SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
COc1cc(C)cc(CCN=C(NCc2cccs2)N[C@@H](C)CF)c1
|
COcccC)ccCCN=CNCccccs5)))))))N[C@@H]C)CF))))))))c6
|
[C][O][C][=C][C][Branch1][C][C][=C][C][Branch2][Ring1][#Branch1][C][C][N][=C][Branch1][#Branch2][N][C][C][=C][C][=C][S][Ring1][Branch1][N][C@@H1][Branch1][C][C][C][F][=C][Ring2][Ring1][#Branch1]
|
c13cc7cc(C)c1.C7CN=C(N4)N5.c16cccs1.[C@H]5(C)CF.CO3.C46
|
COc1ccc(C(=O)N2CCC[C@@](CO)(NC(=O)C(F)=CC3CC3)C2)cc1Cl
|
COccccC=O)NCCC[C@@]CO))NC=O)CF)=CCCC3)))))))C6)))))))cc6Cl
|
[C][O][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][Ring1][C][O][Branch1][S][N][C][=Branch1][C][=O][C][Branch1][C][F][=C][C][C][C][Ring1][Ring1][C][Ring1][P][C][=C][Ring2][Ring1][=Branch2][Cl]
|
c16ccc8cc1Cl.N14CCC[C@]7%10C1.C5(=O)C=9F.C=9C1CC1.C48=O.CO6.C%10O.N57
|
CC[C@@H](CC(=O)NC[C@@H](C)N(C)C)N(C)C(=O)C[C@H](O)CC(C)(C)C
|
CC[C@@H]CC=O)NC[C@@H]C)NC)C)))))))NC)C=O)C[C@H]O)CCC)C)C
|
[C][C][C@@H1][Branch1][P][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C@H1][Branch1][C][O][C][C][Branch1][C][C][Branch1][C][C][C]
|
C2(=O)C[C@H](O)CC(C)(C)C.CC[C@H]3CC1=O.C4[C@H]5C.N5(C)C.N23C.N14
|
CCC(=O)N[C@@H](C)C(=O)NC[C@@H]1CN(C(=O)[C@@]2(Cl)[C@@H]3C(=O)CC[C@@H]32)CC1(F)F
|
CCC=O)N[C@@H]C)C=O)NC[C@@H]CNC=O)[C@@]Cl)[C@@H]C=O)CC[C@@H]56)))))))CC5F)F
|
[C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@][Branch1][C][Cl][C@@H1][C][=Branch1][C][=O][C][C][C@@H1][Ring1][=Branch1][Ring1][Branch2][C][C][Ring1][#C][Branch1][C][F][F]
|
[C@@H]1%10CN6CC1(F)F.[C@]19(Cl)[C@@H]2C(=O)CC[C@@H]21.[C@H]7(C)C5=O.CCC4=O.C69=O.N47.N58.C8%10
|
COc1sccc1C(=O)N1C[C@@H](CNC(=O)[C@H](F)C2CCC2)OC2(CCC2)C1
|
COcsccc5C=O)NC[C@@H]CNC=O)[C@H]F)CCCC4))))))))OCCCC4)))C6
|
[C][O][C][S][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][C][C][C][Ring1][Ring2][O][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Ring1]
|
N13C[C@@H]8OC2(CCC2)C1.c15sccc17.C4(=O)[C@@H]9F.C19CCC1.C37=O.CO5.C68.N46
|
C=C(C)[C@](C)(O)C(=O)N1C[C@@]2(NC(=O)CCc3ccncc3)CC[C@H]1C2
|
C=CC)[C@]C)O)C=O)NC[C@@]NC=O)CCcccncc6))))))))))CC[C@H]6C5
|
[C][=C][Branch1][C][C][C@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C][C@@][Branch1][S][N][C][=Branch1][C][=O][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][C@H1][Ring1][P][C][Ring1][S]
|
C=C(C)[C@](C)(O)C4=O.N14C[C@@]26CC[C@H]1C2.c17ccncc1.C5(=O)CC7.N56
|
CCC=CC(=O)NCC[C@@]12CC[C@@H]1CN(C(=O)C(=O)N1CCC(C)CC1)C2
|
CCC=CC=O)NCC[C@@]CC[C@@H]4CNC=O)C=O)NCCCC)CC6))))))))C7
|
[C][C][C][=C][C][=Branch1][C][=O][N][C][C][C@@][C][C][C@@H1][Ring1][Ring2][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][C]
|
[C@@]128CC[C@@H]1CN4C2.N15CCC(C)CC1.C4(=O)C5=O.C=7C3=O.CCC=7.C6C8.N36
|
CC(=O)NCC(C)(C)C(=O)N[C@@H]1C[C@H](C)N(c2nc(C#N)ncc2Cl)C1
|
CC=O)NCCC)C)C=O)N[C@@H]C[C@H]C)NcncC#N))ncc6Cl)))))))C5
|
[C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][C][C][N][Branch1][=C][C][=N][C][Branch1][Ring1][C][#N][=N][C][=C][Ring1][Branch2][Cl][C][Ring1][#C]
|
c16nc(C#N)ncc1Cl.C5C(C)(C)C4=O.[C@@H]17C[C@H](C)N6C1.CC3=O.N35.N47
|
CCCN1CCC[C@H]1C(=O)N[C@H](CO)CNC(=O)[C@H](C)Cc1ccccc1C
|
CCCNCCC[C@H]5C=O)N[C@H]CO))CNC=O)[C@H]C)Ccccccc6C
|
[C][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C]
|
c18ccccc1C.N14CCC[C@H]17.C3(=O)[C@H](C)C8.[C@H]5(C6)CO.CCC4.C27=O.N25.N36
|
CCCc1ccc(C(=O)NC[C@H]2C[C@@H](C)N(C(=O)c3ccn(C)c(=O)c3)C2)s1
|
CCCccccC=O)NC[C@H]C[C@@H]C)NC=O)cccnC)c=O)c6)))))))C5))))))))s5
|
[C][C][C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][C][=Ring1][Branch2][C][Ring1][S][S][Ring2][Ring1][=Branch2]
|
c18ccn(C)c(=O)c1.[C@H]1%10C[C@@H](C)N5C1.c19ccc7s1.CCC9.C47=O.C58=O.N46.C6%10
|
CCc1nn(C)c(C(=O)N2CCN(C(=O)CCO[C@@H]3CCOC3)[C@H](CC)C2)c1Cl
|
CCcnnC)cC=O)NCCNC=O)CCO[C@@H]CCOC5)))))))))[C@H]CC))C6)))))))c5Cl
|
[C][C][C][=N][N][Branch1][C][C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][O][C@@H1][C][C][O][C][Ring1][Branch1][C@H1][Branch1][Ring1][C][C][C][Ring2][Ring1][C][=C][Ring2][Ring1][#Branch2][Cl]
|
c1%10nn(C)c8c1Cl.N14CCN5[C@H]9C1.C5(=O)CC6.[C@@H]17CCOC1.C48=O.CC%10.O67.C9C
|
C=CCCC1(C(=O)N2CC[C@@H]3[C@H](C2)C3(F)F)CN(C(=O)c2cc(C)c(O)nn2)C1
|
C=CCCCC=O)NCC[C@@H][C@H]C6)C3F)F))))))))CNC=O)cccC)cO)nn6)))))))C4
|
[C][=C][C][C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][Ring2][Branch1][C][F][F][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][O][N][=N][Ring1][Branch2][C][Ring2][Ring1][=Branch2]
|
N14CC[C@@H]2[C@H](C1)C2(F)F.c16cc(C)c(O)nn1.C178CN5C1.C=CCC8.C47=O.C56=O
|
