SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
Cc1ncccc1CC(=O)N1CCO[C@@H](CC(=O)N(C)C[C@H]2CN(C)CCO2)C1
|
Ccncccc6CC=O)NCCO[C@@H]CC=O)NC)C[C@H]CNC)CCO6))))))))))C6
|
[C][C][=N][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][N][Branch1][C][C][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
Cc1ncccc18.N13CCO[C@@H]6C1.[C@H]17CN(C)CCO1.C8C3=O.C6C4=O.N45C.C57
|
CCCCCCC(=O)NC[C@]1(F)C[C@@H](NC(=O)CC(C)(C)CCC)C1
|
CCCCCCC=O)NC[C@]F)C[C@@H]NC=O)CCC)C)CCC)))))))C4
|
[C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Ring1][#C]
|
C3(=O)CC(C)(C)CCC.CCCCCCC2=O.[C@]16(F)C[C@H]5C1.N24.C46.N35
|
CCC[C@@H](CC)C(=O)N(CC)CC(C)(C)CNC(=O)Cc1c(C)noc1C
|
CCC[C@@H]CC))C=O)NCC))CCC)C)CNC=O)CccC)noc5C
|
[C][C][C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][=N][O][C][=Ring1][=Branch1][C]
|
CCC[C@@H](CC)C2=O.c17c(C)noc1C.C5C(C)(C)C6.C3(=O)C7.N245.C4C.N36
|
C#CC[C@]1(C(=O)NC(C)(CC)CC)CCCNC1
|
C#CC[C@]C=O)NCC)CC))CC)))))CCCNC6
|
[C][#C][C][C@][Branch1][S][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][Ring1][C][C][C][C][C][C][C][N][C][Ring1][#C]
|
[C@]145CCCNC1.C3(C)(CC)CC.C#CC5.C24=O.N23
|
C=CCOC[C@H](C(=O)N1C[C@H](NC(=O)CCc2nccs2)C[C@@H]1C)C(C)(C)C
|
C=CCOC[C@H]C=O)NC[C@H]NC=O)CCcnccs5)))))))))C[C@@H]5C)))))))CC)C)C
|
[C][=C][C][O][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][=N][C][=C][S][Ring1][Branch1][C][C@@H1][Ring1][#C][C][C][Branch1][C][C][Branch1][C][C][C]
|
C6[C@H](C3=O)C(C)(C)C.N13C[C@H]7C[C@@H]1C.C4(=O)CC8.c18nccs1.C=CC5.O56.N47
|
C[C@H]1[C@H]2CC[C@H](C[C@H]1NC(=O)CC(F)(F)F)N2C(=O)Cc1cccc(N)c1N
|
C[C@H][C@H]CC[C@H]C[C@H]7NC=O)CCF)F)F)))))))N5C=O)CcccccN)c6N
|
[C][C@H1][C@H1][C][C][C@H1][Branch2][Ring1][Ring1][C][C@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F][N][Ring1][#C][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1][N]
|
C[C@@H]1[C@H]5C[C@H]2CC[C@H]1N24.c16cccc(N)c1N.C3(=O)CC(F)(F)F.C4(=O)C6.N35
|
C=CCn1ncc2c(O)nc(=NCCN(C)C(=O)[C@@H](C)[C@@H]3CCCO3)[nH]c21
|
C=CCnncccO)nc=NCCNC)C=O)[C@@H]C)[C@@H]CCCO5)))))))))))[nH]c69
|
[C][=C][C][N][N][=C][C][C][Branch1][C][O][=N][C][=Branch2][Ring1][#Branch1][=N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C@@H1][C][C][C][O][Ring1][Branch1][NH1][C][=Ring2][Ring1][Branch1][Ring2][Ring1][Branch2]
|
n16ncc2c(O)nc(=NCC5)[nH]c21.C4(=O)[C@H]7C.[C@@H]17CCCO1.C=CC6.N45C
|
Cc1ncsc1C=CC(=O)N1CC[C@H](N(C)C(=O)Cc2cnns2)[C@@H](C)C1
|
Ccncsc5C=CC=O)NCC[C@H]NC)C=O)Cccnns5))))))))[C@@H]C)C6
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][=C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][P][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][=N][S][Ring1][Branch1][C@@H1][Branch1][C][C][C][Ring1][P]
|
N13CC[C@H]5[C@@H](C)C1.Cc1ncsc1C=6.c17cnns1.C=6C3=O.C4(=O)C7.N45C
|
CCC(CC)(OC)C(=O)N[C@H]1CN(C(=O)C(C)=C2CCCC2)C2(CCOCC2)C1
|
CCCCC))OC))C=O)N[C@H]CNC=O)CC)=CCCCC5)))))))CCCOCC6)))))C5
|
[C][C][C][Branch1][Ring1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][C][=C][C][C][C][C][Ring1][Branch1][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1]
|
[C@H]16CN4C2(CCOCC2)C1.CCC5(CC)C3=O.C4(=O)C=7C.C1=7CCCC1.O5C.N36
|
CCOCC(=O)N1CCC[C@]1(C)C(=O)N(C)CCn1ccnc1
|
CCOCC=O)NCCC[C@]5C)C=O)NC)CCnccnc5
|
[C][C][O][C][C][=Branch1][C][=O][N][C][C][C][C@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1]
|
N12CCC[C@@]17C.n18ccnc1.C5C2=O.C37=O.N36C.C6C8.CC4.O45
|
Cc1ccnn1CC(=O)N(C)C1CCN(Cc2cc(F)ccc2Cl)CC1
|
Ccccnn5CC=O)NC)CCCNCcccF)ccc6Cl))))))))CC6
|
[C][C][=C][C][=N][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][Branch1][=C][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Cl][C][C][Ring1][#C]
|
c17cc(F)ccc1Cl.C15CCN4CC1.Cc1ccnn16.C6C3=O.N35C.C47
|
CON=CC(=O)N1CC[C@H](NC(=O)c2ccc(OC(F)(F)F)c(C)c2)C(C)(C)C1
|
CON=CC=O)NCC[C@H]NC=O)ccccOCF)F)F)))cC)c6))))))))CC)C)C6
|
[C][O][N][=C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][C][=C][Ring1][N][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][#Branch1]
|
N13CC[C@H]6C(C)(C)C1.c17ccc5c(C)c1.CON=CC3=O.O5C(F)(F)F.C47=O.N46
|
CSC=CC(=O)N1C[C@H](CNC(=O)Cc2ccc(F)c(Cl)c2F)C2(CC2)C1
|
CSC=CC=O)NC[C@H]CNC=O)CccccF)cCl)c6F)))))))))))CCC3))C5
|
[C][S][C][=C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][F][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][Branch1]
|
c17ccc(F)c(Cl)c1F.N13C[C@H]6C2(CC2)C1.CSC=CC3=O.C4(=O)C7.C56.N45
|
C=CC1(CC(=O)N[C@H](CCO)C2CCCC2)CN(C(=O)c2cnn[nH]2)C1
|
C=CCCC=O)N[C@H]CCO)))CCCCC5)))))))))CNC=O)ccnn[nH]5))))))C4
|
