SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
COCCCOCC(=O)N(C)CCCCCC(=O)NCCc1ncccc1C
|
COCCCOCC=O)NC)CCCCCC=O)NCCcncccc6C
|
[C][O][C][C][C][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][=N][C][=C][C][=C][Ring1][=Branch1][C]
|
C7CCCCC3=O.c19ncccc1C.C4CC5.C6C2=O.N27C.C8C9.CO4.O56.N38
|
CS(=O)(=O)c1ccc(C(=O)NC2CC(CCNC(=O)C=C3CCCC3)C2)s1
|
CS=O)=O)ccccC=O)NCCCCCNC=O)C=CCCCC5))))))))))C4))))))s5
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][Branch1][S][C][C][N][C][=Branch1][C][=O][C][=C][C][C][C][C][Ring1][Branch1][C][Ring1][#C][S][Ring2][Ring1][#Branch1]
|
CS(=O)(=O)c1ccc8s1.C17CC%10C1.C1=9CCCC1.C5(=O)C=9.C48=O.C%10C6.N47.N56
|
CC(C)C1(C(=O)NC[C@@]2(F)CCCN(C(=O)C3(CO)CCCC3)C2)CC1
|
CCC)CC=O)NC[C@@]F)CCCNC=O)CCO))CCCC5))))))C6)))))))))CC3
|
[C][C][Branch1][C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][F][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][C][C][Ring1][#Branch1][C][Ring1][S][C][C][Ring2][Ring1][#Branch1]
|
[C@]1%10(F)CCCN5C1.C18%11CCCC1.C179CC1.CC9C.C47=O.C58=O.N46.C6%10.C%11O
|
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1C[C@@H](OC)CN1C(=O)c1cc(C)c(C)nc1C
|
C=CC)C[C@@H]C)C=O)NC[C@@H]C[C@@H]OC))CN5C=O)cccC)cC)nc6C
|
[C][=C][Branch1][C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][Ring1][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][N][=C][Ring1][Branch2][C]
|
c16cc(C)c(C)nc1C.C=C(C)C[C@@H](C)C2=O.[C@@H]17C[C@@H]4CN13.C36=O.N25.C57.O4C
|
C#C[C@@H](CC1CCC1)NC(=O)[C@H](F)C1(O)CN(C(=O)CCC(=C)Cl)C1
|
C#C[C@@H]CCCCC4)))))NC=O)[C@H]F)CO)CNC=O)CCC=C)Cl)))))C4
|
[C][#C][C@@H1][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][Branch1][C][O][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=C][Cl][C][Ring1][N]
|
C3(=O)CCC(=C)Cl.C16(O)CN3C1.C#C[C@H]4C5.C2(=O)[C@@H]6F.C15CCC1.N24
|
CO[C@@H](C(=O)NCC#CCNC(=O)C1=C(C)C(C)(C)OC1=O)C1CCCCC1
|
CO[C@@H]C=O)NCC#CCNC=O)C=CC)CC)C)OC5=O))))))))))))))CCCCCC6
|
[C][O][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][#C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][Branch2][=O][C][C][C][C][C][C][Ring1][=Branch1]
|
C3(=O)C1=C(C)C(C)(C)OC1=O.C17CCCCC1.[C@@H]47C2=O.C5C#CC6.CO4.N25.N36
|
O=C(c1ccn(-c2ccc(Cl)cc2)n1)N1CC[C@H]2[C@H](CCN2C(=O)C2CCC2)C1
|
O=Ccccn-ccccCl)cc6))))))n5)))))NCC[C@H][C@H]CCN5C=O)CCCC4))))))))C6
|
[O][=C][Branch2][Ring1][Branch1][C][C][=C][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=Ring1][N][N][C][C][C@H1][C@H1][Branch1][S][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][Ring1][#C]
|
N13CC[C@H]2[C@H](CCN24)C1.c17ccc(Cl)cc1.c15ccn7n1.C16CCC1.O=C35.C46=O
|
COC(=O)C(C)(C)CC(=O)N(CC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O)CC(C)C
|
COC=O)CC)C)CC=O)NCC=O)N[C@@H]C[C@H]C[C@H]5[C@@H]O)[C@H]5O)))))))))))CCC)C
|
[C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][C@H1][Ring1][Branch1][C@@H1][Branch1][C][O][C@H1][Ring1][=Branch1][O][C][C][Branch1][C][C][C]
|
C3(=O)C(C)(C)CC4=O.[C@@H]18C[C@H]2C[C@H]1[C@@H](O)[C@H]2O.C6C5=O.C7C(C)C.N467.CO3.N58
|
CNC(=O)NCC(=O)N1C[C@H]2C[C@H](NC(=O)[C@H]3OCCCC3(C)C)[C@H]1C2
|
CNC=O)NCC=O)NC[C@H]C[C@H]NC=O)[C@H]OCCCC6C)C)))))))))[C@H]6C5
|
[C][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][O][C][C][C][C][Ring1][=Branch1][Branch1][C][C][C][C@H1][Ring1][P][C][Ring1][S]
|
N16C[C@@H]2C[C@@H]1[C@@H]9C2.[C@H]1%10OCCCC1(C)C.C8C6=O.C45=O.C7%10=O.CN4.N58.N79
|
CCc1[nH]ccc1C(=O)N1C[C@@H](C(=O)N=c2ccn([C@@H](C)CC)[nH]2)C(C)(C)C1
|
CCc[nH]ccc5C=O)NC[C@@H]C=O)N=cccn[C@@H]C)CC)))[nH]5)))))))CC)C)C5
|
[C][C][C][NH1][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][=C][C][=C][N][Branch1][#Branch1][C@@H1][Branch1][C][C][C][C][NH1][Ring1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][Ring1]
|
C4(=O)N=c1ccn6[nH]1.N13C[C@@H]4C(C)(C)C1.c17[nH]ccc15.[C@H]6(C)CC.C35=O.CC7
|
COCCN(C)CC(=O)N1CC2(CCCCN(C(=O)CC(C)(C)CCOC)C2)C1
|
COCCNC)CC=O)NCCCCCCNC=O)CCC)C)CCOC)))))))C7))))))C4
|
[C][O][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][O][C][C][Ring1][P][C][Ring2][Ring1][Ring2]
|
N13CC2(CCCCN4C2)C1.C4(=O)CC(C)(C)CC6.C8C3=O.C5C7.N78C.CO5.O6C
|
CSC1(C(=O)NCCCNC(=O)CC2=CCOCC2)CCC1
|
CSCC=O)NCCCNC=O)CC=CCOCC6))))))))))))))CCC4
|
[C][S][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][C][=C][C][O][C][C][Ring1][=Branch1][C][C][C][Ring2][Ring1][Ring2]
|
C4(=O)CC1=CCOCC1.C178CCC1.C5CC6.C38=O.CS7.N35.N46
|
CCCN1CCC[C@H]1C(=O)N1C[C@@H]2C[C@H]1[C@@H]2NC(=O)C[C@@](C)(C1CCC1)N(C)C
|