C[C@H](n1nc(-c2ccc(N)cc2)nc1CSc1ccccc1)C1(C)CC1
|
C[C@H]nnc-ccccN)cc6))))))nc5CScccccc6)))))))))))))CC)CC3
|
[C][C@H1][Branch2][Ring1][#C][N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][N][=C][Ring1][N][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][C][Ring1][Ring2]
|
n14nc8nc15.c18ccc(N)cc1.c17ccccc1.C16(C)CC1.C[C@H]46.C35.S37
|
C#CCCC(=O)N1CC(O)(CN(C)C(=O)CCCCCOC)C1
|
C#CCCC=O)NCCO)CNC)C=O)CCCCCOC))))))))))C4
|
[C][#C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][P][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][C][O][C][C][Ring1][P]
|
C3(=O)CCCCC4.C#CCCC2=O.N12CC6(O)C1.N35C.C56.O4C
|
Cc1ccc(C(=O)N2CCC[C@@H](NC(=O)CC3=Cc4ccccc4C3)CC2)n1C
|
CccccC=O)NCCC[C@@H]NC=O)CC=Ccccccc6C9))))))))))))CC7))))))))n5C
|
[C][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][C][C][Ring2][Ring1][Ring2][N][Ring2][Ring1][O][C]
|
C6(=O)CC1=Cc2ccccc2C1.N15CCC[C@@H]7CC1.Cc1ccc8n1C.C58=O.N67
|
C[C@@H](CCCCNC(=O)CCNC(=O)C1CCC1)NC(=O)[C@@H](C)OC1CCCC1
|
C[C@@H]CCCCNC=O)CCNC=O)CCCC4))))))))))))))NC=O)[C@@H]C)OCCCCC5
|
[C][C@@H1][Branch2][Ring1][#Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][C][C][C][Ring1][Branch1]
|
C[C@H]7CCCC8.C2(=O)CC9.C4(=O)[C@H]5C.C16CCCC1.C1%10CCC1.C3%10=O.N28.N39.N47.O56
|
C[C@@H](C(=O)NC1CC1)N1CC(CNC(=O)c2cc(F)ccc2F)C1
|
C[C@@H]C=O)NCCC3)))))NCCCNC=O)cccF)ccc6F))))))))))C4
|
[C][C@@H1][Branch1][O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][N][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][C][Ring1][S]
|
c18cc(F)ccc1F.C[C@H]5C3=O.N15CC9C1.C17CC1.C48=O.N37.C69.N46
|
CC=C[C@H](O)C(=O)N1CC[C@@](CNC(=O)c2scc(C)c2C)(OC)C1
|
CC=C[C@H]O)C=O)NCC[C@@]CNC=O)csccC)c5C)))))))))OC))C5
|
[C][C][=C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][S][C][=C][Branch1][C][C][C][=Ring1][=Branch1][C][Branch1][Ring1][O][C][C][Ring2][Ring1][C]
|
N13CC[C@]59C1.c17scc(C)c1C.C=8[C@H](O)C3=O.C47=O.CC=8.C69.N46.O5C
|
CC1(C)CCN(C(=O)C2=CCC2)C[C@@H]1CNC(=O)Cc1ncnc2sccc12
|
CCC)CCNC=O)C=CCC4)))))C[C@@H]6CNC=O)Ccncncsccc95
|
[C][C][Branch1][C][C][C][C][N][Branch1][O][C][=Branch1][C][=O][C][=C][C][C][Ring1][Ring2][C][C@@H1][Ring1][=N][C][N][C][=Branch1][C][=O][C][C][=N][C][=N][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
CC1(C)CCN3C[C@@H]17.c16ncnc2sccc12.C3(=O)C1=CCC1.C4(=O)C6.C57.N45
|
O=C(C1CCCCC1)N1CCN[C@H](C(=O)N2CCCC[C@H]2CCO)C1
|
O=CCCCCCC6))))))NCCN[C@H]C=O)NCCCC[C@H]6CCO))))))))))C6
|
[O][=C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][N][C][C][N][C@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][C][O][C][Ring1][P]
|
N13CCN[C@H]5C1.N14CCCC[C@H]17.C16CCCCC1.O=C36.C45=O.C7CO
|
O=C(N[C@H]1[C@@H]2CCCC[C@@H]21)[C@@H]1CCN(C(=O)COCCCF)C12CC2
|
O=CN[C@H][C@@H]CCCC[C@@H]67))))))))[C@@H]CCNC=O)COCCCF)))))))C5CC3
|
[O][=C][Branch1][=N][N][C@H1][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][Ring1][#Branch1][C@@H1][C][C][N][Branch1][O][C][=Branch1][C][=O][C][O][C][C][C][F][C][Ring1][=N][C][C][Ring1][Ring1]
|
[C@@H]18CCN4C12CC2.[C@@H]17[C@H]2CCCC[C@@H]12.C4(=O)C5.C6CCF.O=C38.N37.O56
|
CSC(C)(C)/C=C/C(=O)NC1CN(C(=O)c2c[nH]nc2[C@@H]2CCCO2)C1
|
CSCC)C)/C=C/C=O)NCCNC=O)cc[nH]nc5[C@@H]CCCO5)))))))))))C4
|
[C][S][C][Branch1][C][C][Branch1][C][C][/C][=C][/C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C@@H1][C][C][C][O][Ring1][Branch1][C][Ring1][S]
|
c17c[nH]nc19.C5(C)(C)C=8.C16CN4C1.[C@@H]19CCCO1.C=8C3=O.C47=O.CS5.N36
|
N#Cc1ccc(C(=O)NC[C@H](CO)NC(=O)c2coc3c2C(=O)NCCC3)nc1
|
N#CccccC=O)NC[C@H]CO))NC=O)ccocc5C=O)NCCC7))))))))))))))))nc6
|
[N][#C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Ring1][Branch2][N][=C][Ring2][Ring1][O]
|
c19coc2c1C(=O)NCCC2.N#Cc1ccc8nc1.C6[C@@H]7CO.C48=O.C59=O.N46.N57
|
CC(=O)N1CC(C(=O)NC[C@]2(C)CCC[C@H]2NC(=O)[C@@H](O)CN(C)C)C1
|
CC=O)NCCC=O)NC[C@]C)CCC[C@H]5NC=O)[C@@H]O)CNC)C))))))))))))))C4
|
[C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][C][Ring2][Ring1][#Branch1]
|
[C@@]1%10(C)CCC[C@H]18.C5(=O)[C@@H](O)C7.N13CC9C1.CC3=O.C49=O.N7(C)C.N46.C6%10.N58
|
CO[C@H](F)C(=O)NC[C@@H]1CN(C)CCN1C(=O)Cc1csc(C)n1
|
CO[C@H]F)C=O)NC[C@@H]CNC)CCN6C=O)CccscC)n5
|
[C][O][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1]
|
[C@@H]16CN(C)CCN13.c17csc(C)n1.[C@@H]4(F)C2=O.C3(=O)C7.CO4.N25.C56
|
COC1(CNC(=O)C(=O)NCCC(N)=O)CN(C(=O)[C@@H](C)CSC)C1
|
COCCNC=O)C=O)NCCCN)=O)))))))))CNC=O)[C@@H]C)CSC)))))C4
|
[C][O][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Branch1][C][N][=O][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][S][C][C][Ring2][Ring1][#Branch1]