[C][=C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring2][C][C][O][C][C][C][C][C][Ring1][Branch1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=N][NH1][Ring1][Branch1][C][Ring2][Ring1][Branch2]
|
C=CC17CN4C1.[C@H]58CCO.C18CCCC1.c16cnn[nH]1.C7C3=O.C46=O.N35
|
CNC(=O)[C@@H](c1cscn1)N(C)C[C@H]1COc2ccccc2O1
|
CNC=O)[C@@H]ccscn5)))))NC)C[C@H]COcccccc6O%10
|
[C][N][C][=Branch1][C][=O][C@@H1][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][N][Branch1][C][C][C][C@H1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#Branch2]
|
[C@H]16COc2ccccc2O1.C3(=O)[C@H]47.c17cscn1.N45C.CN3.C56
|
COc1ccc(CNC(=NCCCCn2ccnc2C)NCC(C)(C)C)c(C)c1
|
COccccCNC=NCCCCnccnc5C)))))))))))NCCC)C)C)))))))cC)c6
|
[C][O][C][=C][C][=C][Branch2][Ring1][=N][C][N][C][=Branch1][=C][=N][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][N][C][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][=C][Ring2][Ring1][O]
|
N4C(=NCCCC6)N5.c13ccc7c(C)c1.n16ccnc1C.C5C(C)(C)C.CO3.C47
|
CC[C@@H](CCc1ccccc1)C(=O)N1CC[C@H](NC(=O)CCF)C(C)(C)C1
|
CC[C@@H]CCcccccc6))))))))C=O)NCC[C@H]NC=O)CCF)))))CC)C)C6
|
[C][C][C@@H1][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][=Branch2][N][C][=Branch1][C][=O][C][C][F][C][Branch1][C][C][Branch1][C][C][C][Ring1][=C]
|
N12CC[C@H]4C(C)(C)C1.CC[C@@H](CC5)C2=O.c15ccccc1.C3(=O)CCF.N34
|
CC(C)=CC(=O)NC1CC2(C1)C[C@@H]2NC(=O)[C@H]1CCCN(CC(C)C)C1
|
CCC)=CC=O)NCCCC4)C[C@@H]3NC=O)[C@H]CCCNCCC)C)))C6
|
[C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][#Branch1][C][C][Branch1][C][C][C][C][Ring1][#Branch2]
|
C16CC2(C1)C[C@@H]27.[C@H]18CCCN5C1.C=9C3=O.C5C(C)C.CC=9C.C48=O.N36.N47
|
CN1C[C@](C)(NC(=O)C[C@@H](O)CNC(=O)[C@@]2(C)CC=CCC2)CCC1=O
|
CNC[C@]C)NC=O)C[C@@H]O)CNC=O)[C@@]C)CC=CCC6)))))))))))))CCC6=O
|
[C][N][C][C@][Branch1][C][C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][=C][C][C][Ring1][#Branch1][C][C][C][Ring2][Ring1][Branch2][=O]
|
CN1C[C@@]5(C)CCC1=O.C3(=O)C[C@@H](O)C6.[C@]17(C)CC=CCC1.C47=O.N35.N46
|
C=C(C)C[C@H](NC(=O)[C@H](C)CC)C(=O)NCC(C1CC1)C1CC1
|
C=CC)C[C@H]NC=O)[C@H]C)CC)))))C=O)NCCCCC3)))CCC3
|
[C][=C][Branch1][C][C][C][C@H1][Branch1][N][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][Ring1]
|
C=C(C)C[C@H]4C3=O.C2(=O)[C@H](C)CC.C5C67.C16CC1.C17CC1.N24.N35
|
Cc1c(C(=O)N2CCC[C@H]2CCCNC(=O)Cn2nnnc2C)cnn1C
|
CccC=O)NCCC[C@H]5CCCNC=O)Cnnnnc5C))))))))))))))))))cnn5C
|
[C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][N][N][=N][N][=C][Ring1][Branch1][C][C][=N][N][Ring2][Ring1][=Branch2][C]
|
Cc1c6cnn1C.N13CCC[C@H]18.n17nnnc1C.C8CC5.C4(=O)C7.C36=O.N45
|
CCC[C@@H](CNC(=O)c1cc[nH]c(=NC)c1)C(=O)NCc1scnc1C
|
CCC[C@@H]CNC=O)ccc[nH]c=NC))c6)))))))))C=O)NCcscnc5C
|
[C][C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=Branch1][Ring1][=N][C][C][=Ring1][Branch2][C][=Branch1][C][=O][N][C][C][S][C][=N][C][=Ring1][Branch1][C]
|
CCC[C@@H](C4)C3=O.c16cc[nH]c(=NC)c1.c17scnc1C.C26=O.N24.N35.C57
|
COc1cc(C)nc(N2C[C@H](C(=O)N3CCc4oc(C)nc4C3)CC(F)(F)C2)n1
|
COcccC)ncNC[C@H]C=O)NCCcocC)nc5C9))))))))))CCF)F)C6))))))n6
|
[C][O][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring2][#Branch1][N][C][C@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][O][C][Branch1][C][C][=N][C][=Ring1][=Branch1][C][Ring1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][Ring2][=N][Ring2][Ring1][O]
|
N15CCc2oc(C)nc2C1.N17C[C@H]8CC(F)(F)C1.c16cc(C)nc7n1.C58=O.CO6
|
O=C([C@H]1CCC[C@H]1Cc1ccccc1)N(CCF)CCF
|
O=C[C@H]CCC[C@H]5Ccccccc6))))))))))))NCCF)))CCF
|
[O][=C][Branch1][P][C@H1][C][C][C][C@H1][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][Ring2][C][C][F][C][C][F]
|
[C@H]15CCC[C@H]16.c17ccccc1.O=C25.N234.C3CF.C4CF.C67
|
CC1(C)CCN(C(=O)C#CC2CCC2)C[C@@H]1C(=O)N[C@H]1CCc2ncnn2C1
|
CCC)CCNC=O)C#CCCCC4)))))))C[C@@H]6C=O)N[C@H]CCcncnn5C9
|
[C][C][Branch1][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][#C][C][C][C][C][Ring1][Ring2][C][C@@H1][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C][=N][C][=N][N][Ring1][Branch1][C][Ring1][=Branch2]
|
CC1(C)CCN3C[C@@H]16.[C@H]15CCc2ncnn2C1.C3(=O)C#CC1CCC1.C46=O.N45
|
CC=CCC(=O)NC[C@@]1(F)CC[C@H](NC(=O)c2cccc(Cl)c2F)C1
|
CC=CCC=O)NC[C@@]F)CC[C@H]NC=O)cccccCl)c6F)))))))))C5
|
[C][C][=C][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][F][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][C][Ring1][P]
|
c17cccc(Cl)c1F.[C@]19(F)CC[C@H]6C1.C=8CC3=O.C47=O.CC=8.N35.C59.N46
|
C=C[C@H]1C[C@H](NC(=O)[C@@H]2[C@H](O)CCN2C(=O)[C@H](C)c2cncnc2)CCO1
|