CCCNCCC[C@H]5C=O)NC[C@@H]C[C@H]5[C@@H]4NC=O)C[C@@]C)CCCC4))))NC)C
|
[C][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Ring1][Branch1][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][C@@][Branch1][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][N][Branch1][C][C][C]
|
N13C[C@@H]2C[C@H]1[C@@H]27.C4(=O)C[C@]69C.N15CCC[C@H]18.C19CCC1.CCC5.C38=O.N6(C)C.N47
|
C#CCCNC(=O)CCc1ccc(C(=O)NCc2ccccc2OC(F)F)[nH]1
|
C#CCCNC=O)CCccccC=O)NCcccccc6OCF)F))))))))))))[nH]5
|
[C][#C][C][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][F][NH1][Ring2][Ring1][Ring1]
|
c1%10ccccc15.c19ccc8[nH]1.C3(=O)CC9.C#CCC6.O5C(F)F.C48=O.N36.N47.C7%10
|
O=C(N[C@H]1C[C@H](O)CN(C(=O)[C@@H]2CCCS2)C1)c1cc2n(n1)CCNS2(=O)=O
|
O=CN[C@H]C[C@H]O)CNC=O)[C@@H]CCCS5))))))C6)))))))cccnn5)CCNS6=O)=O
|
[O][=C][Branch2][Ring1][#Branch2][N][C@H1][C][C@H1][Branch1][C][O][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][S][Ring1][Branch1][C][Ring1][=C][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][N][S][Ring1][#Branch1][=Branch1][C][=O][=O]
|
c17cc2n(n1)CCNS2(=O)=O.[C@H]15C[C@H](O)CN4C1.[C@@H]16CCCS1.O=C37.C46=O.N35
|
CC[C@H]1CN(C(=O)[C@H](C)n2cncn2)C[C@@H]1C(=O)Nn1nnc(C)c1C
|
CC[C@H]CNC=O)[C@H]C)ncncn5)))))))C[C@@H]5C=O)NnnncC)c5C
|
[C][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=N][C][=N][Ring1][Branch1][C][C@@H1][Ring1][=C][C][=Branch1][C][=O][N][N][N][=N][C][Branch1][C][C][=C][Ring1][=Branch1][C]
|
C4(=O)Nn1nnc(C)c1C.[C@H]16CN3C[C@@H]14.C3(=O)[C@@H]5C.n15cncn1.CC6
|
CC1(C)C[C@H](NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CN(C(=O)[C@H](O)C2CCC2)C1
|
CCC)C[C@H]NC=O)[C@@H]CC[C@@H]CCCC[C@@H]6C%10))))))))))))CNC=O)[C@H]O)CCCC4))))))C6
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][Ring1][#Branch2][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][C][Ring1][Ring2][C][Ring2][Ring1][N]
|
[C@@H]17CC[C@@H]2CCCC[C@@H]2C1.CC1(C)C[C@H]6CN5C1.C5(=O)[C@@H]8O.C18CCC1.C47=O.N46
|
C=CCCCCCC(=O)N1C[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(C)n2)C[C@H]1C
|
C=CCCCCCC=O)NC[C@H]C)NC=O)cccc[N+]=O)[O-]))cC)n6)))))))C[C@H]6C
|
[C][=C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch1][C][C][=N][Ring1][#Branch2][C][C@H1][Ring2][Ring1][Ring1][C]
|
c15ccc([N+](=O)[O-])c(C)n1.C=CCCCCCC3=O.N13C[C@H](C)N4C[C@H]1C.C45=O
|
CN1[C@H]2CCC[C@H]1CN(c1ncccc1S(=O)(=O)NCCc1cnoc1)C2
|
CN[C@H]CCC[C@H]6CNcncccc6S=O)=O)NCCccnoc5)))))))))))))))C8
|
[C][N][C@H1][C][C][C][C@H1][Ring1][=Branch1][C][N][Branch2][Ring1][#Branch2][C][=N][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][=N][O][C][=Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
CN1[C@H]2CCC[C@H]1CN5C2.c15ncccc1S4(=O)=O.c16cnoc1.C3C6.N34
|
C[C@@H](CNC(=O)Cn1cnccc1=O)CN(C)C(=O)c1ccc(Cl)cn1
|
C[C@@H]CNC=O)Cncnccc6=O)))))))))))CNC)C=O)ccccCl)cn6
|
[C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][N][C][=N][C][=C][C][Ring1][=Branch1][=O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1]
|
n17cnccc1=O.c16ccc(Cl)cn1.C[C@@H](C4)C5.C2(=O)C7.N35C.C36=O.N24
|
CC[C@H](C)[C@H](O)[C@H](C)C(=O)N(C)C[C@H]1CCCN1C(=O)[C@@]1(C)CNC(=O)C1
|
CC[C@H]C)[C@H]O)[C@H]C)C=O)NC)C[C@H]CCCN5C=O)[C@@]C)CNC=O)C5
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1]
|
CC[C@H](C)[C@H](O)[C@H](C)C2=O.[C@]15(C)CNC(=O)C1.[C@H]16CCCN13.N24C.C35=O.C46
|
C=CCCn1c(CN2CCC[C@H](O)C2)nnc1N1CCC[C@]2(C=CCO2)CC1
|
C=CCCncCNCCC[C@H]O)C6)))))))nnc5NCCC[C@]C=CCO5))))CC7
|
[C][=C][C][C][N][C][Branch1][=N][C][N][C][C][C][C@H1][Branch1][C][O][C][Ring1][#Branch1][=N][N][=C][Ring1][=N][N][C][C][C][C@][Branch1][#Branch1][C][=C][C][O][Ring1][Branch1][C][C][Ring1][O]
|
N14CCC[C@]2(C=CCO2)CC1.n15c4nnc16.N13CCC[C@H](O)C1.C=CCC5.C36
|
C[C@@H](NC(=O)[C@@H]1CC(=O)NC1(C)C)C1(O)CN(c2ncnc(C(C)(C)C)n2)C1
|
C[C@@H]NC=O)[C@@H]CC=O)NC5C)C))))))))CO)CNcncncCC)C)C))n6))))))C4
|
[C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][Branch1][C][C][C][C][Branch1][C][O][C][N][Branch2][Ring1][Ring1][C][=N][C][=N][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][Ring1][#Branch2][C][Ring1][#C]
|
[C@@H]16CC(=O)NC1(C)C.c15ncnc7n1.C18(O)CN5C1.C7(C)(C)C.C[C@@H]48.C36=O.N34
|
CN(C[C@H]1CN(C(=O)CNC(=O)C(C)(C)C)CCO1)C(=O)[C@H](O)C1CCC1
|
CNC[C@H]CNC=O)CNC=O)CC)C)C))))))CCO6)))))))C=O)[C@H]O)CCCC4
|
[C][N][Branch2][Ring1][#C][C][C@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][Ring1][S][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][C][Ring1][Ring2]
|
[C@H]17CN2CCO1.C3(=O)C(C)(C)C.C4(=O)[C@@H]8O.C2(=O)C6.C18CCC1.CN45.C57.N36