|
C159CN4C1.C4(=O)[C@@H](C)C8.C2(=O)C3=O.C7CC(N)=O.CO5.C69.N26.N37.S8C
|
C=C(C)CCC(=O)N1CC(C2(NC(=O)c3nc(Cl)c(Cl)c(N)c3Cl)CC2)C1
|
C=CC)CCC=O)NCCCNC=O)cncCl)cCl)cN)c6Cl)))))))))CC3)))C4
|
[C][=C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][S][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][=N][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][Branch1][C][N][=C][Ring1][=Branch2][Cl][C][C][Ring1][S][C][Ring2][Ring1][Ring2]
|
c17nc(Cl)c(Cl)c(N)c1Cl.N14CC(C26CC2)C1.C=C(C)CCC4=O.C57=O.N56
|
COc1cccc(CN2CCN(C(=O)c3c(Br)ccc(F)c3F)CC2)c1
|
COcccccCNCCNC=O)ccBr)cccF)c6F))))))))CC6)))))))c6
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][S][C][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][Branch1][C][Br][C][=C][C][Branch1][C][F][=C][Ring1][Branch2][F][C][C][Ring1][P][=C][Ring2][Ring1][Branch2]
|
c17c(Br)ccc(F)c1F.c15cccc8c1.N16CCN4CC1.C47=O.CO5.C68
|
Cc1coc(C(=O)NCCN(C(=O)c2cccn(C3CC3)c2=O)C(C)C)c1
|
CccocC=O)NCCNC=O)ccccnCCC3)))c6=O))))))))CC)C)))))))c5
|
[C][C][=C][O][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=Branch2][=O][C][Branch1][C][C][C][=C][Ring2][Ring1][#Branch2]
|
c1%10cccn%11c1=O.Cc1coc9c1.C49=O.C6C7.N578.C5%10=O.C1%11CC1.C8(C)C.N46
|
C[C@H]1CN(C(=O)CC2CCOCC2)CC[C@H]1NC(=O)CCn1cncn1
|
C[C@H]CNC=O)CCCCOCC6))))))))CC[C@H]6NC=O)CCncncn5
|
[C][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][O][C][C][Ring1][=Branch1][C][C][C@H1][Ring1][#C][N][C][=Branch1][C][=O][C][C][N][C][=N][C][=N][Ring1][Branch1]
|
C[C@H]1CN3CC[C@H]15.C17CCOCC1.C4(=O)CC6.n16cncn1.C3(=O)C7.N45
|
Cc1cc(C(=O)N2CC[C@@H]3CCN(C(=O)C(F)(F)Sc4cnn(C)c4)C[C@H]32)co1
|
CcccC=O)NCC[C@@H]CCNC=O)CF)F)SccnnC)c5))))))))C[C@H]69))))))))))co5
|
[C][C][=C][C][Branch2][Ring2][=N][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][S][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C@H1][Ring2][Ring1][C][Ring2][Ring1][Branch1][=C][O][Ring2][Ring1][N]
|
N15CC[C@@H]2CCN6C[C@H]21.Cc1cc8co1.C6(=O)C7(F)F.c19cnn(C)c1.C58=O.S79
|
CCCC(C)(CCC)C(=O)NCCCC1(NC(=O)c2oc(CO)nc2C)CC1
|
CCCCC)CCC)))C=O)NCCCCNC=O)cocCO))nc5C))))))))CC3
|
[C][C][C][C][Branch1][C][C][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][O][C][Branch1][Ring1][C][O][=N][C][=Ring1][#Branch1][C][C][C][Ring1][=C]
|
CCCC(C)(CCC)C3=O.c17oc8nc1C.C5CC9.C169CC1.C47=O.N35.N46.C8O
|
CN(Cc1c(F)cc(Br)cc1F)C(=O)CNC(=O)c1ccc(N)cc1
|
CNCccF)ccBr)cc6F))))))))C=O)CNC=O)ccccN)cc6
|
[C][N][Branch1][P][C][C][=C][Branch1][C][F][C][=C][Branch1][C][Br][C][=C][Ring1][Branch2][F][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1]
|
c17c(F)cc(Br)cc1F.c16ccc(N)cc1.C2(=O)C5.CN24.C36=O.C47.N35
|
COCCNC(=O)[C@@H](c1cncs1)N1CCC2=C(CCCC2)C1
|
COCCNC=O)[C@@H]ccncs5)))))NCCC=CCCCC6))))C6
|
[C][O][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Branch2][C][=C][N][=C][S][Ring1][Branch1][N][C][C][C][=C][Branch1][#Branch1][C][C][C][C][Ring1][=Branch1][C][Ring1][#Branch2]
|
N16CCC2=C(CCCC2)C1.C3(=O)[C@H]67.c17cncs1.C4C5.CO4.N35
|
Cc1c(F)cccc1CNc1[nH]c(=NCCCCOC(C)(C)C)nc2scnc12
|
CccF)cccc6CNc[nH]c=NCCCCOCC)C)C))))))))ncscnc95
|
[C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][N][C][NH1][C][=Branch1][#C][=N][C][C][C][C][O][C][Branch1][C][C][Branch1][C][C][C][N][=C][S][C][=N][C][=Ring2][Ring1][Ring1][Ring1][Branch1]
|
c16[nH]c(=NCCCC3)nc2scnc12.Cc1c7cccc1F.C4(C)(C)C.C57.N56.O34
|
CCc1nnsc1C(=O)N1CC(O)([C@@H](C)NC(=O)[C@@H](C)NC(=O)C2CCCC2)C1
|
CCcnnsc5C=O)NCCO)[C@@H]C)NC=O)[C@@H]C)NC=O)CCCCC5)))))))))))C4
|
[C][C][C][N][=N][S][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@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][Ring2]
|
c1%10nnsc18.N13CC%11(O)C1.C4(=O)[C@H]7C.C19CCCC1.C38=O.[C@H]6%11C.C59=O.CC%10.N46.N57
|
CCC1(N[C@H](C[C@H]2CCCCO2)c2nnnn2CCOCC2CC2)CCCCC1
|
CCCN[C@H]C[C@H]CCCCO6)))))))cnnnn5CCOCCCC3))))))))))))))CCCCC6
|
[C][C][C][Branch2][Ring1][=C][N][C@H1][Branch1][#Branch2][C][C@H1][C][C][C][C][O][Ring1][=Branch1][C][=N][N][=N][N][Ring1][Branch1][C][C][O][C][C][C][C][Ring1][Ring1][C][C][C][C][C][Ring2][Ring1][O]
|
C15%10CCCCC1.[C@H]18CCCCO1.c19nnnn17.[C@H]69C8.C7C3.C1%11CC1.CC%10.N56.O34.C4%11
|
CCCS(=O)(=O)CC(=O)N1CCOC[C@H](NC(=O)COc2ccon2)C1
|
CCCS=O)=O)CC=O)NCCOC[C@H]NC=O)COcccon5)))))))))C7
|
[C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][O][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][O][C][C][=C][O][N][=Ring1][Branch1][C][Ring1][P]
|
CCCS(=O)(=O)CC3=O.N13CCOC[C@H]7C1.c16ccon1.C4(=O)C5.N47.O56
|