C=C[C@H]C[C@H]NC=O)[C@@H][C@H]O)CCN5C=O)[C@H]C)ccncnc6)))))))))))))))CCO6
|
[C][=C][C@H1][C][C@H1][Branch2][Ring1][S][N][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=C][N][=C][N][=C][Ring1][=Branch1][C][C][O][Ring2][Ring1][=Branch2]
|
C=C[C@H]1C[C@H]5CCO1.[C@@H]16[C@H](O)CCN14.c17cncnc1.C4(=O)[C@@H]7C.C36=O.N35
|
CC(C)(O)CC(=O)N1CC[C@@]2(CCCC[C@@H]2NC(=O)CCN2CCC(O)CC2)C1
|
CCC)O)CC=O)NCC[C@@]CCCC[C@@H]6NC=O)CCNCCCO)CC6)))))))))))))))C5
|
[C][C][Branch1][C][C][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][#Branch2][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][C][Ring2][Ring1][=Branch1]
|
N13CC[C@@]2(CCCC[C@@H]26)C1.CC(C)(O)CC3=O.N15CCC(O)CC1.C4(=O)CC5.N46
|
C=CCCCC(=O)NC[C@H]1C[C@@H]1CNC(=O)c1cc(F)ccc1-n1ccnc1
|
C=CCCCC=O)NC[C@H]C[C@@H]3CNC=O)cccF)ccc6-nccnc5
|
[C][=C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][N][C][=C][N][=C][Ring1][Branch1]
|
c16cc(F)ccc19.C=CCCCC2=O.n19ccnc1.[C@H]17C[C@@H]18.C36=O.N24.C47.C58.N35
|
CCCC(=O)N1C[C@]2(F)CCC[C@]2(NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)C1
|
CCCC=O)NC[C@]F)CCC[C@]5NC=O)C=Ccccc[N+]=O)[O-]))cc6))))))))))C8
|
[C][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C][C][C@][Ring1][=Branch1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][Ring2][Ring1][#Branch1]
|
N13C[C@@]25CCC[C@@]2(F)C1.C=6c1ccc([N+](=O)[O-])cc1.CCCC3=O.C4(=O)C=6.N45
|
Cc1cncc(C(=O)NC2CC3(C2)C[C@@H]3NC(=O)[C@@H]2CCC(=O)C2)c1Cl
|
CccnccC=O)NCCCC4)C[C@@H]3NC=O)[C@@H]CCC=O)C5))))))))))))))c6Cl
|
[C][C][=C][N][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][C][Ring1][=Branch1][=C][Ring2][Ring1][Branch2][Cl]
|
Cc1cncc9c1Cl.C16CC2(C1)C[C@@H]27.[C@@H]18CCC(=O)C1.C49=O.C58=O.N46.N57
|
CCCc1ccc(-c2cn([C@@H](COCC)C(=O)NC3CSC3)nn2)cc1
|
CCCcccc-ccn[C@@H]COCC))))C=O)NCCSC4)))))))nn5)))))cc6
|
[C][C][C][C][=C][C][=C][Branch2][Ring1][=N][C][=C][N][Branch2][Ring1][Ring1][C@@H1][Branch1][Branch1][C][O][C][C][C][=Branch1][C][=O][N][C][C][S][C][Ring1][Ring2][N][=N][Ring1][P][C][=C][Ring2][Ring1][#Branch1]
|
c19ccc%10cc1.c1%10cn8nn1.[C@H]8(C5)C4=O.C17CSC1.CCC9.O56.C6C.N47
|
CCCn1cc(CN2C[C@@H](F)C[C@@H]2C(=O)Nc2c(C#N)c(Br)nn2C(C)C)cn1
|
CCCnccCNC[C@@H]F)C[C@@H]5C=O)NccC#N))cBr)nn5CC)C)))))))))))))))cn5
|
[C][C][C][N][C][=C][Branch2][Ring2][Ring2][C][N][C][C@@H1][Branch1][C][F][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][Branch1][Ring1][C][#N][C][Branch1][C][Br][=N][N][Ring1][Branch2][C][Branch1][C][C][C][C][=N][Ring2][Ring1][#Branch2]
|
c15c(C#N)c(Br)nn18.N14C[C@@H](F)C[C@@H]16.n17cc9cn1.CCC7.C36=O.C8(C)C.C49.N35
|
O=C(N[C@H](Cc1cc[nH]n1)C(=O)N1C[C@H]2CC[C@H]1C2)C1=NOCC1
|
O=CN[C@H]Cccc[nH]n5))))))C=O)NC[C@H]CC[C@H]6C5))))))))))C=NOCC5
|
[O][=C][Branch2][Ring1][N][N][C@H1][Branch1][=Branch2][C][C][C][=C][NH1][N][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Ring1][=Branch1][C][Ring1][Branch1][C][=N][O][C][C][Ring1][Branch1]
|
O=C3C1=NOCC1.N14C[C@H]2CC[C@H]1C2.[C@@H]5(C6)C4=O.c16cc[nH]n1.N35
|
Cc1ncnc(O)c1C(=O)N1CC(O)([C@H](C)NC(=O)c2cnn(C(C)C)c2C)C1
|
CcncncO)c6C=O)NCCO)[C@H]C)NC=O)ccnnCC)C))c5C)))))))))C4
|
[C][C][=N][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch2][Ring1][=Branch2][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][C][C][=Ring1][Branch2][C][C][Ring2][Ring1][Ring1]
|
Cc1ncnc(O)c16.c17cnn8c1C.N13CC9(O)C1.C36=O.[C@@H]59C.C47=O.C8(C)C.N45
|
Cc1nn(CC(=O)NC[C@@H]2CCN(C(=O)CS(C)(=O)=O)C2(C)C)c(C)c1Cl
|
CcnnCC=O)NC[C@@H]CCNC=O)CSC)=O)=O))))C5C)C))))))))))cC)c5Cl
|
[C][C][=N][N][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][N][Branch1][C][C][C][C][Branch1][C][C][=C][Ring2][Ring1][=Branch2][Cl]
|
Cc1nn6c(C)c1Cl.[C@@H]17CCN4C1(C)C.C4(=O)CS(C)(=O)=O.C6C3=O.N35.C57
|
C[C@@H](CN(C)C(=O)[C@@H]1COc2cc(O)ccc2C1)NC(=O)CSC1CC1
|
C[C@@H]CNC)C=O)[C@@H]COcccO)ccc6C%10)))))))))))))NC=O)CSCCC3
|
[C][C@@H1][Branch2][Ring1][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][Ring1][O][N][C][=Branch1][C][=O][C][S][C][C][C][Ring1][Ring1]
|
[C@@H]18COc2cc(O)ccc2C1.C[C@H]5C6.C4(=O)C7.N36C.C38=O.C19CC1.N45.S79
|
O=C(Cn1c(CCc2nc[nH]n2)nnc1N1CCc2sc(Cl)cc2C1)NCCO
|
O=CCncCCcnc[nH]n5)))))))nnc5NCCcscCl)cc5C9)))))))))))))))NCCO
|
[O][=C][Branch2][Ring2][Ring2][C][N][C][Branch1][#Branch2][C][C][C][N][=C][NH1][N][=Ring1][Branch1][=N][N][=C][Ring1][N][N][C][C][C][S][C][Branch1][C][Cl][=C][C][=Ring1][=Branch1][C][Ring1][#Branch2][N][C][C][O]
|
N15CCc2sc(Cl)cc2C1.n16c5nnc17.c18nc[nH]n1.O=C3C6.C7C8.C4CO.N34
|
CC[C@H]1CC[C@H](C(=O)NCCC[C@H](C)NC(=O)c2cc(F)c(C)cc2N)CC1
