O)C[C@@H]1CCc2ccccc21
|
C[C@@H]CNC=O)C=CCl)CCC5))))))))NC)C=O)C[C@@H]CCcccccc69
|
[C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][C][C][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C@@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2]
|
C4(=O)C[C@@H]1CCc2ccccc21.C3(=O)C1=C(Cl)CCC1.C[C@H]5C6.N45C.N36
|
CCc1ccsc1C(=O)N1CCC[C@@]1(C)C(=O)N1C[C@@H](CO)CC(C)(C)C1
|
CCcccsc5C=O)NCCC[C@@]5C)C=O)NC[C@@H]CO))CCC)C)C6
|
[C][C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2]
|
N13C[C@@H]6CC(C)(C)C1.N12CCC[C@]14C.c17ccsc15.C25=O.C34=O.CC7.C6O
|
CON1C[C@H](C(=O)NCCC[C@@H](C)NC(=O)c2cnc3c(c2)COC3)CC1=O
|
CONC[C@H]C=O)NCCC[C@@H]C)NC=O)ccnccc6)COC5))))))))))))))))CC5=O
|
[C][O][N][C][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][O][C][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2][=O]
|
c19cnc2c(c1)COC2.CON1C[C@H]8CC1=O.C6CC[C@H]7C.C48=O.C59=O.N46.N57
|
COCC(C)(COC)C(=O)NC[C@@H](C)CC(=O)N[C@H]1COC[C@@H]1SC
|
COCCC)COC)))C=O)NC[C@@H]C)CC=O)N[C@H]COC[C@@H]5SC
|
[C][O][C][C][Branch1][C][C][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][O][C][C@@H1][Ring1][Branch1][S][C]
|
C4C(C)(C5)C2=O.C6[C@@H](C)CC3=O.[C@H]17COC[C@@H]18.CO4.O5C.N26.N37.S8C
|
N#C[C@H](C(=O)NC[C@@H]1CCN1C(=O)c1cc2c(C3CC3)cccc2[nH]1)C1CC1
|
N#C[C@H]C=O)NC[C@@H]CCN4C=O)ccccCCC3)))cccc6[nH]9)))))))))))))))))CCC3
|
[N][#C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][C][=C][Ring1][=Branch2][NH1][Ring1][N][C][C][C][Ring1][Ring1]
|
c17cc2c%10cccc2[nH]1.N#C[C@@H]9C4=O.[C@@H]18CCN15.C57=O.C1%10CC1.C19CC1.N46.C68
|
CCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NC(=O)c2cc3c(Br)c(C)ccc3[nH]2)C1
|
CCC=O)NC[C@@H]CF)F)F))[C@H]NC=O)ccccBr)cC)ccc6[nH]9)))))))))))C5
|
[C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][C][=C][C][=C][Ring1][Branch2][NH1][Ring1][O][C][Ring2][Ring1][#Branch1]
|
c17cc2c(Br)c(C)ccc2[nH]1.N14C[C@@H]6[C@H]8C1.CCC4=O.C8(F)(F)F.C57=O.N56
|
CC(=O)c1ccc([C@H](C)NC(=O)N(C)Cc2cc(C)cs2)cc1
|
CC=O)cccc[C@H]C)NC=O)NC)CcccC)cs5))))))))))cc6
|
[C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][=Branch2][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][C][Branch1][C][C][=C][S][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2]
|
c17ccc9cc1.c18cc(C)cs1.CC7=O.[C@@H]59C.C34=O.N46C.N35.C68
|
C[C@@H](C[C@H](C)NC(=O)c1cncs1)NC(=O)c1cc2c(nn1)CCC2
|
C[C@@H]C[C@H]C)NC=O)ccncs5)))))))))NC=O)ccccnn6))CCC5
|
[C][C@@H1][Branch2][Ring1][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][S][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch1][N][=N][Ring1][=Branch1][C][C][C][Ring1][#Branch1]
|