|
Cc1ncncc1C(=O)N[C@H](C)CNC(=O)C1=C[S@+]([O-])CCC1
|
Ccncncc6C=O)N[C@H]C)CNC=O)C=C[S@+][O-])CCC6
|
[C][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][S@+1][Branch1][C][O-1][C][C][C][Ring1][#Branch1]
|
C3(=O)C1=C[S@+]([O-])CCC1.Cc1ncncc16.[C@@H]4(C)C5.C26=O.N24.N35
|
C#CC[C@@H](C)C(=O)N1CCCC(NC(=O)Cn2nccc2C)CCC1
|
C#CC[C@@H]C)C=O)NCCCCNC=O)Cnnccc5C)))))))))CCC8
|
[C][#C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][N][N][=C][C][=C][Ring1][Branch1][C][C][C][C][Ring2][Ring1][C]
|
N13CCCC5CCC1.C#CC[C@@H](C)C3=O.n16nccc1C.C4(=O)C6.N45
|
COC(=O)[C@H]1C[C@@H]1C(=O)NCC(C)=CC(=O)NCC1(C)CCCCCC1
|
COC=O)[C@H]C[C@@H]3C=O)NCCC)=CC=O)NCCC)CCCCCC7
|
[C][O][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][C][C][C][C][C][Ring1][Branch2]
|
C1%10(C)CCCCCC1.[C@H]17C[C@@H]18.C5C=9C.C=9C4=O.C27=O.C38=O.CO2.N35.N46.C6%10
|
CC[C@H](CCC(=O)N[C@H]1C[C@@H]1[C@@H]1C[C@H]1C)NC(=O)C1CN(C2CCC2)C1
|
CC[C@H]CCC=O)N[C@H]C[C@@H]3[C@@H]C[C@H]3C)))))))))))NC=O)CCNCCCC4))))C4
|
[C][C][C@H1][Branch2][Ring1][Ring1][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Ring1][Ring1][C@@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][Branch2]
|
CC[C@@H]5CCC3=O.[C@H]16C[C@@H]1[C@@H]1C[C@H]1C.C18CN7C1.C17CCC1.C48=O.N36.N45
|
CCCN(CCNC(=O)[C@H]1CCC[C@H]1O)c1ncnc(C)c1OC
|
CCCNCCNC=O)[C@H]CCC[C@H]5O))))))))))cncncC)c6OC
|
[C][C][C][N][Branch1][S][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C@H1][Ring1][Branch1][O][C][=N][C][=N][C][Branch1][C][C][=C][Ring1][#Branch1][O][C]
|
c17ncnc(C)c13.[C@H]18CCC[C@H]1O.CCC4.N457.C5C6.C28=O.N26.O3C
|
CC(C)CCCC(=O)N1CC[C@@](O)(CNC(=O)[C@@]2(F)CCOC2)C1
|
CCC)CCCC=O)NCC[C@@]O)CNC=O)[C@@]F)CCOC5))))))))C5
|
[C][C][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][O][Branch1][P][C][N][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][O][C][Ring1][=Branch1][C][Ring1][S]
|
CC(C)CCCC3=O.N13CC[C@]7(O)C1.[C@]16(F)CCOC1.C46=O.C57.N45
|
CC1(C)CCCN(C(=O)CCCF)[C@H]1CNC(=O)CCOc1ccccc1F
|
CCC)CCCNC=O)CCCF)))))[C@H]6CNC=O)CCOcccccc6F
|
[C][C][Branch1][C][C][C][C][C][N][Branch1][=Branch2][C][=Branch1][C][=O][C][C][C][F][C@H1][Ring1][=N][C][N][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F]
|
CC1(C)CCCN2[C@H]17.c15ccccc1F.C2(=O)CCCF.C3(=O)CC4.C67.N36.O45
|
Cc1ccc([C@H](C)C(=O)N[C@H]2CCCCN(C(=O)C3(CN(C)C)CC3)C2)cc1
|
Ccccc[C@H]C)C=O)N[C@H]CCCCNC=O)CCNC)C)))CC3))))C7))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][#Branch1][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][#Branch1][C][N][Branch1][C][C][C][C][C][Ring1][#Branch1][C][Ring1][S][C][=C][Ring2][Ring1][O]
|
[C@H]17CCCCN5C1.Cc1ccc%10cc1.[C@@H]%10(C)C4=O.C189CC1.C58=O.N6(C)C.N47.C69
|
CSC(SC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NCC1CC2(CC(O)C2)C1
|
CSCSC))C=O)N[C@@H]Cccnc[nH]5))))))C=O)NCCCCCCO)C4)))C4
|
[C][S][C][Branch1][Ring1][S][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][=Branch2][C][C][Branch1][C][O][C][Ring1][Branch1][C][Ring1][Branch2]
|
C1%10CC2(C1)CC(O)C2.[C@H]5(C9)C4=O.C78C3=O.c19cnc[nH]1.CS7.S8C.N35.N46.C6%10
|
CO[C@H]1CCN(CC(=O)N2CC[C@@H](CCNC(=O)[C@@H](C)c3ccn(C)n3)C2)C1
|
CO[C@H]CCNCC=O)NCC[C@@H]CCNC=O)[C@@H]C)cccnC)n5))))))))))C5)))))))C5
|
[C][O][C@H1][C][C][N][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][Ring2][Ring1][C][C][Ring2][Ring1][#Branch2]
|
[C@H]16CCN7C1.N14CC[C@@H]%10C1.c19ccn(C)n1.C5(=O)[C@H]9C.C7C4=O.C%10C8.CO6.N58
|
CC=CC=CC(=O)NCC[C@@H](C)N(C)C(=O)CNC(=O)Cn1cncn1
|
CC=CC=CC=O)NCC[C@@H]C)NC)C=O)CNC=O)Cncncn5
|
[C][C][=C][C][=C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][N][C][=N][C][=N][Ring1][Branch1]
|
C5C[C@H]6C.n1%10cncn1.C=9C2=O.C3(=O)C7.C4(=O)C%10.C=8C=9.N36C.CC=8.N25.N47
|
CC(C)CCCCC(=O)NC[C@]1(F)C[C@@H](CNC(=O)c2ccnn2C2CC2)C1
|
CCC)CCCCC=O)NC[C@]F)C[C@@H]CNC=O)cccnn5CCC3)))))))))))C4
|
[C][C][Branch1][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring1][P]
|
CC(C)CCCCC3=O.[C@]18(F)C[C@H]9C1.c17ccnn1%10.C47=O.C1%10CC1.N35.C58.C69.N46
|
CC=C(CC)C(=O)N1CC2(CC(CNC(=O)CCc3cn[nH]c3)C2)C1
|
CC=CCC))C=O)NCCCCCNC=O)CCccn[nH]c5))))))))))C4)))C4
|
[C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring1][#C][C][Ring2][Ring1][C]
|
N14CC2(CC8C2)C1.C=7(CC)C4=O.C5(=O)CC9.c19cn[nH]c1.CC=7.C68.N56
|
C/C=C(\C)C(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)CCCc1ncco1
|
C/C=C\C)C=O)NCCC[C@H][C@@H]6CCN5C=O)CCCcncco5
|
[C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][=N][C][=C][O][Ring1][Branch1]