CCC=CC=CC(=O)NC[C@@H]1CCCC[C@H]1NC(=O)C1CCN(OC)CC1
|
CCC=CC=CC=O)NC[C@@H]CCCC[C@H]6NC=O)CCCNOC))CC6
|
[C][C][C][=C][C][=C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][N][Branch1][Ring1][O][C][C][C][Ring1][Branch2]
|
C16CCN(OC)CC1.[C@@H]19CCCC[C@H]15.C=8C2=O.CCC=7.C=7C=8.C36=O.N24.C49.N35
|
C[C@@H]1CCCc2c(C(=O)N[C@@H]3CCN(C(=O)CSc4nncs4)C3)cnn21
|
C[C@@H]CCCccC=O)N[C@@H]CCNC=O)CScnncs5))))))))C5)))))))cnn59
|
[C][C@@H1][C][C][C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][S][C][=N][N][=C][S][Ring1][Branch1][C][Ring1][=C][C][=N][N][Ring2][Ring1][=Branch1][Ring2][Ring1][#Branch2]
|
C[C@@H]1CCCc2c9cnn21.[C@@H]18CCN6C1.c1%10nncs1.C6(=O)C7.C59=O.N58.S7%10
|
C[C@@H](CCNC(=O)CC[C@@H]1CCCOC1)CCNC(=O)c1nccn1C
|
C[C@@H]CCNC=O)CC[C@@H]CCCOC6))))))))))))CCNC=O)cnccn5C
|
[C][C@@H1][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][N][Ring1][Branch1][C]
|
C[C@@H](CC4)CC5.[C@@H]17CCCOC1.c16nccn1C.C2(=O)CC7.C36=O.N24.N35
|
CCN(C(=O)[C@@H](O)CCN(C)C)[C@@H]1CCN(C(=O)CCCC2CCOCC2)C1
|
CCNC=O)[C@@H]O)CCNC)C))))))[C@@H]CCNC=O)CCCCCCOCC6))))))))))C5
|
[C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][N][Branch1][C][C][C][C@@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][C][C][C][O][C][C][Ring1][=Branch1][C][Ring1][S]
|
C3(=O)[C@@H](O)CC6.[C@@H]17CCN4C1.C4(=O)CCC8.C18CCOCC1.N357.N6(C)C.CC5
|
Cc1c[nH]c(C(=O)N[C@@H]2CCCC[C@@H]2CNC(=O)c2cc(C#N)ccc2O)c1
|
Ccc[nH]cC=O)N[C@@H]CCCC[C@@H]6CNC=O)cccC#N))ccc6O))))))))))))))))))c5
|
[C][C][=C][NH1][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][#N][=C][C][=C][Ring1][Branch2][O][=C][Ring2][Ring1][O]
|
c18cc(C#N)ccc1O.[C@@H]16CCCC[C@@H]19.Cc1c[nH]c7c1.C37=O.C48=O.N36.C59.N45
|
O=C(CS(=O)(=O)C1CC1)NC[C@H]1CC2(CO1)CN(C(=O)[C@H]1COC(=O)O1)C2
|
O=CCS=O)=O)CCC3)))))NC[C@H]CCCO5))CNC=O)[C@H]COC=O)O5))))))C4
|
[O][=C][Branch1][=C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][N][C][C@H1][C][C][Branch1][Branch1][C][O][Ring1][Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][O][C][=Branch1][C][=O][O][Ring1][=Branch1][C][Ring1][=C]
|
O=C3CS(=O)(=O)C1CC1.[C@H]17CC2(CO1)CN4C2.[C@H]16COC(=O)O1.C46=O.N35.C57
|
CCCN(CC)c1ccc(C(=O)NC2(CNC(=O)C3(C#N)CC(C)C3)CC2)cc1
|
CCCNCC))ccccC=O)NCCNC=O)CC#N))CCC)C4)))))))CC3)))))cc6
|
[C][C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][Branch1][C][C][C][Ring1][#Branch1][C][C][Ring1][=C][C][=C][Ring2][Ring1][#Branch1]
|
c1%11ccc%13cc1.C1%12(C#N)CC(C)C1.C195CC1.CCC7.N78%11.C4%13=O.C6%12=O.C8C.N49.C%105.N6%10
|
C#C[C@H]1CN(C(=O)[C@](C)(CSC)NC(=O)c2cnn(C)c2CC)C[C@@H]1OC
|
C#C[C@H]CNC=O)[C@]C)CSC)))NC=O)ccnnC)c5CC)))))))))))C[C@@H]5OC
|
[C][#C][C@H1][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][Ring2][C][S][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][C][C@@H1][Ring2][Ring1][#Branch1][O][C]
|
C#C[C@H]1CN3C[C@@H]15.C3(=O)[C@]6(C)C7.c18cnn(C)c19.C48=O.S7C.N46.C9C.O5C
|
CCCCCCCCN(C)C(=O)C1(CNC(=O)[C@@H](CC)SC)CCC1
|
CCCCCCCCNC)C=O)CCNC=O)[C@@H]CC))SC))))))CCC4
|
[C][C][C][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][=C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][C][S][C][C][C][C][Ring1][=N]
|
CCCCCCCC4.C3(=O)[C@H]6CC.C178CCC1.N24C.C27=O.C58.N35.S6C
|
C[C@@H]1COC[C@H](CC(=O)N2CC3(CCCC3)[C@@H]2C(=O)N[C@H](C)C(=O)NC2CC2)O1
|
C[C@@H]COC[C@H]CC=O)NCCCCCC5))))[C@@H]4C=O)N[C@H]C)C=O)NCCC3))))))))))))))O6
|
[C][C@@H1][C][O][C][C@H1][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][O][Ring2][Ring1][N]
|
N14CC2(CCCC2)[C@@H]19.C[C@@H]1COC[C@H]%10O1.[C@@H]7(C)C6=O.C%10C4=O.C59=O.C18CC1.N57.N68
|
C=C(F)C1(CC(=O)N2CC=C[C@]2(C)C(=O)NC[C@H](C)c2cnc[nH]2)CCC1
|
C=CF)CCC=O)NCC=C[C@]5C)C=O)NC[C@H]C)ccnc[nH]5))))))))))))))))CCC4
|
[C][=C][Branch1][C][F][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][=C][C@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][=C][N][=C][NH1][Ring1][Branch1][C][C][C][Ring2][Ring1][Branch2]
|
C=C(F)C18CCC1.N13CC=C[C@@]16C.c17cnc[nH]1.C8C3=O.C5[C@@H]7C.C46=O.N45
|
C#CC[C@](C)(CC)C(=O)NC[C@@H](CC1CC1)C(=O)N1CCC[C@@H](OC2CC2)C1
|
C#CC[C@]C)CC))C=O)NC[C@@H]CCCC3))))C=O)NCCC[C@@H]OCCC3))))C6
|
[C][#C][C][C@][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][#Branch1][O][C][C][C][Ring1][Ring1][C][Ring1][#Branch2]
|
C#CC[C@](C)(CC)C3=O.C7[C@@H](C8)C4=O.N14CCC[C@@H]5C1.C18CC1.C16CC1.N37.O56
|
CCN(CCNC(=O)CN1CCN(C2CC2)C1=O)C(=O)[C@@H]1CCCN(C)C1
|
CCNCCNC=O)CNCCNCCC3)))C5=O)))))))))))C=O)[C@@H]CCCNC)C6
|