|
CC[C@H]CC[C@H]C=O)NCCC[C@H]C)NC=O)cccF)cC)cc6N)))))))))))))))CC6
|
[C][C][C@H1][C][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][C][Branch1][C][F][=C][Branch1][C][C][C][=C][Ring1][Branch2][N][C][C][Ring2][Ring1][#Branch2]
|
c18cc(F)c(C)cc1N.[C@H]19CC[C@H]7CC1.C5CC[C@@H]6C.C37=O.C48=O.CC9.N35.N46
|
C/C(=C\C(=O)N1C[C@@H]2[C@@H](CNc3ncc(F)cn3)[C@@H]2C1)C(C)C
|
C/C=C\C=O)NC[C@@H][C@@H]CNcnccF)cn6))))))))[C@@H]3C6))))))))CC)C
|
[C][/C][=Branch2][Ring1][#C][=C][\C][=Branch1][C][=O][N][C][C@@H1][C@@H1][Branch1][=C][C][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C@@H1][Ring1][N][C][Ring1][#C][C][Branch1][C][C][C]
|
N14C[C@@H]2[C@@H]8[C@@H]2C1.c16ncc(F)cn1.CC=7C(C)C.C=7C4=O.C58.N56
|
N=C(O)OCCCNC(=O)[C@@H]1CCC[C@@H](NC(=O)CC23CCC(CC2)C3)CC1
|
N=CO)OCCCNC=O)[C@@H]CCC[C@@H]NC=O)CCCCCCC6))C5))))))))CC7
|
[N][=C][Branch1][C][O][O][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1][C][C][Ring2][Ring1][C]
|
[C@@H]19CCC[C@@H]8CC1.C12%10CCC(CC1)C2.N=C(O)O6.C6CC7.C5(=O)C%10.C49=O.N47.N58
|
O=C(Cc1cnc2ccccc2c1)N1CC2(C1)CN(C(=O)[C@@]1(F)CC=CCC1)C2
|
O=CCccncccccc6c%10)))))))))))NCCC4)CNC=O)[C@@]F)CC=CCC6)))))))C4
|
[O][=C][Branch1][S][C][C][=C][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch1][S][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][=C][C][C][Ring1][#Branch1][C][Ring1][=C]
|
c16cnc2ccccc2c1.N13CC2(C1)CN4C2.[C@]15(F)CC=CCC1.O=C3C6.C45=O
|
CN(C)Cc1cc(C(=O)N2CCCC[C@H](CNC(=O)c3cncnc3)C2)ccn1
|
CNC)CcccC=O)NCCCC[C@H]CNC=O)ccncnc6)))))))))C7))))))))ccn6
|
[C][N][Branch1][C][C][C][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][N][=C][N][=C][Ring1][=Branch1][C][Ring1][P][=C][C][=N][Ring2][Ring1][=Branch2]
|
N14CCCC[C@H]%11C1.c1%10cc8ccn1.c19cncnc1.CN6C.C48=O.C59=O.C6%10.C7%11.N57
|
CCCc1cc(C(=O)NC[C@@H](CC(C)C)NC(=O)[C@H](C)c2cc[nH]n2)n(C)n1
|
CCCcccC=O)NC[C@@H]CCC)C)))NC=O)[C@H]C)ccc[nH]n5))))))))))))nC)n5
|
[C][C][C][C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=C][NH1][N][=Ring1][Branch1][N][Branch1][C][C][N][=Ring2][Ring1][=Branch2]
|
c18cc7n(C)n1.C5[C@H]6CC(C)C.C4(=O)[C@@H]9C.c19cc[nH]n1.CCC8.C37=O.N35.N46
|
O=C(NC1CCCCC1)[C@H](C1CC2(CCOCC2)C1)N1CC[C@@](F)(CF)C1
|
O=CNCCCCCC6)))))))[C@H]CCCCCOCC6)))))C4))))NCC[C@@]F)CF))C5
|
[O][=C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][C@H1][Branch1][S][C][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=Branch2][N][C][C][C@@][Branch1][C][F][Branch1][Ring1][C][F][C][Ring1][Branch2]
|
C16CC2(CCOCC2)C1.N14CC[C@]7(F)C1.C15CCCCC1.O=C3[C@@H]46.N35.C7F
|
C[C@H](CCCNC(=O)c1cn(C)c(=O)n1C)NC(=O)C1CCN(C(N)=O)CC1
|
C[C@H]CCCNC=O)ccnC)c=O)n5C)))))))))))NC=O)CCCNCN)=O))CC6
|
[C][C@H1][Branch2][Ring1][#Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][C][N][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2]
|
c17cn(C)c(=O)n1C.C18CCN4CC1.C[C@@H]5CCC6.C27=O.C38=O.C4(N)=O.N26.N35
|
CC(Cl)=CC(=O)N1CC2(CCN(C(=O)C[C@@H](O)CC(C)(C)C)CC2)C[C@H]1C
|
CCCl)=CC=O)NCCCCNC=O)C[C@@H]O)CCC)C)C))))))CC6)))))C[C@H]5C
|
[C][C][Branch1][C][Cl][=C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][S][C][C@H1][Ring2][Ring1][Ring2][C]
|
N13CC2(CCN4CC2)C[C@H]1C.C4(=O)C[C@@H](O)CC(C)(C)C.C=5C3=O.CC=5Cl
|
Cc1occc1C(=O)N1CCC[C@H](C)[C@@H]1CNC(=O)[C@@H](C)C(=O)OC(C)(C)C
|
Ccoccc5C=O)NCCC[C@H]C)[C@@H]6CNC=O)[C@@H]C)C=O)OCC)C)C
|
[C][C][O][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][C][C][C@@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
N13CCC[C@H](C)[C@@H]18.C4(=O)[C@@H](C)C2=O.Cc1occc17.C5(C)(C)C.C37=O.C68.N46.O25
|
CCCC=C(CC)C(=O)N1CC[C@@](C)(NC(=O)c2cc(F)c(F)cc2O)C1
|
CCCC=CCC))C=O)NCC[C@@]C)NC=O)cccF)cF)cc6O)))))))))C5
|
[C][C][C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][O][C][Ring2][Ring1][C]
|
c16cc(F)c(F)cc1O.N13CC[C@]5(C)C1.C=7(CC)C3=O.CCCC=7.C46=O.N45
|
CCn1cccc1C(=O)NCCCN(C(=O)[C@@H]1COCC[C@@H]1C)C1CCCC1
|
CCncccc5C=O)NCCCNC=O)[C@@H]COCC[C@@H]6C))))))))CCCCC5
|
[C][C][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][C][O][C][C][C@@H1][Ring1][=Branch1][C][C][C][C][C][C][Ring1][Branch1]
|
[C@@H]18COCC[C@@H]1C.n19cccc17.C16CCCC1.C4CC5.C27=O.N356.C38=O.CC9.N24
|
C=CCOCC(=O)N[C@H](C(=O)N1CC[C@@H]1C1CCCCC1)C(C)(C)O
|
C=CCOCC=O)N[C@H]C=O)NCC[C@@H]4CCCCCC6)))))))))))CC)C)O
|
[C][=C][C][O][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][C][C][C][C][C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][O]
|
[C@@H]6(C3=O)C(C)(C)O.C17CCCCC1.N13CC[C@@H]17.C5C2=O.C=CC4.O45.N26
|