|
N13CCC[C@H]2[C@@H]1CCN24.C4(=O)CCC6.C=5(C)C3=O.c16ncco1.CC=5
|
C[C@H]1C[C@H](CNc2cnc(C#N)c(C#N)n2)CN1C(=O)C1CC(OC(F)(F)F)C1
|
C[C@H]C[C@H]CNccncC#N))cC#N))n6))))))))CN5C=O)CCCOCF)F)F)))C4
|
[C][C@H1][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=C][N][=C][Branch1][Ring1][C][#N][C][Branch1][Ring1][C][#N][=N][Ring1][#Branch2][C][N][Ring1][P][C][=Branch1][C][=O][C][C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=Branch2]
|
c16cnc(C#N)c(C#N)n1.C[C@H]1C[C@H]8CN13.C17CC4C1.O4C(F)(F)F.C37=O.C58.N56
|
C[C@H](NC(=O)CN(C(=O)COc1ccsn1)C1CCC1)C(C)(C)C#N
|
C[C@H]NC=O)CNC=O)COcccsn5))))))))CCCC4))))))))CC)C)C#N
|
[C][C@H1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][N][Branch1][=C][C][=Branch1][C][=O][C][O][C][C][=C][S][N][=Ring1][Branch1][C][C][C][C][Ring1][Ring2][C][Branch1][C][C][Branch1][C][C][C][#N]
|
C[C@H]6C(C)(C)C#N.c15ccsn1.C2(=O)C7.C3(=O)C4.C18CCC1.N378.N26.O45
|
C[C@H](CCCNC(=O)C1(c2ccsc2)CC1)NC(=O)c1ncccc1N
|
C[C@H]CCCNC=O)Ccccsc5)))))CC3))))))))NC=O)cncccc6N
|
[C][C@H1][Branch2][Ring1][#Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][C][Ring1][Branch2][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][N]
|
c17ncccc1N.C[C@@H]5CCC6.c19ccsc1.C189CC1.C38=O.C47=O.N36.N45
|
CN(CCCN(C)C(=O)[C@@]12CCCC[C@@H]1C2)C(=O)C1(Br)CC1
|
CNCCCNC)C=O)[C@@]CCCC[C@@H]6C7))))))))))))C=O)CBr)CC3
|
[C][N][Branch2][Ring1][#Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@][C][C][C][C][C@@H1][Ring1][=Branch1][C][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][Br][C][C][Ring1][Ring2]
|
[C@@]127CCCC[C@@H]1C2.C5CC6.C18(Br)CC1.CN45.N36C.C37=O.C48=O
|
Cc1nc(CC(=O)N[C@H]2CCC[C@H](N(C)C(=O)c3cc4n(n3)CCOC4)C2)cs1
|
CcncCC=O)N[C@H]CCC[C@H]NC)C=O)cccnn5)CCOC6))))))))))C6)))))))))cs5
|
[C][C][=N][C][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Branch2][Ring1][Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][O][C][Ring1][#Branch1][C][Ring2][Ring1][Ring1][=C][S][Ring2][Ring1][N]
|
c19cc2n(n1)CCOC2.[C@H]17CCC[C@H]8C1.Cc1nc%10cs1.C%10C5=O.N68C.C69=O.N57
|
CCc1conc1CC(=O)N1[C@H](C)C[C@@H]1C(=O)NCc1cc(C)ccn1
|
CCcconc5CC=O)N[C@H]C)C[C@@H]4C=O)NCcccC)ccn6
|
[C][C][C][=C][O][N][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][C][C][=C][C][=N][Ring1][#Branch1]
|
c17cc(C)ccn1.c18conc16.N12[C@H](C)C[C@@H]15.C6C2=O.C35=O.CC8.N34.C47
|
Cc1nnn(CC(=O)N[C@](C)(CNC(=O)[C@H](O)C(C)(C)C)C2CCC2)n1
|
CcnnnCC=O)N[C@]C)CNC=O)[C@H]O)CC)C)C))))))CCCC4))))))))n5
|
[C][C][N][=N][N][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C@][Branch1][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][C][C][C][C][Ring1][Ring2][N][=Ring2][Ring1][=Branch2]
|
C4(=O)[C@H](O)C(C)(C)C.Cc1nnn7n1.[C@]58(C)C6.C7C3=O.C18CCC1.N35.N46
|
C=C=CCC(=O)NCCO[C@H]1CCN(C(=O)[C@@]2(F)CCOC2)C1
|
C=C=CCC=O)NCCO[C@H]CCNC=O)[C@@]F)CCOC5))))))C5
|
[C][=C][=C][C][C][=Branch1][C][=O][N][C][C][O][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][O][C][Ring1][=Branch1][C][Ring1][=N]
|
C=C=CCC3=O.[C@H]16CCN4C1.[C@]18(F)CCOC1.C7C5.C48=O.N37.O56
|
C[C@H](CCN(C)C(=O)c1cc2ccccc2[nH]1)NC(=O)[C@@H]1Cc2ccccc21
|
C[C@H]CCNC)C=O)cccccccc6[nH]9)))))))))))))NC=O)[C@@H]Ccccccc68
|
[C][C@H1][Branch2][Ring1][Branch2][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][N][C][=Branch1][C][=O][C@@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][Branch2]
|
C4(=O)[C@@H]1Cc2ccccc21.c17cc2ccccc2[nH]1.C[C@@H]5CC6.N36C.C37=O.N45
|
Cc1cccc([C@H](F)C(=O)NC2CC3(CCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)CC3)C2)c1
|
Cccccc[C@H]F)C=O)NCCCCCNC=O)[C@H][C@@H]CCC[C@@H]56)))))))CC6)))))C4)))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][#Branch2][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C@@H1][C][C][C][C@@H1][Ring1][Branch1][Ring1][=Branch1][C][C][Ring1][=C][C][Ring1][P][=C][Ring2][Ring1][N]
|
C18CC2(CCN7CC2)C1.Cc1cccc%10c1.[C@@H]19[C@H]2CCC[C@@H]12.[C@@H]%10(F)C6=O.C79=O.N68
|
CC[C@H](C)C(=O)C(=O)N[C@H](C(=O)NC1CC2(C1)CC(OC)C2)[C@H]1CCCO1
|
CC[C@H]C)C=O)C=O)N[C@H]C=O)NCCCC4)CCOC))C4))))))))[C@H]CCCO5
|
[C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch1][Ring1][O][C][C][Ring1][#Branch1][C@H1][C][C][C][O][Ring1][Branch1]
|
CC[C@H](C)C(=O)C3=O.C17CC2(CC5C2)C1.[C@H]68C4=O.[C@H]18CCCO1.N36.N47.O5C
|
Cc1sc(C(=O)N2CCC(F)(CNC(=O)[C@H]3CCC=CCCC3)CC2)c(C)c1C
|
CcscC=O)NCCCF)CNC=O)[C@H]CCC=CCCC8)))))))))))CC6)))))))cC)c5C
|