[C][C][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][N][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][Branch2][=O][C][=Branch1][C][=O][C@@H1][C][C][C][N][Branch1][C][C][C][Ring1][#Branch1]
|
N19CCN%10C1=O.[C@@H]18CCCN(C)C1.C3(=O)C9.N456.C6C7.C1%10CC1.C48=O.CC5.N37
|
Cc1nc(CC(=O)N2CC(O)(CCNC(=O)COc3cc(F)cc(F)c3)C2)cs1
|
CcncCC=O)NCCO)CCNC=O)COcccF)ccF)c6))))))))))))C4))))))cs5
|
[C][C][=N][C][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][Ring2][Ring1][Ring2][=C][S][Ring2][Ring1][N]
|
c17cc(F)cc(F)c1.Cc1nc9cs1.N14CC%10(O)C1.C9C4=O.C5(=O)C6.C%10C8.N58.O67
|
CN(C(=O)[C@@H]1C[C@H]1Br)C1CC(NC(=O)c2ncccc2C2CC2)C1
|
CNC=O)[C@@H]C[C@H]3Br)))))CCCNC=O)cncccc6CCC3)))))))))))C4
|
[C][N][Branch1][O][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][Br][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][S]
|
c17ncccc19.C15CC6C1.[C@@H]18C[C@H]1Br.CN35.C38=O.C47=O.C19CC1.N46
|
CCCNC(=O)[C@@H](c1cccc(Cl)c1F)N(C)[C@@H]1CCCc2c1cnn2C
|
CCCNC=O)[C@@H]cccccCl)c6F)))))))NC)[C@@H]CCCcc6cnn5C
|
[C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][N][Branch1][C][C][C@@H1][C][C][C][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C]
|
N5(C)[C@@H]1CCCc2c1cnn2C.c16cccc(Cl)c1F.C3(=O)[C@H]56.CCC4.N34
|
Cc1csc(CCC(=O)NC[C@@H]2CN(C(=O)[C@@H](O)C3CCC3)CCO2)n1
|
CccscCCC=O)NC[C@@H]CNC=O)[C@@H]O)CCCC4))))))CCO6)))))))))))n5
|
[C][C][=C][S][C][Branch2][Ring1][P][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][C][Ring1][Ring2][C][C][O][Ring1][=C][=N][Ring2][Ring1][=Branch2]
|
[C@@H]17CN5CCO1.Cc1csc8n1.C8CC4=O.C5(=O)[C@H]9O.C19CCC1.N46.C67
|
O=C(CO[C@@H]1CCOC1)NC[C@@H]1[C@H]2CCC[C@H]1N(c1nc3ncc(Cl)cc3s1)C2
|
O=CCO[C@@H]CCOC5)))))))NC[C@@H][C@H]CCC[C@H]6NcncnccCl)cc6s9)))))))))C7
|
[O][=C][Branch1][#Branch2][C][O][C@@H1][C][C][O][C][Ring1][Branch1][N][C][C@@H1][C@H1][C][C][C][C@H1][Ring1][=Branch1][N][Branch1][P][C][=N][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][C][Ring1][P]
|
c18nc2ncc(Cl)cc2s1.[C@@H]19[C@H]2CCC[C@H]1N8C2.[C@@H]16CCOC1.O=C4C5.O56.N47.C79
|
C[C@@H](CNC(=O)CSc1cccc[n+]1[O-])NC(=O)[C@H]1CC(C)(C)[C@@H]1C(F)(F)F
|
C[C@@H]CNC=O)CSccccc[n+]6[O-]))))))))))))NC=O)[C@H]CCC)C)[C@@H]4CF)F)F
|
[C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][=N+1][Ring1][=Branch1][O-1][N][C][=Branch1][C][=O][C@H1][C][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
c19cccc[n+]1[O-].[C@H]17CC(C)(C)[C@@H]18.C[C@H]4C5.C2(=O)C6.C8(F)(F)F.C37=O.N25.S69.N34
|
C[C@H](C(=O)NCCN1C(=O)CCC1=O)[C@H]1CCN(C(=O)c2ccns2)C1
|
C[C@H]C=O)NCCNC=O)CCC5=O))))))))))[C@H]CCNC=O)cccns5))))))C5
|
[C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][C][C][Ring1][=Branch1][=O][C@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][S][Ring1][Branch1][C][Ring1][N]
|
N17C(=O)CCC1=O.[C@H]18CCN4C1.C[C@@H]8C3=O.c16ccns1.C5C7.C46=O.N35
|
CSCC(=O)N1CCC2(CC1)COC[C@@H](CNC(=O)c1[nH]nnc1C1CC1)O2
|
CSCC=O)NCCCCC6))COC[C@@H]CNC=O)c[nH]nnc5CCC3)))))))))))O6
|
[C][S][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][O][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][NH1][N][=N][C][=Ring1][Branch1][C][C][C][Ring1][Ring1][O][Ring2][Ring1][Ring2]
|
N13CCC2(CC1)COC[C@@H]8O2.c17[nH]nnc19.C6C3=O.C47=O.C19CC1.CS6.C58.N45
|
CCCC1CCC(NC(=O)[C@@H]2CC=CCN2C(=O)CCCNC(=O)OC)CC1
|
CCCCCCCNC=O)[C@@H]CC=CCN6C=O)CCCNC=O)OC))))))))))))))))CC6
|
[C][C][C][C][C][C][C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C@@H1][C][C][=C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][N][C][=Branch1][C][=O][O][C][C][C][Ring2][Ring1][=Branch2]
|
C1%10CCC8CC1.[C@@H]19CC=CCN15.C5(=O)CCC7.CCC%10.C49=O.C36=O.N48.N67.O3C
|
C=Cc1ccc(C(=O)N2CCN(C)[C@@H](C(=O)N3CC=C[C@@H](O)C3)C2)cc1
|
C=CccccC=O)NCCNC)[C@@H]C=O)NCC=C[C@@H]O)C6)))))))C6)))))))cc6
|
[C][=C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][=C][C@@H1][Branch1][C][O][C][Ring1][#Branch1][C][Ring1][S][C][=C][Ring2][Ring1][Branch2]
|
C=Cc1ccc7cc1.N14CCN(C)[C@@H]6C1.N15CC=C[C@@H](O)C1.C47=O.C56=O
|
CCc1[nH]ccc1C(=O)NCCSCC(=O)N1CC(OCC(F)F)C1
|
CCc[nH]ccc5C=O)NCCSCC=O)NCCOCCF)F))))C4
|
[C][C][C][NH1][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][S][C][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][O][C][C][Branch1][C][F][F][C][Ring1][=Branch2]
|
c1%10[nH]ccc19.N13CC5C1.C8C3=O.C4C(F)F.C29=O.C6C7.CC%10.N26.S78.O45
|
CC1(C)CC[C@@H](CNC(=O)C2=CCCN(C(=O)[C@@H]3CCCC34CCC4)C2)OC1
|
CCC)CC[C@@H]CNC=O)C=CCCNC=O)[C@@H]CCCC5CCC4)))))))))C6)))))))))OC6
|
[C][C][Branch1][C][C][C][C][C@@H1][Branch2][Ring1][P][C][N][C][=Branch1][C][=O][C][=C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][C][C][Ring1][Branch1][C][C][C][Ring1][Ring2][C][Ring1][S][O][C][Ring2][Ring1][O]