c18cc2c(nn1)CCC2.C[C@H]5C[C@@H]6C.c17cncs1.C37=O.C48=O.N36.N45
|
CC1(C)CC[C@@]2(CN(C(=O)c3cccn4c(CBr)nnc34)CCO2)C1
|
CCC)CC[C@@]CNC=O)ccccncCBr))nnc95))))))))))CCO6)))))C5
|
[C][C][Branch1][C][C][C][C][C@@][Branch2][Ring1][P][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][N][C][Branch1][Ring1][C][Br][=N][N][=C][Ring1][O][Ring1][#Branch1][C][C][O][Ring2][Ring1][Ring1][C][Ring2][Ring1][Branch2]
|
CC1(C)CC[C@@]2(CN5CCO2)C1.c16cccn2c7nnc12.C56=O.C7Br
|
C#C[C@@H]1OCCC[C@H]1n1c(=O)n(C)c2cc(Cl)c(Cl)cc21
|
C#C[C@@H]OCCC[C@H]6nc=O)nC)cccCl)cCl)cc69
|
[C][#C][C@@H1][O][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Ring1][=N]
|
n13c(=O)n(C)c2cc(Cl)c(Cl)cc21.C#C[C@@H]1OCCC[C@H]13
|
CN(C[C@]1(O)CCCN(C(=O)CC=C(Cl)Cl)C1)C(=O)c1cc[nH]c2nccc1-2
|
CNC[C@]O)CCCNC=O)CC=CCl)Cl)))))C6)))))))C=O)ccc[nH]cnccc9-5
|
[C][N][Branch2][Ring1][#Branch2][C][C@][Branch1][C][O][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][Cl][Cl][C][Ring1][=C][C][=Branch1][C][=O][C][C][=C][NH1][C][=N][C][=C][C][=Ring1][=Branch2][Ring1][Branch1]
|
c16cc[nH]c2nccc1-2.[C@@]17(O)CCCN3C1.C3(=O)CC=C(Cl)Cl.CN45.C46=O.C57
|
CC(C)[C@H](C(=O)NC1(CNC(=O)[C@@]2(F)C[C@@H]2C)CCC1)n1cnnn1
|
CCC)[C@H]C=O)NCCNC=O)[C@@]F)C[C@@H]3C)))))))CCC4))))))ncnnn5
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][Branch1][S][C][N][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C@@H1][Ring1][Ring2][C][C][C][C][Ring1][=N][N][C][=N][N][=N][Ring1][Branch1]
|
CC(C)[C@@H]8C3=O.C159CCC1.[C@]17(F)C[C@@H]1C.n18cnnn1.C47=O.N35.C69.N46
|
Cn1nc(C2CC2)nc1CC(=O)N[C@@H]1CC[C@H]1NC(=O)c1cccc2nonc12
|
CnncCCC3)))nc5CC=O)N[C@@H]CC[C@H]4NC=O)cccccnonc95
|
[C][N][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][=C][Ring1][Branch2][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][C][=N][O][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
c17cccc2nonc12.Cn1nc9nc18.[C@@H]15CC[C@H]16.C8C3=O.C19CC1.C47=O.N35.N46
|
COCc1cc(C(=O)NC2C[C@@H]3CC(NC(=O)c4c(C)coc4C)C[C@H]3C2)on1
|
COCcccC=O)NCC[C@@H]CCNC=O)ccC)coc5C))))))))C[C@H]5C8))))))))))on5
|
[C][O][C][C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][Branch1][P][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=C][O][C][=Ring1][=Branch1][C][C][C@H1][Ring1][#C][C][Ring2][Ring1][C][O][N][=Ring2][Ring1][#Branch2]
|
C18C[C@@H]2CC9C[C@H]2C1.c1%11c(C)coc1C.c1%12cc%10on1.C5%10=O.C6%11=O.CO7.C7%12.N58.N69
|
CCc1occc1C(=O)NCCC(C)(C)Nc1cc(Cl)nc(CS(C)(=O)=O)n1
|
CCcoccc5C=O)NCCCC)C)NcccCl)ncCSC)=O)=O)))n6
|
[C][C][C][O][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=C][C][Branch1][C][Cl][=N][C][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][=N][Ring1][N]