[C][C][S][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C][C][C][=C][C][C][C][Ring1][Branch2][C][C][Ring2][Ring1][Ring1][=C][Branch1][C][C][C][=Ring2][Ring1][O][C]
|
Cc1sc7c(C)c1C.N14CCC9(F)CC1.[C@H]18CCC=CCCC1.C47=O.C58=O.C69.N56
|
COc1cccc(C(=O)N2CCN(C(=O)[C@@H]3COCCN(C[C@H](C)O)C3)CC2)c1
|
COcccccC=O)NCCNC=O)[C@@H]COCCNC[C@H]C)O)))C7))))))))CC6)))))))c6
|
[C][O][C][=C][C][=C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][O][C][C][N][Branch1][#Branch1][C][C@H1][Branch1][C][C][O][C][Ring1][O][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][O]
|
[C@@H]18COCCN7C1.c16cccc9c1.N14CCN5CC1.C7[C@H](C)O.C49=O.C58=O.CO6
|
Cc1nc(CC(=O)NC[C@@H](C)[C@@]2(O)CCN(C(=O)c3nnn4c3CCC4)C2)cs1
|
CcncCC=O)NC[C@@H]C)[C@@]O)CCNC=O)cnnnc5CCC5)))))))))C5))))))))))cs5
|
[C][C][=N][C][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C@@][Branch1][C][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][N][=N][N][C][=Ring1][Branch1][C][C][C][Ring1][Branch1][C][Ring1][S][=C][S][Ring2][Ring1][N]
|
c18nnn2c1CCC2.[C@]1%10(O)CCN6C1.Cc1nc9cs1.C9C5=O.C7[C@H]%10C.C68=O.N57
|
C#CCCC(=O)NCC(CC)(CC)NC(=O)Cc1ccc(Br)cc1C
|
C#CCCC=O)NCCCC))CC))NC=O)CccccBr)cc6C
|
[C][#C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C]
|
c16ccc(Br)cc1C.C4C5(CC)CC.C#CCCC2=O.C3(=O)C6.N24.N35
|
CCn1cc(C(=O)N2CCC[C@@H](N(C)C(=O)C34COC(C3)C4)C2)c2ccccc21
|
CCnccC=O)NCCC[C@@H]NC)C=O)CCOCC5)C5)))))))C6)))))))cccccc69
|
[C][C][N][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][O]
|
n1%10cc9c2ccccc21.N15CCC[C@@H]7C1.C128COC(C1)C2.C59=O.N67C.C68=O.CC%10
|
CC(C)CCOCC(=O)N1C[C@@H](CC(=O)N2CCn3ncnc3C2)C[C@H]1C
|
CCC)CCOCC=O)NC[C@@H]CC=O)NCCnncnc5C9)))))))))))C[C@H]5C
|
[C][C][Branch1][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][N][N][=C][N][=C][Ring1][Branch1][C][Ring1][=Branch2][C][C@H1][Ring1][P][C]
|
N15CCn2ncnc2C1.N14C[C@@H]8C[C@H]1C.CC(C)CC6.C7C4=O.C8C5=O.O67
|
C=CCCCC(=O)N1C[C@H](CNC(=O)[C@]23COC[C@H]2C3(F)F)C2(CCOCC2)C1
|
C=CCCCC=O)NC[C@H]CNC=O)[C@]COC[C@H]5C6F)F))))))))))CCCOCC6)))))C5
|
[C][=C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@][C][O][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][Branch1][C][F][F][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
N14C[C@H]8C2(CCOCC2)C1.[C@]127COC[C@H]1C2(F)F.C=CCCCC4=O.C57=O.C68.N56
|
CCCN=C(NCCC(C)(C)C(F)(F)F)N1CCC[C@@H](Cn2ccnn2)C1
|
CCCN=CNCCCC)C)CF)F)F))))))NCCC[C@@H]Cnccnn5))))))C6
|
[C][C][C][N][=C][Branch2][Ring1][Ring1][N][C][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F][N][C][C][C][C@@H1][Branch1][=Branch2][C][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][N]
|
CCCN=C(N3)N1CCC[C@@H]5C1.C3CC(C)(C)C(F)(F)F.n14ccnn1.C45
|
CC1=C(C(=O)NCC23CCC(NC(=O)[C@@H]4CCN(C)[C@@H]4C)(CC2)CO3)CCCO1
|
CC=CC=O)NCCCCCNC=O)[C@@H]CCNC)[C@@H]5C))))))))CC6))CO6)))))))))CCCO6
|
[C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C][N][Branch1][C][C][C@@H1][Ring1][=Branch1][C][Branch1][Branch1][C][C][Ring1][S][C][O][Ring2][Ring1][C][C][C][C][O][Ring2][Ring1][N]
|
CC1=C(C5=O)CCCO1.C12%10CCC8(CC1)CO2.[C@@H]19CCN(C)[C@@H]1C.C69=O.N57.C7%10.N68
|
CCOCC1(NC(=O)[C@@H](NC(=O)CC2(C)CCOCC2)[C@H]2CCOC2)CC1
|
CCOCCNC=O)[C@@H]NC=O)CCC)CCOCC6)))))))))[C@H]CCOC5))))))))CC3
|
[C][C][O][C][C][Branch2][Ring2][C][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][O][C][C][Ring1][#Branch1][C@H1][C][C][O][C][Ring1][Branch1][C][C][Ring2][Ring1][#Branch1]
|
C1%11(C)CCOCC1.C3(=O)[C@@H]8%10.[C@H]1%10CCOC1.C179CC1.C4(=O)C%11.CC5.O56.C69.N37.N48
|
CSC=CC(=O)N1C[C@H](NC(=O)C2CN(S(C)(=O)=O)C2)[C@@H]2C[C@@H]21
|
CSC=CC=O)NC[C@H]NC=O)CCNSC)=O)=O))C4))))))[C@@H]C[C@@H]36
|
[C][S][C][=C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][Branch2][C@@H1][C][C@@H1][Ring1][Ring1][Ring1][P]
|
N13C[C@H]6[C@@H]2C[C@@H]21.CSC=CC3=O.C17CN5C1.S5(C)(=O)=O.C47=O.N46
|
C=C=CCCC(=O)N1CCC[C@@H](N(C)C(=O)c2ccc(C#N)cc2)CC1
|
C=C=CCCC=O)NCCC[C@@H]NC)C=O)ccccC#N))cc6))))))))CC7
|
[C][=C][=C][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][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][C][Ring2][Ring1][Ring1]
|
N13CCC[C@@H]5CC1.c16ccc(C#N)cc1.C=C=CCCC3=O.N45C.C46=O
|
C[C@@H]1CN(C(=O)[C@@]2(C)CC2(F)F)C[C@H]1CNC(=O)c1c(F)cccc1C(F)(F)F
|
C[C@@H]CNC=O)[C@@]C)CC3F)F)))))C[C@H]5CNC=O)ccF)cccc6CF)F)F
|
[C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][F][F][C][C@H1][Ring1][=N][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
c17c9cccc1F.C[C@@H]1CN3C[C@H]18.[C@]16(C)CC1(F)F.C9(F)(F)F.C36=O.C47=O.C58.N45
|