|
C5(=O)C1=CCCN6C1.CC1(C)CC[C@@H]9OC1.[C@@H]18CCCC12CCC2.C68=O.C79.N57
|
CN1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cc(C(F)F)nn1C
|
CNCCC[C@@H]5[C@H]CCCN5C=O)cccCF)F))nn5C
|
[C][N][C][C][C][C@@H1][Ring1][Branch1][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=N][N][Ring1][Branch2][C]
|
CN1CCC[C@@H]1[C@H]1CCCN12.c13cc4nn1C.C23=O.C4(F)F
|
CCC[C@@H](C)CN(C)S(=O)(=O)c1c[nH]ccc1=NC[C@@H](C)CC1CC1
|
CCC[C@@H]C)CNC)S=O)=O)cc[nH]ccc6=NC[C@@H]C)CCCC3
|
[C][C][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][NH1][C][=C][C][Ring1][=Branch1][=N][C][C@@H1][Branch1][C][C][C][C][C][C][Ring1][Ring1]
|
S3(=O)(=O)c1c[nH]ccc1=NC[C@@H](C)C4.CCC[C@@H](C)C2.N23C.C14CC1
|
C[C@H](OCCN(C)C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)[C@@H]1CCCOC1)C2
|
C[C@H]OCCNC)C)))))C=O)N[C@H]C[C@H]C[C@@H]C6)NC=O)[C@@H]CCCOC6)))))))C5
|
[C][C@H1][Branch1][=Branch2][O][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][=C]
|
[C@H]18C[C@H]2C[C@@H](C1)N4C2.[C@@H]19CCCOC1.C[C@H]5C3=O.C6C7.N7(C)C.C49=O.O56.N38
|
CC(C)SCC(=O)N[C@@H]1CCC[C@@H]1NC(=O)CCc1ccccc1[N+](=O)[O-]
|
CCC)SCC=O)N[C@@H]CCC[C@@H]5NC=O)CCcccccc6[N+]=O)[O-]
|
[C][C][Branch1][C][C][S][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1]
|
c18ccccc1[N+](=O)[O-].[C@@H]16CCC[C@@H]17.C3(=O)CC8.C5C2=O.CC4C.S45.N26.N37
|
CCCc1n[nH]cc1C(=O)OCc1ccc2oc(C(=O)OC)cc2c1
|
CCCcn[nH]cc5C=O)OCccccocC=O)OC)))cc5c9
|
[C][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][O][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][Ring1][=Branch2][=C][Ring1][=N]
|
c19ccc2oc6cc2c1.c18n[nH]cc17.CCC8.C37=O.C46=O.O35.C59.O4C
|
O=C(N[C@@H](C1CC1)C(F)(F)F)[C@H]1[C@@H]2CN(C(=O)c3ccc(Cl)cn3)C[C@@H]21
|
O=CN[C@@H]CCC3)))CF)F)F))))[C@H][C@@H]CNC=O)ccccCl)cn6)))))))C[C@@H]56
|
[O][=C][Branch2][Ring1][C][N][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F][C@H1][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1][C][C@@H1][Ring1][=C][Ring1][#C]
|
[C@@H]18[C@H]2CN5C[C@@H]12.c17ccc(Cl)cn1.[C@H]69C(F)(F)F.O=C48.C19CC1.C57=O.N46
|
CC(C)C[C@@H](CNC(=O)c1sccc1Cl)C(=O)N[C@H](C)c1ccn(C)n1
|
CCC)C[C@@H]CNC=O)csccc5Cl)))))))))C=O)N[C@H]C)cccnC)n5
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][Cl][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1]
|
CC(C)C[C@@H](C4)C3=O.c16sccc1Cl.c17ccn(C)n1.C26=O.[C@H]57C.N24.N35
|
CCCC1(C(=O)N2CCC[C@H](C3(NC(=O)[C@H]4C[C@]4(C)Br)CC3)C2)CCC1
|
CCCCC=O)NCCC[C@H]CNC=O)[C@H]C[C@]3C)Br))))))CC3)))C6)))))))CCC4
|
[C][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][=Branch1][C][Branch1][#C][N][C][=Branch1][C][=O][C@H1][C][C@][Ring1][Ring1][Branch1][C][C][Br][C][C][Ring1][O][C][Ring1][P][C][C][C][Ring2][Ring1][#Branch1]
|
N15CCC[C@H](C27CC2)C1.C18%10CCC1.[C@H]19C[C@]1(C)Br.CCC%10.C58=O.C69=O.N67
|
C[C@@H]1CCCC[C@H]1NC(=O)C1(Cc2ccccc2)CN(C[C@H]2CCCO2)C1
|
C[C@@H]CCCC[C@H]6NC=O)CCcccccc6)))))))CNC[C@H]CCCO5))))))C4
|
[C][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch1][=Branch2][C][C@H1][C][C][C][O][Ring1][Branch1][C][Ring1][P]
|
C[C@@H]1CCCC[C@H]15.C168CN4C1.c19ccccc1.[C@H]17CCCO1.C36=O.N35.C89.C47
|
O=C(NC[C@H]1CCCN1C(=O)CCO[C@H]1CCOC1)c1ncc(F)cn1
|
O=CNC[C@H]CCCN5C=O)CCO[C@H]CCOC5))))))))))))))))cnccF)cn6
|
[O][=C][Branch2][Ring1][Branch2][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][O][C@H1][C][C][O][C][Ring1][Branch1][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1]
|
c17ncc(F)cn1.[C@H]18CCCN13.C3(=O)CC4.[C@H]15CCOC1.O=C27.N26.C68.O45
|
CCOCCC(=O)N1CC[C@H](N=c2cnc3ccccc3[nH]2)C(F)(F)CC1
|
CCOCCC=O)NCC[C@H]N=ccncccccc6[nH]%10)))))))))))CF)F)CC7
|
[C][C][O][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][S][N][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][#Branch2][C][Branch1][C][F][Branch1][C][F][C][C][Ring2][Ring1][Ring2]
|
N14CC[C@H](N=c2cnc3ccccc3[nH]2)C(F)(F)CC1.C6CC4=O.CC5.O56
|
CSCCNC(=O)[C@@H](c1nnc2n1CCC2)N1CCC2(CC1)C[C@H](O)CO2
|
CSCCNC=O)[C@@H]cnncn5CCC5))))))))NCCCCC6))C[C@H]O)CO5
|
[C][S][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=N][C][=N][N][=C][N][Ring1][Branch1][C][C][C][Ring1][Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C@H1][Branch1][C][O][C][O][Ring1][Branch2]
|
N15CCC2(CC1)C[C@H](O)CO2.c17nnc2n1CCC2.C3(=O)[C@H]57.C6C4.CS6.N34
|
C=CCN1CCN(C(=O)[C@@H](NC(=O)[C@@H]2CCO[C@H]2C=C)c2ccoc2)CC1
|
C=CCNCCNC=O)[C@@H]NC=O)[C@@H]CCO[C@H]5C=C)))))))))cccoc5)))))))CC6
|