CNC(=O)NCC(=O)N[C@](C)(CNC(=O)c1ccc2cccnc2c1F)C1CC1
|
CNC=O)NCC=O)N[C@]C)CNC=O)cccccccnc6c%10F))))))))))))))CCC3
|
[C][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@][Branch1][C][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2][F][C][C][C][Ring1][Ring1]
|
c1%10ccc2cccnc2c1F.[C@]8%11(C)C9.C7C5=O.C34=O.C6%10=O.C1%11CC1.CN3.N47.N58.N69
|
CCCC(C)(C)CC(=O)N(C)C[C@@H](C)C(=O)Nc1cnc(SC)nc1
|
CCCCC)C)CC=O)NC)C[C@@H]C)C=O)NccncSC))nc6
|
[C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][=C][N][=C][Branch1][Ring1][S][C][N][=C][Ring1][Branch2]
|
CCCC(C)(C)CC2=O.c15cnc6nc1.C4[C@@H](C)C3=O.N24C.N35.S6C
|
COC(=O)CCCNC(=O)[C@@H]1C[C@@]12CCN(c1ncc(F)c(SC)n1)C2
|
COC=O)CCCNC=O)[C@@H]C[C@@]3CCNcnccF)cSC))n6))))))C5
|
[C][O][C][=Branch1][C][=O][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@@][Ring1][Ring1][C][C][N][Branch1][S][C][=N][C][=C][Branch1][C][F][C][Branch1][Ring1][S][C][=N][Ring1][=Branch2][C][Ring1][=C]
|
[C@@H]17C[C@@]12CCN6C2.c16ncc(F)c8n1.C3(=O)CCC5.C47=O.CO3.N45.S8C
|
CC(C)[C@H](CNC(=O)[C@@H]1CN2CCN1C[C@@H]2C)NC(=O)c1cnc(O)o1
|
CCC)[C@H]CNC=O)[C@@H]CNCCN6C[C@@H]6C))))))))))))NC=O)ccncO)o5
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][C][N][C][C][N][Ring1][=Branch1][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][O][Ring1][=Branch1]
|
[C@@H]17CN2CCN1C[C@@H]2C.CC(C)[C@@H]5C6.c18cnc(O)o1.C37=O.C48=O.N36.N45
|
CC1(CC(=O)N2CC[C@H](C(=O)NCc3cccc(CO)c3)C23CCC3)CCC1
|
CCCC=O)NCC[C@H]C=O)NCcccccCO))c6)))))))))C5CCC4))))))))))CCC4
|
[C][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][Ring1][C][O][=C][Ring1][Branch2][C][Ring1][P][C][C][C][Ring1][Ring2][C][C][C][Ring2][Ring1][O]
|
N14CC[C@H]7C12CCC2.c19cccc%10c1.CC18CCC1.C8C4=O.C57=O.N56.C69.C%10O
|
Cc1ccnc(Cl)c1NC(=O)C[C@@H]1COCCN1C(=O)c1cncc(O)c1
|
CcccncCl)c6NC=O)C[C@@H]COCCN6C=O)ccnccO)c6
|
[C][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][O][=C][Ring1][#Branch1]
|
Cc1ccnc(Cl)c14.[C@@H]16COCCN13.c15cncc(O)c1.C2(=O)C6.C35=O.N24
|
CCOCCOCC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)c1cnccc1C(F)F
|
CCOCCOCC=O)NC[C@@H]CCCC[C@@H]6NC=O)ccnccc6CF)F
|
[C][C][O][C][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][F]
|
[C@@H]13CCCC[C@@H]1%11.c1%12cnccc14.C9C2=O.C7C8.C5%12=O.C4(F)F.CC6.O67.O89.N2%10.C%103.N5%11
|
Cc1cc[nH]c1C(=O)N1CC[C@H]([C@@H]2CCCN(C(=O)C3=C(Cl)CCCC3)C2)C1
|
Cccc[nH]c5C=O)NCC[C@H][C@@H]CCCNC=O)C=CCl)CCCC6)))))))C6))))))C5
|
[C][C][C][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][#Branch2][C@@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][C][C][C][Ring1][#Branch1][C][Ring1][#C][C][Ring2][Ring1][Ring2]
|
N14CC[C@H]([C@@H]2CCCN5C2)C1.C5(=O)C1=C(Cl)CCCC1.Cc1cc[nH]c16.C46=O
|
COCc1nc(C(=O)NC[C@H](CNC(=O)[C@H]2C[C@@H](C)O[C@@H](C)C2)C(F)(F)F)cs1
|
COCcncC=O)NC[C@H]CNC=O)[C@H]C[C@@H]C)O[C@@H]C)C6)))))))))CF)F)F))))))cs5
|
[C][O][C][C][=N][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][Ring1][Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][S][Ring2][Ring1][#Branch2]
|
C6[C@H](C7)C(F)(F)F.[C@H]19C[C@@H](C)O[C@@H](C)C1.c1%10nc8cs1.C38=O.C49=O.CO5.C5%10.N36.N47
|
CS(=O)(=O)NCc1cn(C[C@H]2CCN(C(=O)c3cn4c(n3)SCC4)C2)nn1
|
CS=O)=O)NCccnC[C@H]CCNC=O)ccncn5)SCC5))))))))C5))))))nn5
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][N][Branch2][Ring1][=C][C][C@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][S][C][C][Ring1][=Branch1][C][Ring1][#C][N][=N][Ring2][Ring1][Branch1]
|
c18cn2c(n1)SCC2.c1%10cn9nn1.[C@H]1%11CCN5C1.CS7(=O)=O.C58=O.N67.C6%10.C9%11
|
Cc1nccc(C(=O)NCCC2(C(=O)N3C[C@H](CO)[C@@H](C)C3)CCC2)n1
|
CcncccC=O)NCCCC=O)NC[C@H]CO))[C@@H]C)C5))))))CCC4))))))))n6
|
[C][C][=N][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][C][C][Ring1][Branch2][C][C][C][Ring1][=C][=N][Ring2][Ring1][=Branch2]
|
Cc1nccc7n1.N15C[C@H]%10[C@@H](C)C1.C189CCC1.C47=O.C6C9.C58=O.N46.C%10O
|
Cc1cccc2c1OC[C@@H]2C(=O)NC[C@H]1CN(C(=O)C2(C(N)=O)CC2)CCCO1
|
Ccccccc6OC[C@@H]5C=O)NC[C@H]CNC=O)CCN)=O))CC3))))CCCO7
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch1][C][C][C][O][Ring1][#C]
|
Cc1cccc2c1OC[C@@H]2C3=O.[C@H]18CN4CCCO1.C167CC1.C46=O.C7(N)=O.N35.C58
|
CO[C@]1(C(=O)N2CCC[C@H](C(=O)NCc3nc[nH]n3)C2)CC[C@@H](C)C1
|
CO[C@]C=O)NCCC[C@H]C=O)NCcnc[nH]n5))))))))C6)))))))CC[C@@H]C)C5
|
[C][O][C@][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C][C][N][=C][NH1][N][=Ring1][Branch1][C][Ring1][#C][C][C][C@@H1][Branch1][C][C][C][Ring2][Ring1][#Branch1]
|
[C@@]168CC[C@@H](C)C1.N14CCC[C@H]9C1.c1%10nc[nH]n1.C48=O.C59=O.CO6.N57.C7%10