CO[C@H](CCS(C)(=O)=O)C(=O)N[C@@]1(C)CCCN(C(=O)CCCn2cccn2)C1
|
CO[C@H]CCSC)=O)=O))))C=O)N[C@@]C)CCCNC=O)CCCncccn5)))))))))C6
|
[C][O][C@H1][Branch1][O][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][=Branch1][C][=O][N][C@@][Branch1][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][N][C][=C][C][=N][Ring1][Branch1][C][Ring1][P]
|
[C@@H]5(CCS(C)(=O)=O)C3=O.[C@]16(C)CCCN4C1.C4(=O)CCC7.n17cccn1.CO5.N36
|
CCC[C@H]1CN(C(=O)C[C@H]2CCCN(C)C2)CCN1C(=O)c1conc1C
|
CCC[C@H]CNC=O)C[C@H]CCCNC)C6))))))))CCN6C=O)cconc5C
|
[C][C][C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C@H1][C][C][C][N][Branch1][C][C][C][Ring1][#Branch1][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][O][N][=C][Ring1][Branch1][C]
|
[C@H]16CN3CCN14.[C@H]17CCCN(C)C1.c15conc1C.C3(=O)C7.CCC6.C45=O
|
CN(C(=O)[C@H](Cn1cncn1)NC(=O)C1CC(C)(C)C1)[C@H]1CC1(C)C
|
CNC=O)[C@H]Cncncn5))))))NC=O)CCCC)C)C4))))))))[C@H]CC3C)C
|
[C][N][Branch2][Ring1][P][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][C@H1][C][C][Ring1][Ring1][Branch1][C][C][C]
|
C2(=O)[C@@H]4C7.C16CC(C)(C)C1.n17cncn1.[C@H]15CC1(C)C.CN25.C36=O.N34
|
Cc1c[nH]nc1C(=O)NC[C@@H](C)N1CCN(C(=O)[C@@H](C)CC(F)(F)F)CC1
|
Ccc[nH]nc5C=O)NC[C@@H]C)NCCNC=O)[C@@H]C)CCF)F)F)))))CC6
|
[C][C][=C][NH1][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#C]
|
C3(=O)[C@@H](C)CC(F)(F)F.N15CCN3CC1.Cc1c[nH]nc16.C4[C@H]5C.C26=O.N24
|
C#CCCN(C)CC(=O)NC[C@H](O)CC(=O)N[C@H]1CCOC1
|
C#CCCNC)CC=O)NC[C@H]O)CC=O)N[C@H]CCOC5
|
[C][#C][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C][Ring1][Branch1]
|
C6[C@H](O)CC3=O.[C@H]17CCOC1.C#CCC4.C5C2=O.N45C.N26.N37
|
CCC(C)=C(C)C(=O)N1CCC([C@@H](C)NC(=O)c2ccccc2F)CC1
|
CCCC)=CC)C=O)NCCC[C@@H]C)NC=O)cccccc6F))))))))))CC6
|
[C][C][C][Branch1][C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][Ring2][Ring1][C]
|
N13CCC8CC1.c16ccccc1F.C=7(C)C3=O.CCC=7C.[C@H]58C.C46=O.N45
|
C=C[C@@H](O)Cc1cn(CCOCCNC(=O)c2ccccc2SC(F)F)nn1
|
C=C[C@@H]O)CccnCCOCCNC=O)cccccc6SCF)F))))))))))))))))nn5
|
[C][=C][C@@H1][Branch1][C][O][C][C][=C][N][Branch2][Ring1][=Branch2][C][C][O][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][Branch1][C][F][F][N][=N][Ring2][Ring1][#Branch1]
|
c17ccccc1%10.c19cn8nn1.C=C[C@@H](O)C9.S%10C(F)F.C8C4.C5C6.C37=O.O45.N36
|
Cc1cc(=NC[C@H](C)[C@@H](C)O)[nH]c(=NCc2ccc3c(c2)OCO3)[nH]1
|
Cccc=NC[C@H]C)[C@@H]C)O)))))[nH]c=NCcccccc6)OCO5))))))))))[nH]6
|
[C][C][=C][C][=Branch1][N][=N][C][C@H1][Branch1][C][C][C@@H1][Branch1][C][C][O][NH1][C][=Branch2][Ring1][C][=N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][NH1][Ring2][Ring1][Branch2]
|
Cc1cc(=NC[C@H](C)[C@@H](C)O)[nH]c(=NC4)[nH]1.c14ccc2c(c1)OCO2
|
C=CCC1(C(=O)N2C[C@H]3[C@@H](NC(=O)[C@@H](CO)C(C)(C)C)CO[C@H]3C2)CCCC1
|
C=CCCC=O)NC[C@H][C@@H]NC=O)[C@@H]CO))CC)C)C)))))CO[C@H]5C8)))))))))CCCC5
|
[C][=C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@H1][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][C][Branch1][C][C][Branch1][C][C][C][C][O][C@H1][Ring1][#C][C][Ring2][Ring1][C][C][C][C][C][Ring2][Ring1][=Branch2]
|
N14C[C@@H]2[C@H](C1)OC[C@@H]26.C5(=O)[C@@H](CO)C(C)(C)C.C178CCCC1.C=CC8.C47=O.N56
|
O=C1C[C@H](CC(=O)N[C@@H]2[C@H]3C[C@H]4CN(C(=O)C=C5CCCC5)[C@@H]2[C@H]4C3)CCCN1
|
O=CC[C@H]CC=O)N[C@@H][C@H]C[C@H]CNC=O)C=CCCCC5)))))))[C@@H]7[C@H]5C8))))))))))))CCCN7
|
[O][=C][C][C@H1][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][C][C][C][Ring1][Branch1][C@@H1][Ring1][#C][C@H1][Ring1][=N][C][Ring1][S][C][C][C][N][Ring2][Ring1][N]
|
[C@@H]18[C@H]2C[C@H]3CN7[C@@H]1[C@H]3C2.O=C1C[C@H]%10CCCN1.C1=9CCCC1.C%10C6=O.C7(=O)C=9.N68
|
O=C(CC1CCOCC1)N[C@H]1COCC[C@H]1NC(=O)C[C@H]1C=CS(=O)(=O)C1
|
O=CCCCCOCC6)))))))N[C@H]COCC[C@H]6NC=O)C[C@H]C=CS=O)=O)C5
|
[O][=C][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][N][C@H1][C][O][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C@H1][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1]
|
[C@H]14COCC[C@H]15.[C@H]17C=CS(=O)(=O)C1.C16CCOCC1.O=C2C6.C3(=O)C7.N24.N35
|
COCC1CN(C(=O)[C@H](C)[C@@H]2CCCN(C(=O)CCCC3CCC3)C2)C1
|
COCCCNC=O)[C@H]C)[C@@H]CCCNC=O)CCCCCCC4))))))))C6))))))))C4
|
[C][O][C][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][Ring2][C][Ring1][#C][C][Ring2][Ring1][#Branch1]
|
[C@@H]18CCCN5C1.C5(=O)CCC9.C17CN4C1.C4(=O)[C@@H]8C.C19CCC1.CO6.C67
|
CCO[C@@H](C(=O)N[C@H]1CCC[C@H]1n1cc([C@@H](C)O)nn1)C1CCCCC1
|
CCO[C@@H]C=O)N[C@H]CCC[C@H]5ncc[C@@H]C)O))nn5))))))))))))CCCCCC6
|