|
c15cc(Cl)nc8n1.c17occc16.C3CC4(C)C.C8S(C)(=O)=O.C26=O.CC7.N23.N45
|
Cc1cc(CCCC(=O)N[C@@H]2CN(C(=O)[C@H]3C[C@@H]4C[C@@H]4C3)CC(C)(C)C2)on1
|
CcccCCCC=O)N[C@@H]CNC=O)[C@H]C[C@@H]C[C@@H]3C6)))))))CCC)C)C6)))))))))))on5
|
[C][C][C][=C][Branch2][Ring2][#Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][S][O][N][=Ring2][Ring1][O]
|
[C@@H]17CN6CC(C)(C)C1.Cc1cc9on1.C9CCC5=O.[C@H]18C[C@@H]2C[C@@H]2C1.C68=O.N57
|
Cc1cc(F)cnc1C(=O)NC[C@@]12CCCC[C@@H]1N(C(=O)c1ocnc1C)CC2
|
CcccF)cnc6C=O)NC[C@@]CCCC[C@@H]6NC=O)cocnc5C)))))))CC9
|
[C][C][=C][C][Branch1][C][F][=C][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@][C][C][C][C][C@@H1][Ring1][=Branch1][N][Branch1][=N][C][=Branch1][C][=O][C][O][C][=N][C][=Ring1][Branch1][C][C][C][Ring1][P]
|
[C@@]128CCCC[C@@H]1N4CC2.Cc1cc(F)cnc16.c17ocnc1C.C36=O.C47=O.N35.C58
|
CN(C)C[C@]1(F)CCN(c2nc3ccccc3c(=NC3CCN(C)CC3)[nH]2)C1
|
CNC)C[C@]F)CCNcncccccc6c=NCCCNC)CC6)))))))[nH]%10))))))))))C5
|
[C][N][Branch1][C][C][C][C@][Branch1][C][F][C][C][N][Branch2][Ring1][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][=N][=N][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][NH1][Ring2][Ring1][C][C][Ring2][Ring1][Branch2]
|
c15nc2ccccc2c(=NC2CCN(C)CC2)[nH]1.[C@@]16(F)CCN5C1.CN4C.C46
|
CCCCS[C@H](C)C(=O)N1CCC[C@H]1CN(C)C(=O)c1cncc(P(C)(C)=O)c1
|
CCCCS[C@H]C)C=O)NCCC[C@H]5CNC)C=O)ccnccPC)C)=O))c6
|
[C][C][C][C][S][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][=Branch2][P][Branch1][C][C][Branch1][C][C][=O][=C][Ring1][#Branch2]
|
c17cncc(P(C)(C)=O)c1.N12CCC[C@H]18.[C@@H]6(C)C2=O.CCCC5.N34C.C37=O.S56.C48
|
CC(C)(C)S(=O)(=O)CC(=O)N1[C@@H]2CC[C@H]1C[C@H](NC(=O)CCCn1ccnc1)C2
|
CCC)C)S=O)=O)CC=O)N[C@@H]CC[C@H]5C[C@H]NC=O)CCCnccnc5))))))))))C7
|
[C][C][Branch1][C][C][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][Ring2][Ring1][C]
|
CC(C)(C)S(=O)(=O)CC3=O.N13[C@@H]2CC[C@H]1C[C@H]5C2.C4(=O)CCC6.n16ccnc1.N45
|
CC/C=C(\C)C(=O)N(C)C[C@H]1CCN(C(=O)c2cncc3ccc(F)cc23)C1
|
CC/C=C\C)C=O)NC)C[C@H]CCNC=O)ccncccccF)cc%106)))))))))))C5
|
[C][C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][O][Ring1][#Branch1][C][Ring2][Ring1][C]
|
c17cncc2ccc(F)cc12.[C@H]19CCN5C1.C=8(C)C4=O.CCC=8.N46C.C57=O.C69
|
CC(C)C[C@H](CNc1nc(Cl)nc2nc(Cl)n(C)c12)NC(=O)c1cnnc(O)c1
|
CCC)C[C@H]CNcncCl)ncncCl)nC)c95)))))))))))NC=O)ccnncO)c6
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring1][=Branch2][C][N][C][=N][C][Branch1][C][Cl][=N][C][N][=C][Branch1][C][Cl][N][Branch1][C][C][C][Ring1][N][=Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][N][=N][C][Branch1][C][O][=C][Ring1][#Branch1]
|