|
C=CCOc1ccccc1C(=O)N[C@H]1C[C@@H]2C[C@H]1[C@H](NC(=O)C1(CCC)CC1)C2
|
C=CCOcccccc6C=O)N[C@H]C[C@@H]C[C@H]5[C@H]NC=O)CCCC)))CC3)))))C5
|
[C][=C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C@@H1][C][C@H1][Ring1][Branch1][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][Branch1][Ring2][C][C][C][C][C][Ring1][=Branch1][C][Ring1][=C]
|
[C@H]17C[C@@H]2C[C@H]1[C@H]8C2.c16ccccc1%10.C19%11CC1.C=CC5.C3%10=O.C49=O.C%11CC.O56.N37.N48
|
CC(C)Cc1ccnc(C(=O)N2CCC[C@@H]([C@H](C)NC(=O)CC3CCC3)C2)c1F
|
CCC)CcccncC=O)NCCC[C@@H][C@H]C)NC=O)CCCCC4))))))))C6)))))))c6F
|
[C][C][Branch1][C][C][C][C][=C][C][=N][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][P][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][C][Ring1][S][=C][Ring2][Ring1][Branch2][F]
|
c1%10ccnc7c1F.N14CCC[C@@H]8C1.CC(C)C%10.C5(=O)C9.C19CCC1.C47=O.[C@@H]68C.N56
|
CCc1ccc(CNC(=O)[C@@H]2CC3(CCN2C(=O)[C@@H](C)CN(C)C)CC3)o1
|
CCccccCNC=O)[C@@H]CCCCN6C=O)[C@@H]C)CNC)C))))))))CC3))))))))o5
|
[C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][C@@H1][C][C][Branch2][Ring1][Ring2][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][C][C][Ring1][=C][O][Ring2][Ring1][=Branch2]
|
[C@@H]18CC2(CCN15)CC2.c19ccc%10o1.C5(=O)[C@@H](C)C7.C48=O.N7(C)C.CC9.C6%10.N46
|
CC(Cl)=CC(=O)NC[C@]1(C)CC[C@@H](NC(=O)c2[nH]c(C3CC3)nc2C)C1
|
CCCl)=CC=O)NC[C@]C)CC[C@@H]NC=O)c[nH]cCCC3)))nc5C))))))))C5
|
[C][C][Branch1][C][Cl][=C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][NH1][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=Ring1][Branch2][C][C][Ring2][Ring1][C]
|
[C@@]1%10(C)CC[C@@H]7C1.c18[nH]c%11nc1C.C=9C4=O.CC=9Cl.C58=O.C1%11CC1.N46.C6%10.N57
|
CC(C)[C@]1(C(=O)N2CC[C@@](O)(C(N)=O)C2)CCCN1C(=O)CCOCC1CCC1
|
CCC)[C@]C=O)NCC[C@@]O)CN)=O))C5))))))CCCN5C=O)CCOCCCCC4
|
[C][C][Branch1][C][C][C@][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][O][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring1][=Branch2][C][C][C][N][Ring1][S][C][=Branch1][C][=O][C][C][O][C][C][C][C][C][Ring1][Ring2]
|
[C@]179CCCN14.N13CC[C@]8(O)C1.C4(=O)CC5.C1%10CCC1.CC9C.C37=O.C8(N)=O.O56.C6%10
|
C[C@@H](C#N)CN(C)c1nc(N2CCS(=O)(=O)C(C)(C)C2)nc2cccnc12
|
C[C@@H]C#N))CNC)cncNCCS=O)=O)CC)C)C6))))))nccccnc%106
|
[C][C@@H1][Branch1][Ring1][C][#N][C][N][Branch1][C][C][C][=N][C][Branch2][Ring1][Branch1][N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2][=N][C][=C][C][=C][N][=C][Ring2][Ring1][Ring2][Ring1][=Branch1]
|
c14nc5nc2cccnc12.N15CCS(=O)(=O)C(C)(C)C1.C[C@@H](C#N)C3.N34C
|
C=C1CC(CC(=O)N(CCCO)CCC(=O)N[C@H](C)c2ccncc2)C1
|
C=CCCCC=O)NCCCO))))CCC=O)N[C@H]C)cccncc6))))))))))))))C4
|
[C][=C][C][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][Branch1][Branch1][C][C][C][O][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch2]
|
c19ccncc1.C=C1CC8C1.C6CC4=O.C8C3=O.C5CCO.N356.[C@H]79C.N47
|
CNc1cc(C(=O)N(C)CC(C)(C)CNC(=O)c2cc(C(N)=O)c[nH]2)cc(Cl)n1
|
CNcccC=O)NC)CCC)C)CNC=O)cccCN)=O))c[nH]5))))))))))))ccCl)n6
|
[C][N][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][NH1][Ring1][Branch2][=C][C][Branch1][C][Cl][=N][Ring2][Ring1][O]
|
c17cc9cc(Cl)n1.C5C(C)(C)C6.c18cc%10c[nH]1.C39=O.N35C.C48=O.C%10(N)=O.CN7.N46
|
CCOCC1(C(=O)N[C@H]2C[C@@H](CCC(=O)N[C@@H]3CCC[C@H]3C)C2)CCC1
|
CCOCCC=O)N[C@H]C[C@@H]CCC=O)N[C@@H]CCC[C@H]5C))))))))))C4))))))CCC4
|
[C][C][O][C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][S][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][C][Ring1][#C][C][C][C][Ring2][Ring1][=Branch1]
|
[C@@H]19CCC[C@H]1C.C1%10%11CCC1.[C@H]18C[C@@H]%12C1.C%12CC5=O.C4%10=O.CC6.O67.C7%11.N48.N59
|
O=C(CCCCO)N[C@@H]1CCCC[C@]12CCN(C(=O)Cc1cc(Cl)ccc1O)C2
|
O=CCCCCO)))))N[C@@H]CCCC[C@]6CCNC=O)CcccCl)ccc6O)))))))))C5
|
[O][=C][Branch1][=Branch1][C][C][C][C][O][N][C@@H1][C][C][C][C][C@][Ring1][=Branch1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][Ring1][S]
|
[C@@H]15CCCC[C@]12CCN4C2.c16cc(Cl)ccc1O.O=C3CCCCO.C4(=O)C6.N35
|
C/C(=C\C(=O)N1CCN(C(=O)C(=O)N(C)C)C[C@H]1c1cccc(Cl)c1)C(F)(F)F
|
C/C=C\C=O)NCCNC=O)C=O)NC)C))))C[C@H]6cccccCl)c6))))))))))))))CF)F)F
|
[C][/C][=Branch2][Ring2][Branch2][=C][\C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C@H1][Ring1][=N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
N12CCN3C[C@H]16.c16cccc(Cl)c1.CC=5C(F)(F)F.C3(=O)C4=O.C=5C2=O.N4(C)C
|
CCc1noc(CCC(=O)N2C[C@@H](O)[C@H](NC(=O)[C@@H](C(C)C)N(CC)CC)C2)n1
|
CCcnocCCC=O)NC[C@@H]O)[C@H]NC=O)[C@@H]CC)C))NCC))CC))))))C5))))))))n5
|