[C][C][O][C@@H1][Branch2][Ring1][O][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=C][Branch1][=Branch1][C@@H1][Branch1][C][C][O][N][=N][Ring1][Branch2][C][C][C][C][C][C][Ring1][=Branch1]
|
[C@H]15CCC[C@H]18.n18cc6nn1.C17CCCCC1.[C@@H]47C2=O.[C@H]6(C)O.CC3.O34.N25
|
CS(=O)(=O)CCC(=O)N[C@H]1CC[C@@H]1NC(=O)c1ccc(N)c(F)c1F
|
CS=O)=O)CCC=O)N[C@H]CC[C@@H]4NC=O)ccccN)cF)c6F
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][Branch1][C][F][=C][Ring1][Branch2][F]
|
c16ccc(N)c(F)c1F.CS(=O)(=O)CCC2=O.[C@H]14CC[C@@H]15.C36=O.N24.N35
|
O=C(NCC12CC(CNC(=O)[C@]3(CO)CCCO3)(CO1)C2)c1snnc1C1CC1
|
O=CNCCCCCNC=O)[C@]CO))CCCO5))))))))CO5))C4))))))csnnc5CCC3
|
[O][=C][Branch2][Ring2][Ring1][N][C][C][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@][Branch1][Ring1][C][O][C][C][C][O][Ring1][#Branch1][Branch1][Branch1][C][O][Ring1][S][C][Ring1][P][C][S][N][=N][C][=Ring1][Branch1][C][C][C][Ring1][Ring1]
|
C12%11CC%13(CO1)C2.[C@@]19%12CCCO1.c1%10snnc15.O=C4%10.C69=O.C15CC1.N47.C7%11.C8%13.N68.C%12O
|
O=C(CNC(=O)C(F)(F)F)N[C@H](CNC(=O)c1cncc(Cl)c1Cl)C1CCCC1
|
O=CCNC=O)CF)F)F)))))N[C@H]CNC=O)ccnccCl)c6Cl))))))))))CCCCC5
|
[O][=C][Branch1][#C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][N][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][C][C][C][C][Ring1][Branch1]
|
c18cncc(Cl)c1Cl.C3(=O)C(F)(F)F.C19CCCC1.O=C2C5.[C@H]69C7.C48=O.N35.N26.N47
|
CCN(C(=O)[C@@H]1CCS(=O)(=O)N1C)[C@@H]1CCN(C(=O)CCCc2nc(C)no2)C1
|
CCNC=O)[C@@H]CCS=O)=O)N5C)))))))[C@@H]CCNC=O)CCCcncC)no5)))))))))C5
|
[C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][Ring1][#Branch1][C][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][C][=N][C][Branch1][C][C][=N][O][Ring1][=Branch1][C][Ring1][S]
|
[C@@H]17CCS(=O)(=O)N1C.[C@@H]16CCN4C1.C4(=O)CCC8.c18nc(C)no1.N356.C37=O.CC5
|
Cc1cc(C(=O)NC2(C(=O)OC(C)(C)C)CC2)c(N)cc1F
|
CcccC=O)NCC=O)OCC)C)C))))CC3)))))cN)cc6F
|
[C][C][=C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][#Branch2][=C][Branch1][C][N][C][=C][Ring2][Ring1][Ring2][F]
|
Cc1cc8c(N)cc1F.C167CC1.C5(C)(C)C.C48=O.C37=O.N46.O35
|
CC[C@@]1(C)C=C(C(=O)N[C@H](CNC(=O)c2ccc3nn[nH]c3c2)C(C)(C)C)C1
|
CC[C@@]C)C=CC=O)N[C@H]CNC=O)ccccnn[nH]c5c9))))))))))))CC)C)C)))))C4
|
[C][C][C@@][Branch1][C][C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=N][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch2]
|
c18ccc2nn[nH]c2c1.[C@]19(C)C=C(C4=O)C1.[C@@H]6(C7)C(C)(C)C.C58=O.CC9.N46.N57
|
CCCC[C@H](C)N(C)C(=O)c1ccc(CNC(=O)[C@H]2CCCC(=O)C2)cn1
|
CCCC[C@H]C)NC)C=O)ccccCNC=O)[C@H]CCCC=O)C6)))))))))cn6
|
[C][C][C][C][C@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][=Branch1][C][=O][C][Ring1][#Branch1][C][=N][Ring1][P]
|
c17ccc9cn1.[C@H]18CCCC(=O)C1.CCCC[C@@H]5C.N35C.C37=O.C48=O.C69.N46
|
CC[C@@H](CO)N(CC(=O)N(C)Cc1ccc(F)cc1)Cc1cnn(C)c1
|
CC[C@@H]CO))NCC=O)NC)CccccF)cc6))))))))))CccnnC)c5
|
[C][C][C@@H1][Branch1][Ring1][C][O][N][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
c17ccc(F)cc1.c18cnn(C)c1.CC[C@H]3CO.C4C2=O.N346.N25C.C57.C68
|
Cc1cccc(C(=O)N[C@@H]2CN(C(=O)C3(C(C)(C)C)CCCCC3)CC[C@H]2C)c1
|
CcccccC=O)N[C@@H]CNC=O)CCC)C)C))CCCCC6)))))))CC[C@H]6C)))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][C][C][C][C][Ring1][#Branch2][C][C][C@H1][Ring2][Ring1][C][C][=C][Ring2][Ring1][N]
|
[C@@H]16CN5CC[C@H]1C.Cc1cccc8c1.C179CCCCC1.C9(C)(C)C.C48=O.C57=O.N46
|
C[C@H](C(=O)N[C@@H](CNC(=O)[C@@H]1OCC1(C)C)C1CCCCC1)c1cccc(F)c1
|
C[C@H]C=O)N[C@@H]CNC=O)[C@@H]OCC4C)C))))))))CCCCCC6)))))))))cccccF)c6
|
[C][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][O][C][C][Ring1][Ring2][Branch1][C][C][C][C][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
c18cccc(F)c1.[C@@H]16OCC1(C)C.C17CCCCC1.C[C@@H]8C2=O.[C@@H]47C5.C36=O.N24.N35
|
O=C(O)c1cccc(CNC(=O)N2CCN(Cc3cccc(F)c3)CC2)c1
|
O=CO)cccccCNC=O)NCCNCcccccF)c6)))))))CC6)))))))))c6
|
[O][=C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring1][=N][C][N][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][=C][=C][Ring2][Ring1][Branch2]
|
c18cccc9c1.N15CCN7CC1.c1%10cccc(F)c1.O=C8O.C45=O.C69.N46.C7%10
|
C=CCC(=O)NC(CO)CNC(=O)Cc1cc(Cl)ccc1O
|
C=CCC=O)NCCO))CNC=O)CcccCl)ccc6O
|
[C][=C][C][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O]
|
c16cc(Cl)ccc1O.C=CCC2=O.C4(C5)CO.C3(=O)C6.N24.N35
|
CCSC[C@H](NC(=O)C(=O)C(C)C)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]2C1
|
CCSC[C@H]NC=O)C=O)CC)C)))))C=O)NC[C@H]C[C@@H]O)C[C@H]5C8
|
[C][C][S][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][Ring1][=Branch2]