c16nc(Cl)nc2nc(Cl)n(C)c12.CC(C)C[C@@H]4C5.c17cnnc(O)c1.C37=O.N56.N34
|
C[C@@H]1C[C@@H](C(=O)N2CCC[C@H](C(C)(C)C)C2)N(C(=O)[C@@H]2COC[C@@H](C)O2)C1
|
C[C@@H]C[C@@H]C=O)NCCC[C@H]CC)C)C))C6)))))))NC=O)[C@@H]COC[C@@H]C)O6)))))))C5
|
[C][C@@H1][C][C@@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#Branch2][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][O][C][C@@H1][Branch1][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][#Branch2]
|
C[C@@H]1C[C@@H]5N4C1.N13CCC[C@H]7C1.[C@@H]16COC[C@@H](C)O1.C7(C)(C)C.C35=O.C46=O
|
C[C@H](NC(=O)C[C@@H]1CCCCC1(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCOC2)C1
|
C[C@H]NC=O)C[C@@H]CCCCC6F)F))))))))))[C@@H]CCNC=O)[C@@H]CCCOC6)))))))C5
|
[C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][C][C][Ring1][=Branch1][Branch1][C][F][F][C@@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][=N]
|
[C@@H]18CCCCC1(F)F.[C@@H]17CCN4C1.[C@@H]16CCCOC1.C3(=O)C8.C[C@H]57.C46=O.N35
|
Cn1cc2cccc(C(=O)N[C@H]3CN(C(=O)c4cc(Cl)ns4)C4(CCC4)C3)c2n1
|
CnccccccC=O)N[C@H]CNC=O)cccCl)ns5))))))CCCC4)))C5)))))))c6n9
|
[C][N][C][=C][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][S][Ring1][=Branch1][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][S][C][Ring2][Ring1][=Branch2][=N][Ring2][Ring1][N]
|
Cn1cc2cccc9c2n1.[C@H]17CN6C2(CCC2)C1.c18cc(Cl)ns1.C59=O.C68=O.N57
|
COC(=O)C1CCN(C(=O)[C@@H]2CCOCCN2C(=O)COCC(F)F)CC1
|
COC=O)CCCNC=O)[C@@H]CCOCCN7C=O)COCCF)F))))))))))))))CC6
|
[C][O][C][=Branch1][C][=O][C][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C@@H1][C][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][O][C][C][Branch1][C][F][F][C][C][Ring2][Ring1][#Branch1]
|
[C@@H]18CCOCCN15.C19CCN4CC1.C5(=O)C6.C7C(F)F.C39=O.C48=O.CO3.O67
|
CN(CC1(NC(=O)c2ccsc2C#N)CC1)C(=O)CCCc1nncn1C
|
CNCCNC=O)cccsc5C#N)))))))))CC3))))C=O)CCCcnncn5C
|
[C][N][Branch2][Ring1][#Branch1][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][#N][C][C][Ring1][=N][C][=Branch1][C][=O][C][C][C][C][=N][N][=C][N][Ring1][Branch1][C]
|
c17ccsc1C#N.C4(=O)CCC8.c18nncn1C.C169CC1.CN45.C37=O.C59.N36
|
Cc1ccc(NC(=O)c2nc(-c3cc(F)ccc3F)sc2C)c(O)c1
|
CccccNC=O)cnc-cccF)ccc6F)))))))sc5C))))))))cO)c6
|
[C][C][=C][C][=C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][N][=C][Branch1][=N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][S][C][=Ring1][=N][C][C][Branch1][C][O][=C][Ring2][Ring1][Branch2]
|
Cc1ccc5c(O)c1.c17cc(F)ccc1F.c16nc7sc1C.C46=O.N45
|
C[C@]1(c2cn(Cc3cnoc3)nn2)COCCN1C(=O)[C@@H]1C[C@H](O)[C@@H](F)C1
|
C[C@]ccnCccnoc5))))))nn5)))))COCCN6C=O)[C@@H]C[C@H]O)[C@@H]F)C5
|