[C][C][C][=N][O][C][Branch2][Ring2][=Branch2][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][Branch1][Ring1][C][C][C][C][C][Ring2][Ring1][C][=N][Ring2][Ring1][O]
|
N13C[C@@H]8[C@H](O)C1.C4(=O)[C@H]5C(C)C.c19noc%10n1.C%10CC3=O.N567.CC9.N48.C6C.C7C
|
COC[C@@H](C)CC(=O)N1CC[C@](OC)(C(=O)Nc2ccc(C3CC3)cc2)C1
|
COC[C@@H]C)CC=O)NCC[C@]OC))C=O)NccccCCC3)))cc6))))))))C5
|
[C][O][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][Ring1][O][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring1][=Branch2][C][Ring2][Ring1][Ring1]
|
C6[C@@H](C)CC4=O.N14CC[C@]79C1.c18ccc%10cc1.C59=O.C1%10CC1.CO6.O7C.N58
|
OCCCCC1(N[C@@H](c2nnnn2Cc2ccccc2)C2CC=CC2)CC1
|
OCCCCCN[C@@H]cnnnn5Ccccccc6))))))))))))CCC=CC5)))))))CC3
|
[O][C][C][C][C][C][Branch2][Ring1][N][N][C@@H1][Branch1][P][C][=N][N][=N][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][=C][C][Ring1][Branch1][C][C][Ring2][Ring1][=Branch1]
|
c16nnnn15.c19ccccc1.OCCCC7.C18CC=CC1.C137CC1.[C@H]468.N34.C59
|
CC[C@H](C)C(=O)NCC(=O)N1CC2(CCN(C(=O)c3cnc4c(c3)COC4)C2)C1
|
CC[C@H]C)C=O)NCC=O)NCCCCNC=O)ccnccc6)COC5)))))))))C5))))C4
|
[C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][O][C][Ring1][=Branch1][C][Ring1][S][C][Ring2][Ring1][Ring1]
|
N16CC2(CCN7C2)C1.c19cnc2c(c1)COC2.CC[C@H](C)C5=O.C8C6=O.C79=O.N58
|
C[C@H](Cc1cccnc1)NC(=O)[C@@H](N)c1ccc(SC(F)(F)F)cc1
|
C[C@H]Cccccnc6)))))))NC=O)[C@@H]N)ccccSCF)F)F)))cc6
|
[C][C@H1][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][=C][C][=C][Branch1][#Branch2][S][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O]
|
c15ccc6cc1.c14cccnc1.C2(=O)[C@H]5N.S6C(F)(F)F.C[C@@H]3C4.N23
|
CC(C)[C@@H]1CN(C(=O)[C@]23CSC[C@@H]2C3)C[C@H]1C(=O)NCC1(F)CN(C)C1
|
CCC)[C@@H]CNC=O)[C@]CSC[C@@H]5C6)))))))C[C@H]5C=O)NCCF)CNC)C4
|
[C][C][Branch1][C][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C@][C][S][C][C@@H1][Ring1][Branch1][C][Ring1][=Branch1][C][C@H1][Ring1][=N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][N][Branch1][C][C][C][Ring1][=Branch1]
|
[C@@H]19CN4C[C@H]18.[C@]127CSC[C@@H]1C2.C1%10(F)CN(C)C1.CC9C.C47=O.C58=O.N56.C6%10
|
Cc1nnc(C(=O)NC[C@H](C)NC(=O)[C@@H]2CCCN2Cc2ccccn2)s1
|
CcnncC=O)NC[C@H]C)NC=O)[C@@H]CCCN5Ccccccn6))))))))))))))))))s5
|
[C][C][=N][N][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][C][=C][C][=C][C][=N][Ring1][=Branch1][S][Ring2][Ring1][#Branch2]
|
Cc1nnc9s1.[C@@H]18CCCN17.c1%10ccccn1.C5[C@@H]6C.C39=O.C48=O.N35.N46.C7%10
|
CCOc1nccc(C(=O)N[C@@H]2CN(C(=O)C(F)(F)CC3CC3)C[C@@H]2C)c1F
|
CCOcncccC=O)N[C@@H]CNC=O)CF)F)CCCC3))))))C[C@@H]5C))))))))c6F
|
[C][C][O][C][=N][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][C][C][C][Ring1][Ring1][C][C@@H1][Ring1][=C][C][=C][Ring2][Ring1][Branch2][F]
|
c17nccc9c1F.[C@@H]18CN5C[C@@H]1C.C5(=O)C(F)(F)C%10.C49=O.C1%10CC1.CC6.O67.N48
|
CO[C@H](CC(C)(C)C)C(=O)NC[C@H]1CC[C@@H](C(=O)NCc2cncc(F)c2)C1
|
CO[C@H]CCC)C)C)))C=O)NC[C@H]CC[C@@H]C=O)NCccnccF)c6)))))))))C5
|
[C][O][C@H1][Branch1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][N][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring1][S]
|
[C@@H]5(CC(C)(C)C)C3=O.c1%10cncc(F)c1.[C@H]19CC[C@@H]8C1.C48=O.CO5.N36.C69.N47.C7%10
|
C[C@H](CC(=O)NCCCCNC(N)=O)NC(=O)[C@@H](C)C#N
|
C[C@H]CC=O)NCCCCNCN)=O))))))))))NC=O)[C@@H]C)C#N
|
[C][C@H1][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C][C][N][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][#N]
|
C[C@@H]4CC1=O.C3(=O)[C@@H](C)C#N.C5CCC6.C2(N)=O.N15.N26.N34
|
C=CC(C)(C)NC(=O)COCCNC(=O)[C@H]1C[C@@H](N(C)CC)C1
|
C=CCC)C)NC=O)COCCNC=O)[C@H]C[C@@H]NC)CC)))C4
|
[C][=C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][O][C][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][#Branch1][N][Branch1][C][C][C][C][C][Ring1][Branch2]
|
C=CC6(C)C.[C@H]1%10C[C@@H]9C1.C2(=O)C4.C5C7.C3%10=O.N89C.N26.O45.N37.C8C
|
COC[C@@H](O)C(=O)N1C[C@@H]2C[C@@H](CNC(=O)c3cc(OC)cc(OC)c3)[C@@H]2C1
|
COC[C@@H]O)C=O)NC[C@@H]C[C@@H]CNC=O)cccOC))ccOC))c6)))))))))[C@@H]4C7
|
[C][O][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C@@H1][Ring2][Ring1][C][C][Ring2][Ring1][Branch1]
|
N14C[C@@H]2C[C@@H]%11[C@@H]2C1.c1%10cc7cc8c1.C6[C@@H](O)C4=O.C5%10=O.CO6.C9%11.N59.O7C.O8C
|
CCc1ncoc1C(=O)N1C[C@H](N=[N+]=[N-])[C@H](NC(=O)c2n[nH]cc2Cl)C1
|
CCcncoc5C=O)NC[C@H]N=[N+]=[N-])))[C@H]NC=O)cn[nH]cc5Cl))))))))C5
|
[C][C][C][N][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring2][N][=N+1][=N-1][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][Cl][C][Ring1][P]
|