|
N14C[C@H]2C[C@@H](O)C[C@H]2C1.C3(=O)C(=O)C(C)C.C7[C@H]5C4=O.CC6.S67.N35
|
Cn1cncc1C(=O)N(CCNC(=O)COC1(C)CCC1)C1CCCC1
|
Cncncc5C=O)NCCNC=O)COCC)CCC4))))))))))CCCCC5
|
[C][N][C][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][Ring1][Branch1][C][C][C][C][C][Ring1][Branch1]
|
Cn1cncc19.C15(C)CCC1.C18CCCC1.C3(=O)C4.C29=O.N268.C6C7.N37.O45
|
CNS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H](CNC(=O)[C@@H]2C[C@@H]2C)C2CC2)c1
|
CNS=O)=O)ccccC)cC=O)N[C@@H]CNC=O)[C@@H]C[C@@H]3C)))))))CCC3))))))c6
|
[C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][=Branch1]
|
S7(=O)(=O)c1ccc(C)c9c1.[C@@H]5%10C6.[C@@H]18C[C@@H]1C.C39=O.C48=O.C1%10CC1.CN7.N35.N46
|
CO[C@H](C)[C@@H](CC(=O)N[C@@H]1CCCN(O)C1=O)NC(=O)[C@H](C)c1ccsc1
|
CO[C@H]C)[C@@H]CC=O)N[C@@H]CCCNO)C6=O))))))))))NC=O)[C@H]C)cccsc5
|
[C][O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch1][C][O][C][Ring1][#Branch1][=O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=C][S][C][=Ring1][Branch1]
|
[C@@H]4(C)[C@H]5CC2=O.[C@@H]16CCCN(O)C1=O.C3(=O)[C@@H]7C.c17ccsc1.CO4.N26.N35
|
O=C(NCC(=O)N1CC=C[C@@H](NC(=O)C23COC(CF)(C2)C3)C1)C1CCCCC1
|
O=CNCC=O)NCC=C[C@@H]NC=O)CCOCCF))C5)C5)))))))C6)))))))))CCCCCC6
|
[O][=C][Branch2][Ring2][#Branch1][N][C][C][=Branch1][C][=O][N][C][C][=C][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][O][C][Branch1][Ring1][C][F][Branch1][Ring2][C][Ring1][#Branch1][C][Ring1][Branch2][C][Ring1][P][C][C][C][C][C][C][Ring1][=Branch1]
|
N15CC=C[C@@H]8C1.C12%10COC%11(C1)C2.C19CCCCC1.C7C5=O.O=C49.C6%10=O.N47.N68.C%11F
|
CC(C)c1ccc(N(C(=O)[C@@H](F)Cl)[C@H]2C[C@H]3CN[C@H]2C3)cc1
|
CCC)ccccNC=O)[C@@H]F)Cl)))[C@H]C[C@H]CN[C@H]6C5))))))))cc6
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][Branch2][N][Branch1][#Branch2][C][=Branch1][C][=O][C@@H1][Branch1][C][F][Cl][C@H1][C][C@H1][C][N][C@H1][Ring1][=Branch1][C][Ring1][Branch1][C][=C][Ring2][Ring1][Ring1]
|
c17ccc5cc1.[C@H]16C[C@H]2CN[C@H]1C2.C4(=O)[C@@H](F)Cl.CC7C.N456
|
CN1CC[C@H](CCNC(=O)[C@@H]2CN(C(=O)c3ccsc3)CC23CC3)C1=O
|
CNCC[C@H]CCNC=O)[C@@H]CNC=O)cccsc5))))))CC5CC3)))))))))))C5=O
|
[C][N][C][C][C@H1][Branch2][Ring1][S][C][C][N][C][=Branch1][C][=O][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][C][Ring1][N][C][C][Ring1][Ring1][C][Ring2][Ring1][Branch2][=O]
|
[C@@H]17CN5CC12CC2.CN1CC[C@H]9C1=O.c18ccsc1.C9C6.C47=O.C58=O.N46
|
CN(CCc1cn(-c2ncccn2)nn1)C(=O)c1c[nH]c2cc(C(=O)O)ccc12
|
CNCCccn-cncccn6))))))nn5)))))))C=O)cc[nH]cccC=O)O))ccc96
|
[C][N][Branch2][Ring1][Ring2][C][C][C][=C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][N][=N][Ring1][O][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=C][Ring1][N][Ring1][=Branch2]
|
c15c[nH]c2cc6ccc12.c17cn8nn1.c18ncccn1.CN34.C4C7.C35=O.C6(=O)O
|
CCCN(CC(=O)N1CCC2(CC1)CC2)C(=O)CNC(=O)[C@H](C)CC
|
CCCNCC=O)NCCCCC6))CC3))))))))C=O)CNC=O)[C@H]C)CC
|
[C][C][C][N][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C]
|
N13CCC2(CC1)CC2.C5(=O)[C@H](C)CC.C7C3=O.C4(=O)C8.CCC6.N467.N58
|
CCOCCN=C(NCc1cccc(OC(F)(F)F)c1)N1C[C@@H]2[C@@H](CF)[C@@H]2C1
|
CCOCCN=CNCcccccOCF)F)F)))c6))))))))NC[C@@H][C@@H]CF))[C@@H]3C6
|
[C][C][O][C][C][N][=C][Branch2][Ring1][=Branch1][N][C][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][N][C][C@@H1][C@@H1][Branch1][Ring1][C][F][C@@H1][Ring1][Branch1][C][Ring1][Branch2]
|
C4CN=C(N6)N1C[C@@H]2[C@@H]7[C@@H]2C1.c18cccc5c1.O5C(F)(F)F.CC3.O34.C68.C7F
|
COCc1ccsc1C(=O)NC[C@@H]1C[C@H](C)N(C(=O)C23CCC(C2)C3)C1
|
COCcccsc5C=O)NC[C@@H]C[C@H]C)NC=O)CCCCC5)C5))))))C5
|
[C][O][C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][=C]
|
[C@@H]1%10C[C@H](C)N5C1.c1%11ccsc18.C129CCC(C1)C2.C48=O.C59=O.CO6.C6%11.N47.C7%10
|
O=C(CC=C(Cl)Cl)N[C@@H]1CCC[C@H]2CN(C(=O)c3cc4c[nH]cnc-4n3)C[C@@H]21
|
O=CCC=CCl)Cl))))N[C@@H]CCC[C@H]CNC=O)cccc[nH]cnc-6n9))))))))))C[C@@H]59
|
[O][=C][Branch1][Branch2][C][C][=C][Branch1][C][Cl][Cl][N][C@@H1][C][C][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][NH1][C][=N][C][Ring1][=Branch1][=N][Ring1][=Branch2][C][C@@H1][Ring1][S][Ring2][Ring1][Ring2]
|
[C@@H]17CCC[C@H]2CN6C[C@@H]21.c18cc2c[nH]cnc-2n1.O=C5CC=C(Cl)Cl.C68=O.N57
|
CON(CCC(=O)NC(C)(C)c1ccn(C)n1)C(=O)C=Cc1nccs1
|
CONCCC=O)NCC)C)cccnC)n5))))))))))C=O)C=Ccnccs5
|
[C][O][N][Branch2][Ring1][=Branch2][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=N][C][=C][S][Ring1][Branch1]
|
CON(CCC2=O)C(=O)C=4.c15ccn(C)n1.C=4c1nccs1.C35(C)C.N23
|
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.