[C][C@][Branch2][Ring1][C][C][=C][N][Branch1][=Branch2][C][C][C][=N][O][C][=Ring1][Branch1][N][=N][Ring1][O][C][O][C][C][N][Ring1][P][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][F][C][Ring1][#Branch1]
|
C[C@]18COCCN14.[C@@H]15C[C@H](O)[C@@H](F)C1.c18cn6nn1.c17cnoc1.C45=O.C67
|
C=CCn1nnnc1[C@@H](NCCC1CC1)[C@@H]1CCOC1(C)C
|
C=CCnnnnc5[C@@H]NCCCCC3))))))[C@@H]CCOC5C)C
|
[C][=C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][=Branch2][N][C][C][C][C][C][Ring1][Ring1][C@@H1][C][C][O][C][Ring1][Branch1][Branch1][C][C][C]
|
[C@@H]16CCOC1(C)C.n14nnnc15.C=CC4.[C@@H]256.C3C7.C17CC1.N23
|
CON1C[C@@H](C(=O)NC[C@@H]2CCCCN2C(=O)c2nc(C)c(N)cc2C)CC1=O
|
CONC[C@@H]C=O)NC[C@@H]CCCCN6C=O)cncC)cN)cc6C)))))))))))))))))CC5=O
|
[C][O][N][C][C@@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=N][C][Branch1][C][C][=C][Branch1][C][N][C][=C][Ring1][Branch2][C][C][C][Ring2][Ring1][#Branch2][=O]
|
c16nc(C)c(N)cc1C.CON1C[C@@H]7CC1=O.[C@@H]18CCCCN14.C37=O.C46=O.N35.C58
|
CCOC[C@@H](C(=O)N1CCN(S(C)(=O)=O)CC1)n1cc(C(C)(C)S(C)(=O)=O)nn1
|
CCOC[C@@H]C=O)NCCNSC)=O)=O))CC6)))))))nccCC)C)SC)=O)=O)))nn5
|
[C][C][O][C][C@@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][#Branch2][N][C][=C][Branch1][S][C][Branch1][C][C][Branch1][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][N][=N][Ring1][N]
|
N12CCN5CC1.C7(C)(C)S(C)(=O)=O.C4[C@H]6C2=O.n16cc7nn1.S5(C)(=O)=O.CC3.O34
|
C[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N[C@@H]1C2C[C@@H]3[C@H](C2)C13C(=O)NCC1(F)CC1
|
C[C@@H][C@H]CC[C@@H]C5)[C@@H]6C=O)N[C@@H]CC[C@@H][C@H]C5)C63C=O)NCCF)CC3
|
[C][C@@H1][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch1][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][#Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][C][Ring1][Ring2]
|
C[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]18.[C@@H]17C2C[C@@H]3[C@H](C2)C139.C1%10(F)CC1.C48=O.C59=O.N47.N56.C6%10
|
COC(=O)[C@H]1CC[C@H](C(=O)N[C@H]2CN(C(=O)c3csnn3)CC23CC3)CC1
|
COC=O)[C@H]CC[C@H]C=O)N[C@H]CNC=O)ccsnn5))))))CC5CC3)))))))))CC6
|
[C][O][C][=Branch1][C][=O][C@H1][C][C][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][S][N][=N][Ring1][Branch1][C][C][Ring1][N][C][C][Ring1][Ring1][C][C][Ring2][Ring1][#Branch1]
|
[C@H]17CN6CC12CC2.[C@H]19CC[C@H]%10CC1.c18csnn1.C49=O.C5%10=O.C68=O.CO4.N57
|
CN(C(=O)N[C@H]1CC[C@H](OC(F)F)CC1)[C@@H](C(N)=O)c1ccc(Cl)cc1
|
CNC=O)N[C@H]CC[C@H]OCF)F)))CC6))))))))[C@@H]CN)=O))ccccCl)cc6
|
[C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch1][#Branch1][O][C][Branch1][C][F][F][C][C][Ring1][#Branch2][C@@H1][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
[C@H]16CC[C@H]4CC1.c17ccc(Cl)cc1.[C@@H]57C(N)=O.O4C(F)F.CN25.C23=O.N36