N13C[C@@H]5[C@@H](N=[N+]=[N-])C1.c18ncoc16.c17n[nH]cc1Cl.C36=O.C47=O.CC8.N45
|
Cc1ccc(CCC(=O)N2CCCC[C@@H]2CCCNC(=O)CCCN(C)C)cn1
|
CccccCCC=O)NCCCC[C@@H]6CCCNC=O)CCCNC)C)))))))))))))))))))cn6
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][N][Branch1][C][C][C][C][=N][Ring2][Ring1][N]
|
Cc1ccc8cn1.N13CCCC[C@@H]17.C4(=O)CCC6.C8CC3=O.C7CC5.N6(C)C.N45
|
O=C(CCN1CCNC(=O)C1)NC[C@H]1CC[C@H]1NC(=O)[C@H]1SCc2cccnc21
|
O=CCCNCCNC=O)C6))))))))NC[C@H]CC[C@H]4NC=O)[C@H]SCccccnc69
|
[O][=C][Branch1][=C][C][C][N][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][N][C][C@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][S][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring1][=Branch2]
|
C4(=O)[C@H]1SCc2cccnc21.N15CCNC(=O)C1.O=C3CC5.[C@H]18CC[C@H]17.N36.C68.N47
|
COc1cc(C)sc1C(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2CO)[C@@H]1C
|
COcccC)sc5C=O)N[C@@H]CCCNC=O)Ccccccc6CO))))))))))[C@@H]6C
|
[C][O][C][C][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][C@@H1][Ring1][P][C]
|
[C@@H]16CCCN4[C@@H]1C.c15cc(C)sc17.c18ccccc19.C4(=O)C8.C37=O.CO5.N36.C9O
|
C=CCn1cc(NC(=O)CO[C@H]2C[C@@H](NC(=O)C3(C=C)CCOCC3)C2)cn1
|
C=CCnccNC=O)CO[C@H]C[C@@H]NC=O)CC=C))CCOCC6))))))))C4))))))))cn5
|
[C][=C][C][N][C][=C][Branch2][Ring2][C][N][C][=Branch1][C][=O][C][O][C@H1][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][=C][C][C][O][C][C][Ring1][Branch2][C][Ring1][#C][C][=N][Ring2][Ring1][=Branch2]
|
C1%10(C=C)CCOCC1.n1%11cc8cn1.[C@H]17C[C@@H]9C1.C4(=O)C6.C=CC%11.C5%10=O.N48.O67.N59
|
COc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3C[C@H]3F)CC2)c1N
|
COcccccC=O)NCCC[C@@H]CCCCN6C=O)[C@H]C[C@H]3F)))))))))))CC6)))))))c6N
|
[C][O][C][=C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][F][C][C][Ring2][Ring1][C][=C][Ring2][Ring1][#Branch2][N]
|
c16cccc8c1N.N14CCC9CC1.[C@@H]19CCCCN15.[C@H]17C[C@H]1F.C48=O.C57=O.CO6
|
C[C@@H](CN(C)C(=O)c1ccn(C)n1)N(C)C(=O)c1ccn2cc(C3CC3)nc2c1
|
C[C@@H]CNC)C=O)cccnC)n5))))))))NC)C=O)cccnccCCC3)))nc5c9
|
[C][C@@H1][Branch2][Ring1][Ring2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][=C][Ring1][Branch2][C][=Ring1][N]
|
c19ccn2cc%10nc2c1.c18ccn(C)n1.C[C@H]6C7.N47C.C48=O.N56C.C59=O.C1%10CC1
|
CCCCC1(C(=O)NC[C@@H]2CCCN(C(=O)[C@H]3CC=C(C(C)C)CC3)C2)CCC1
|
CCCCCC=O)NC[C@@H]CCCNC=O)[C@H]CC=CCC)C))CC6)))))))C6)))))))))CCC4
|
[C][C][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@H1][C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][C][Ring1][=Branch2][C][Ring1][P][C][C][C][Ring2][Ring1][=Branch2]
|
[C@H]18CC=C(C(C)C)CC1.[C@@H]1%10CCCN5C1.C179CCC1.CCCC9.C47=O.C58=O.N46.C6%10
|
O=C(O)C[C@@H]1CCN(Cc2ccc(-c3ccc(-c4cncnc4)cc3F)o2)C1
|
O=CO)C[C@@H]CCNCcccc-cccc-ccncnc6))))))cc6F)))))))o5))))))C5
|
[O][=C][Branch1][C][O][C][C@@H1][C][C][N][Branch2][Ring1][S][C][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][=C][Ring1][N][F][O][Ring2][Ring1][C][C][Ring2][Ring1][Branch2]
|
c18ccc9cc1F.[C@@H]17CCN5C1.c16ccc8o1.c19cncnc1.O=C(O)C7.C56
|
CC[C@@H](C(=O)N[C@H](CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21)C(C)(C)C)c1cccnc1
|
CC[C@@H]C=O)N[C@H]CNC=O)[C@H][C@@H]CCC[C@@H]56)))))))))CC)C)C)))))ccccnc6
|
[C][C][C@@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C@@H1][C][C][C][C@@H1][Ring1][Branch1][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
[C@@H]5(C6)C(C)(C)C.CC[C@H]8C3=O.[C@@H]17[C@H]2CCC[C@@H]12.c18cccnc1.C47=O.N35.N46
|
CCC(C)(CC)C(=O)NCc1cn(C[C@H](C)NC(=O)C2(F)CCCC2)nn1
|
CCCC)CC))C=O)NCccnC[C@H]C)NC=O)CF)CCCC5)))))))))nn5
|
[C][C][C][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][=C][N][Branch2][Ring1][Branch1][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][C][C][C][C][Ring1][=Branch1][N][=N][Ring1][P]
|
CCC(C)(CC)C3=O.c19cn8nn1.C17(F)CCCC1.C8[C@@H]6C.C47=O.N35.C59.N46
|
COC[C@@](C)(OC)C(=O)N1CCC[C@@H]1CNC(=O)CC1CCC2(CCCC2)CC1
|
COC[C@@]C)OC))C=O)NCCC[C@@H]5CNC=O)CCCCCCCCC5))))CC6
|
[C][O][C][C@@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][C][Ring1][#Branch2]
|
C19CCC2(CCCC2)CC1.C5[C@]6(C)C3=O.N13CCC[C@@H]18.C4(=O)C9.CO5.O6C.C78.N47
|
COCCOCCC[C@H](C)NC(=O)[C@H](CCC(C)(C)F)NC(=O)OC(C)(C)C
|
COCCOCCC[C@H]C)NC=O)[C@H]CCCC)C)F))))NC=O)OCC)C)C
|
[C][O][C][C][O][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][O][C][C][C][Branch1][C][C][Branch1][C][C][F][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
C2(=O)[C@@H]9CCC(C)(C)F.C6CC[C@@H]8C.C7(C)(C)C.C4C5.C13=O.CO4.O56.N28.N39.O17
|
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