[C][=C][C][N][C][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C@@H1][C][C][O][C@H1][Ring1][Branch1][C][=C][C][C][=C][O][C][=Ring1][Branch1][C][C][Ring2][Ring1][Branch2]
|
N15CCN3CC1.[C@@H]17CCO[C@H]1C=C.C3(=O)[C@@H]68.c18ccoc1.C=CC5.C47=O.N46
|
CC=CC(=O)NC[C@]1(COC)CCCN1C(=O)CCCc1ccccc1N
|
CC=CC=O)NC[C@]COC)))CCCN5C=O)CCCcccccc6N
|
[C][C][=C][C][=Branch1][C][=O][N][C][C@][Branch1][Ring2][C][O][C][C][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N]
|
[C@@]178CCCN13.c19ccccc1N.C3(=O)CCC9.C=6C2=O.CC=6.N25.C57.C48.O4C
|
O=C([C@H]1C[C@H](n2ccnn2)C1)N1C[C@H]2C[C@@H](N=c3[nH]nc(C4CC4)o3)CC[C@H]2C1
|
O=C[C@H]C[C@H]nccnn5)))))C4))))NC[C@H]C[C@@H]N=c[nH]ncCCC3)))o5))))))CC[C@H]6C9
|
[O][=C][Branch1][S][C@H1][C][C@H1][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][=Branch2][N][C][C@H1][C][C@@H1][Branch1][S][N][=C][NH1][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2][C][C][C@H1][Ring1][#C][C][Ring2][Ring1][C]
|
N15C[C@H]2C[C@@H](N=c3[nH]nc8o3)CC[C@H]2C1.[C@H]16C[C@H]7C1.n17ccnn1.O=C56.C18CC1
|
Cn1cc(-c2ncc(C(=O)Nc3nnc(C(C)(C)C)o3)s2)cn1
|
Cncc-cnccC=O)NcnncCC)C)C))o5)))))))s5)))))cn5
|
[C][N][C][=C][Branch2][Ring1][P][C][=N][C][=C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=N][N][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][O][Ring1][=Branch2][S][Ring1][P][C][=N][Ring2][Ring1][=Branch1]
|
Cn1cc8cn1.c18ncc6s1.c15nnc7o1.C7(C)(C)C.C46=O.N45
|
Cc1ncc(C(=O)N2CCC[C@H](NC(=O)c3c(C)ccc(C)c3C)[C@H](F)C2)o1
|
CcnccC=O)NCCC[C@H]NC=O)ccC)cccC)c6C)))))))))[C@H]F)C7))))))))o5
|
[C][C][=N][C][=C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][C][C@H1][Branch1][C][F][C][Ring2][Ring1][Ring2][O][Ring2][Ring1][O]
|
N14CCC[C@H]6[C@H](F)C1.c18c(C)ccc(C)c1C.Cc1ncc7o1.C47=O.C58=O.N56
|
O=C(N[C@H]1C[C@H](CNC(=O)C2COCOC2)C1)c1ccc2c[nH]nc2n1
|
O=CN[C@H]C[C@H]CNC=O)CCOCOC6)))))))))C4)))))ccccc[nH]nc5n9
|
[O][=C][Branch2][Ring1][Branch2][N][C@H1][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][O][C][O][C][Ring1][=Branch1][C][Ring1][=C][C][C][=C][C][=C][NH1][N][=C][Ring1][Branch1][N][=Ring1][=Branch2]
|
c17ccc2c[nH]nc2n1.C18COCOC1.[C@H]16C[C@H]9C1.O=C37.C48=O.N36.C59.N45
|
CCc1cccc(C(=O)N[C@H]2COC[C@H]2NC(=O)C(F)(F)CC2CC2)c1
|
CCcccccC=O)N[C@H]COC[C@H]5NC=O)CF)F)CCCC3))))))))))))))c6
|
[C][C][C][=C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][Branch2]
|
c19cccc7c1.C4(=O)C(F)(F)C8.[C@H]15COC[C@H]16.C37=O.C18CC1.CC9.N35.N46
|
CC(C)N(CCN(C)C(=O)C1=CCC(C)(C)CC1)C(=O)C[C@H]1OCCOC1(C)C
|
CCC)NCCNC)C=O)C=CCCC)C)CC6))))))))))C=O)C[C@H]OCCOC6C)C
|
[C][C][Branch1][C][C][N][Branch2][Ring1][=Branch2][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2][C][=Branch1][C][=O][C][C@H1][O][C][C][O][C][Ring1][=Branch1][Branch1][C][C][C]
|
C2(=O)C1=CCC(C)(C)CC1.[C@H]17OCCOC1(C)C.C3(=O)C7.CC4C.N345.C5C6.N26C
|
CSCc1nc(-c2cnc(Cl)c(Br)c2)n(Cc2ccccc2Cl)n1
|
CSCcnc-ccncCl)cBr)c6))))))nCcccccc6Cl))))))))n5
|
[C][S][C][C][N][=C][Branch1][#C][C][=C][N][=C][Branch1][C][Cl][C][Branch1][C][Br][=C][Ring1][Branch2][N][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][=Ring2][Ring1][Branch1]
|
c17cnc(Cl)c(Br)c1.c15nc7n4n1.c16ccccc1Cl.CS3.C35.C46
|
CCc1cnoc1C(=O)Nc1cccc(NC(=O)CCCc2nc(C)no2)c1
|
CCccnoc5C=O)NcccccNC=O)CCCcncC)no5))))))))))c6
|
[C][C][C][C][=N][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][C][=N][C][Branch1][C][C][=N][O][Ring1][=Branch1][=C][Ring2][Ring1][C]
|
c15cccc6c1.c19cnoc17.C4(=O)CCC8.c18nc(C)no1.C37=O.CC9.N35.N46
|
CCOc1ccsc1C(=O)N1CC[C@@H]1CNC(=O)c1[nH]nc(OC)c1Cl
|
CCOcccsc5C=O)NCC[C@@H]4CNC=O)c[nH]ncOC))c5Cl
|
[C][C][O][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][NH1][N][=C][Branch1][Ring1][O][C][C][=Ring1][#Branch1][Cl]
|
c19[nH]nc5c1Cl.c16ccsc18.N12CC[C@@H]1%10.C28=O.C39=O.CC4.O46.C7%10.N37.O5C
|
C#CC[C@](C)(NC(=O)C1CCCCCC1)C(=O)N[C@@H]1CCC[C@@H]1C(C)C
|
C#CC[C@]C)NC=O)CCCCCCC7)))))))))C=O)N[C@@H]CCC[C@@H]5CC)C
|
[C][#C][C][C@][Branch1][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][Branch1][C][C][C]
|
C#CC[C@@]4(C)C3=O.C16CCCCCC1.[C@@H]15CCC[C@@H]17.C26=O.C7(C)C.N24.N35
|
CO[C@H](C)C(=O)N[C@H]1COCC[C@H]1NC(=O)c1cccc(C2CC2)c1
|
CO[C@H]C)C=O)N[C@H]COCC[C@H]6NC=O)cccccCCC3)))c6
|
[C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][O][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][Ring1][=Branch2]
|
[C@H]16COCC[C@H]17.c18cccc9c1.[C@@H]5(C)C3=O.C48=O.C19CC1.CO5.N36.N47
|
O=C(N[C@@H]1CCCOC1)[C@@H]1c2ccccc2CN1C(=O)c1cc(O)c(O)c(O)c1
|
O=CN[C@@H]CCCOC6)))))))[C@@H]cccccc6CN9C=O)cccO)cO)cO)c6