|
CCc1cc(F)c(Nc2cc(C(F)(F)F)c(Cl)cn2)cc1F
|
CCcccF)cNcccCF)F)F))cCl)cn6)))))))cc6F
|
[C][C][C][=C][C][Branch1][C][F][=C][Branch2][Ring1][#Branch1][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Branch1][C][Cl][C][=N][Ring1][O][C][=C][Ring2][Ring1][Ring1][F]
|
c15cc(F)c4cc1F.c13cc6c(Cl)cn1.C6(F)(F)F.CC5.N34
|
C=C[C@H](CC)CC(=O)NC[C@H]1C=CCN1C(=O)CCC(=O)c1c(F)cccc1F
|
C=C[C@H]CC))CC=O)NC[C@H]C=CCN5C=O)CCC=O)ccF)cccc6F
|
[C][=C][C@H1][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F]
|
C=C[C@H](CC)CC2=O.c15c(F)cccc1F.C3(=O)CCC5=O.[C@H]16C=CCN13.N24.C46
|
C[C@H](NC(C)(C)C)C(=O)N1CCSC[C@@H]1CCNC(=O)c1ccn(C2CCC2)n1
|
C[C@H]NCC)C)C)))C=O)NCCSC[C@@H]6CCNC=O)cccnCCCC4))))n5
|
[C][C@H1][Branch1][#Branch2][N][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][S][C][C@@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][N][=Ring1][=Branch2]
|
N13CCSC[C@@H]19.c18ccn%10n1.C[C@H]5C3=O.C6(C)(C)C.C1%10CCC1.C9C7.C48=O.N56.N47
|
CCC(CC)OCC(=O)NC(C)(C)C[C@@H](F)C(=O)NCc1cnc(F)c(C)c1
|
CCCCC))OCC=O)NCC)C)C[C@@H]F)C=O)NCccncF)cC)c6
|
[C][C][C][Branch1][Ring1][C][C][O][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][=C][N][=C][Branch1][C][F][C][Branch1][C][C][=C][Ring1][Branch2]
|
C6(C)(C)C[C@@H](F)C3=O.c18cnc(F)c(C)c1.CCC4CC.C5C2=O.O45.N26.N37.C78
|
CO[C@H](C)C(=O)N(CCNC(=O)c1cc(F)cc2cc[nH]c12)Cc1ccccc1
|
CO[C@H]C)C=O)NCCNC=O)cccF)cccc[nH]c95)))))))))))))Ccccccc6
|
[C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][C][=C][NH1][C][Ring1][#Branch2][=Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
c19cc(F)cc2cc[nH]c12.c1%10ccccc1.[C@@H]5(C)C3=O.N368.C6C7.C49=O.CO5.N47.C8%10
|
COC(=O)c1sc(NC(=O)C2(c3cc[nH]n3)CC2)cc1C
|
COC=O)cscNC=O)Cccc[nH]n5)))))CC3)))))cc5C
|
[C][O][C][=Branch1][C][=O][C][S][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][C][C][Ring1][Branch2][=C][C][=Ring1][S][C]
|
c17sc6cc1C.c19cc[nH]n1.C189CC1.C47=O.C58=O.CO4.N56
|
CCOc1cc(C(=O)N[C@@H](CNC(=O)CCOc2ccccc2C)C(C)C)on1
|
CCOcccC=O)N[C@@H]CNC=O)CCOcccccc6C)))))))))))))CC)C)))))on5
|
[C][C][O][C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch1][C][C][C][O][N][=Ring2][Ring1][#Branch2]
|
c18ccccc1C.c17cc%11on1.[C@H]9(C%10)C(C)C.C4(=O)CC6.C3%11=O.CC5.O57.N39.N4%10.O68
|
O=C(N[C@H]1CN(C(=O)c2ccc(F)nc2)CC[C@H]1C(F)(F)F)c1ncc(Cl)s1
|
O=CN[C@H]CNC=O)ccccF)nc6)))))))CC[C@H]6CF)F)F)))))))))cnccCl)s5
|
[O][=C][Branch2][Ring2][Ring1][N][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][C][C][C@H1][Ring1][#C][C][Branch1][C][F][Branch1][C][F][F][C][=N][C][=C][Branch1][C][Cl][S][Ring1][=Branch1]
|
[C@H]15CN4CC[C@H]18.c17ccc(F)nc1.c16ncc(Cl)s1.C8(F)(F)F.O=C36.C47=O.N35
|
O=C(NC(CO)CO)[C@H]1CCN(C(=O)c2c(F)ccc(O)c2F)C1
|
O=CNCCO))CO))))[C@H]CCNC=O)ccF)cccO)c6F))))))))C5
|
[O][=C][Branch1][=Branch2][N][C][Branch1][Ring1][C][O][C][O][C@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][F][C][Ring1][S]
|
c17c(F)ccc(O)c1F.[C@H]16CCN4C1.C5(CO)CO.O=C36.C47=O.N35
|
CCCC[C@@H](O)CC(=O)N[C@H](c1ccc(-c2nn[nH]n2)cc1)C(F)(F)F
|
CCCC[C@@H]O)CC=O)N[C@H]cccc-cnn[nH]n5)))))cc6))))))CF)F)F
|
[C][C][C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][C][C][=C][C][=C][Branch1][Branch2][C][N][=N][NH1][N][=Ring1][Branch1][C][=C][Ring1][O][C][Branch1][C][F][Branch1][C][F][F]
|
CCCC[C@@H](O)CC3=O.c15ccc6cc1.[C@@H]45C(F)(F)F.c16nn[nH]n1.N34
|
COc1cnccc1C(=O)N1CC2=C(C1)CN(C(=O)[C@H](C)n1nccc1C)C2
|
COccnccc6C=O)NCC=CC5)CNC=O)[C@H]C)nnccc5C))))))))C5
|
[C][O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][N][=C][C][=C][Ring1][Branch1][C][C][Ring1][S]
|
N13CC2=C(C1)CN4C2.c15cnccc16.n17nccc1C.C4(=O)[C@@H]7C.C36=O.CO5
|
Cc1ccc(C(=O)N2C[C@@H](O)[C@H](N(C)C(=O)[C@H](C)CF)C2)cc1C#N
|
CccccC=O)NC[C@@H]O)[C@H]NC)C=O)[C@H]C)CF)))))C5))))))cc6C#N
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C@H1][Branch1][#C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][F][C][Ring1][=C][C][=C][Ring2][Ring1][=Branch1][C][#N]
|
Cc1ccc6cc1C#N.N13C[C@@H]5[C@H](O)C1.C4(=O)[C@H](C)CF.C36=O.N45C
|
CC(C)(C)OC(=O)CN=[S@](C)(=O)NC(=O)Cc1cccc2sccc12
|
CCC)C)OC=O)CN=[S@]C)=O)NC=O)Ccccccsccc95
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][N][=S@][Branch1][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
C3(=O)CN=[S@](C)(=O)N4.c16cccc2sccc12.CC5(C)C.C4(=O)C6.O35
|
CC(=O)N(C)CC(=O)NCC(C)(C)[C@H]1CCCN1C(=O)CN(C)CCO
|
CC=O)NC)CC=O)NCCC)C)[C@H]CCCN5C=O)CNC)CCO
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][O]
|
[C@H]19CCCN14.C6C9(C)C.C5C3=O.C4(=O)C7.CC2=O.N25C.N78C.C8CO.N36
|
CCSC1(C(=O)N2CCN(C(=O)[C@@H]3CC=CCC3)C[C@H](CO)C2)CC1
|
CCSCC=O)NCCNC=O)[C@@H]CC=CCC6)))))))C[C@H]CO))C7))))))))CC3
|
[C][C][S][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][C][=C][C][C][Ring1][=Branch1][C][C@H1][Branch1][Ring1][C][O][C][Ring1][P][C][C][Ring2][Ring1][=Branch1]
|
N14CCN5C[C@H]%10C1.[C@@H]19CC=CCC1.C178CC1.C48=O.C59=O.CC6.S67.C%10O
|
CC(C)N1CCC[C@H]1C(=O)N(C)CCCOCCN(C)C(=O)CCS(C)(=O)=O
|
CCC)NCCC[C@H]5C=O)NC)CCCOCCNC)C=O)CCSC)=O)=O
|
[C][C][Branch1][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][O][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][S][Branch1][C][C][=Branch1][C][=O][=O]
|
C3(=O)CCS(C)(=O)=O.N16CCC[C@H]19.C7CC4.CC6C.C29=O.N27C.C5C8.N38C.O45
|
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