|
[O][=C][Branch1][#Branch2][N][C@@H1][C][C][C][O][C][Ring1][=Branch1][C@@H1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][=Branch2]
|
O=C3[C@@H]1c2ccccc2CN14.c16cc(O)c(O)c(O)c1.[C@@H]15CCCOC1.C46=O.N35
|
CO[C@H](C)CNC(=O)[C@@H]1C[C@H](F)CN1C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21
|
CO[C@H]C)CNC=O)[C@@H]C[C@H]F)CN5C=O)[C@@H]CCC[C@@H]CCCC[C@@H]6%10
|
[C][O][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][Ring1][#Branch2]
|
[C@@H]18CCC[C@@H]2CCCC[C@@H]21.[C@@H]17C[C@H](F)CN14.[C@@H]5(C)C6.C37=O.C48=O.CO5.N36
|
COC(=O)[C@@H]1C[C@@]1(C(=O)N1C[C@@H](CNC(=O)C2=CCCOC2)C2(CC2)C1)C(C)C
|
COC=O)[C@@H]C[C@@]3C=O)NC[C@@H]CNC=O)C=CCCOC6)))))))))CCC3))C5))))))CC)C
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C@@][Ring1][Ring1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][C][O][C][Ring1][=Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][P][C][Branch1][C][C][C]
|
N14C[C@@H]9C2(CC2)C1.C5(=O)C1=CCCOC1.[C@@H]17C[C@@]18%10.C37=O.C48=O.C%10(C)C.CO3.C69.N56
|
C#C[C@@H](C)N(C)C(=O)Cn1cc(CNC(=O)C[C@H](CC)C(C)C)nn1
|
C#C[C@@H]C)NC)C=O)CnccCNC=O)C[C@H]CC))CC)C)))))))nn5
|
[C][#C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][=C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][Ring1][C][C][C][Branch1][C][C][C][N][=N][Ring1][S]
|
C3(=O)C[C@H](CC)C(C)C.n16cc7nn1.C#C[C@H]4C.C2(=O)C6.N24C.C57.N35
|
CC[C@H]1[C@H](C(=O)N(C)[C@H]2CN(C(=O)c3cc(O)n(CC)n3)CC[C@H]2O)CCN1C
|
CC[C@H][C@H]C=O)NC)[C@H]CNC=O)cccO)nCC))n5))))))CC[C@H]6O)))))))))CCN5C
|
[C][C][C@H1][C@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][Branch1][C][O][N][Branch1][Ring1][C][C][N][=Ring1][Branch2][C][C][C@H1][Ring1][S][O][C][C][N][Ring2][Ring1][#Branch2][C]
|
[C@H]16CN5CC[C@H]1O.[C@H]1%10[C@H]8CCN1C.c17cc(O)n9n1.C48=O.N46C.C57=O.CC%10.C9C
|
Cc1snnc1C(=O)N(C)[C@@H](C)CNC(=O)C1(n2cccn2)CC1
|
Ccsnnc5C=O)NC)[C@@H]C)CNC=O)Cncccn5)))))CC3
|
[C][C][S][N][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][C][C][Ring1][Branch2]
|
Cc1snnc17.n19cccn1.[C@H]5(C)C6.C189CC1.C37=O.N35C.C48=O.N46
|
CS[C@@H](C(=O)N1C[C@@H](NC(=O)c2cc(N(C)C)ccn2)C2(CC2)C1)C(C)(C)C
|
CS[C@@H]C=O)NC[C@@H]NC=O)cccNC)C))ccn6))))))))CCC3))C5))))))CC)C)C
|
[C][S][C@@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N][Branch1][C][C][C][=C][C][=N][Ring1][=Branch2][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][Ring1][C][Branch1][C][C][Branch1][C][C][C]
|
[C@H]5(C3=O)C(C)(C)C.N13C[C@@H]7C2(CC2)C1.c18cc6ccn1.C48=O.N6(C)C.CS5.N47
|
C#CCn1cc(NC(=O)[C@](C)(NC(=O)C(F)F)c2ccc(C(F)(F)F)cc2)cn1
|
C#CCnccNC=O)[C@]C)NC=O)CF)F))))ccccCF)F)F))cc6)))))))))cn5
|
[C][#C][C][N][C][=C][Branch2][Ring2][Branch2][N][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][O][N][C][=Branch1][C][=O][C][Branch1][C][F][F][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][=N][Ring2][Ring1][#Branch2]
|
c18ccc9cc1.n17cc6cn1.C3(=O)[C@]58C.C4(=O)C(F)F.C9(F)(F)F.C#CC7.N36.N45
|
CN(Cc1cn[nH]c1)C(=O)[C@H]1OCC[C@H]1CNC(=O)CCN1CCCCC1
|
CNCccn[nH]c5))))))C=O)[C@H]OCC[C@H]5CNC=O)CCNCCCCC6
|
[C][N][Branch1][=Branch2][C][C][C][=N][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][C@H1][O][C][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][N][C][C][C][C][C][Ring1][=Branch1]
|
[C@H]17OCC[C@H]18.N16CCCCC1.c19cn[nH]c1.C3(=O)CC6.CN24.C27=O.C49.C58.N35
|
C[C@H](Sc1ncccn1)C(=O)N[C@@H]1CN(C(=O)c2cc(Cl)ncc2O)CC[C@@H]1C
|
C[C@H]Scncccn6)))))))C=O)N[C@@H]CNC=O)cccCl)ncc6O))))))))CC[C@@H]6C
|
[C][C@H1][Branch1][#Branch2][S][C][=N][C][=C][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][O][C][C][C@@H1][Ring1][S][C]
|
[C@@H]16CN4CC[C@@H]1C.c17cc(Cl)ncc1O.c18ncccn1.C[C@H]5C3=O.C47=O.S58.N36
|
CCCC(C)=CC(=O)N1CC[C@@]2(C[C@@H](NC(=O)CC3(OCC)CCC3)CO2)C1
|
CCCCC)=CC=O)NCC[C@@]C[C@@H]NC=O)CCOCC)))CCC4)))))))CO5))))C5
|
[C][C][C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][O][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][Branch1][Ring2][O][C][C][C][C][C][Ring1][#Branch1][C][O][Ring1][S][C][Ring2][Ring1][Ring2]
|
N14CC[C@@]2(C[C@@H]8CO2)C1.CCCC=9C.C16%10CCC1.C=9C4=O.C5(=O)C%10.N58.O67.C7C
|
CCn1cccc1C(=O)NC[C@H]1CC(C(=O)N[C@H]2CCC2(C)C)=NO1
|
CCncccc5C=O)NC[C@H]CCC=O)N[C@H]CCC4C)C)))))))=NO5
|
[C][C][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][Branch1][S][C][=Branch1][C][=O][N][C@H1][C][C][C][Ring1][Ring2][Branch1][C][C][C][=N][O][Ring1][=C]
|
[C@H]19CC(C4=O)=NO1.n18cccc17.[C@H]16CCC1(C)C.C37=O.CC8.N35.C59.N46
|
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