SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1C[C@@H](C(=O)N2Cc3nncn3[C@H](C)C2)C1
|
CCC)[C@@H]OCC[C@@H]5C=O)NC[C@H]C[C@@H]C=O)NCcnncn5[C@H]C)C9))))))))))C4
|
[C][C][Branch1][C][C][C@@H1][O][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=N][N][=C][N][Ring1][Branch1][C@H1][Branch1][C][C][C][Ring1][#Branch2][C][Ring1][S]
|
N15Cc2nncn2[C@H](C)C1.[C@@H]19OCC[C@@H]17.[C@H]1%10C[C@@H]8C1.CC9C.C47=O.C58=O.N46.C6%10
|
Cc1ncoc1C(=O)N1CCC(CN(C)C(=O)c2c[nH]ccc2=O)CC1
|
Ccncoc5C=O)NCCCCNC)C=O)cc[nH]ccc6=O))))))))))CC6
|
[C][C][N][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][Ring1][=Branch1][=O][C][C][Ring2][Ring1][C]
|
N13CCC8CC1.c17c[nH]ccc1=O.Cc1ncoc16.C36=O.N45C.C47=O.C58
|
Cn1nc(C(=O)N[C@H]2CCC[C@H]2NC(=O)[C@H]2CCc3nn[nH]c3C2)cc1Cl
|
CnncC=O)N[C@H]CCC[C@H]5NC=O)[C@H]CCcnn[nH]c5C9))))))))))))))))))cc5Cl
|
[C][N][N][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][C][C][C][N][=N][NH1][C][=Ring1][Branch1][C][Ring1][=Branch2][C][=C][Ring2][Ring1][=Branch2][Cl]
|
[C@H]19CCc2nn[nH]c2C1.Cn1nc8cc1Cl.[C@H]16CCC[C@H]17.C48=O.C59=O.N46.N57
|
CCCCC[C@H](O)C(=O)N1CC2(CN(C(=O)CSCCC)C[C@@H]2CO)C1
|
CCCCC[C@H]O)C=O)NCCCNC=O)CSCCC))))))C[C@@H]5CO))))))C4
|
[C][C][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][S][C][C][C][C][C@@H1][Ring1][N][C][O][C][Ring1][P]
|
N13CC2(C1)CN4C[C@@H]27.CCCCC[C@H](O)C3=O.C4(=O)C5.C6CC.S56.C7O
|
CC1(C)CC(C(=O)N2CC=C(C(=O)N[C@@]34C[C@@H]3COC4(C)C)CC2)=NO1
|
CCC)CCC=O)NCC=CC=O)N[C@@]C[C@@H]3COC6C)C)))))))))CC6)))))))=NO5
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@][C][C@@H1][Ring1][Ring1][C][O][C][Ring1][=Branch1][Branch1][C][C][C][C][C][Ring1][P][=N][O][Ring2][Ring1][=Branch2]
|
CC1(C)CC(C5=O)=NO1.N15CC=C(C6=O)CC1.[C@@]127C[C@@H]1COC2(C)C.N67
|
COC(=O)[C@H](C)CC(=O)NCc1nc(C(=O)NC2(CO)CCCCCC2)co1
|
COC=O)[C@H]C)CC=O)NCcncC=O)NCCO))CCCCCC7)))))))))co5
|
[C][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=N][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][O][C][C][C][C][C][C][Ring1][=Branch2][=C][O][Ring1][P]
|
C3(=O)[C@H](C)CC4=O.C17%10CCCCCC1.c19nc8co1.C58=O.CO3.N46.C69.N57.C%10O
|
CC1(C)CC[C@@H]1C(=O)N1CC[C@H](C2CCN(C(=O)C=C[C@@H]3CCOC3)CC2)C1
|
CCC)CC[C@@H]4C=O)NCC[C@H]CCCNC=O)C=C[C@@H]CCOC5))))))))CC6))))))C5
|
[C][C][Branch1][C][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Branch2][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C@@H1][C][C][O][C][Ring1][Branch1][C][C][Ring1][#C][C][Ring2][Ring1][Ring2]
|
N14CC[C@H](C2CCN5CC2)C1.CC1(C)CC[C@@H]16.C=7[C@@H]1CCOC1.C5(=O)C=7.C46=O
|
COC[C@](C)(OC)C(=O)N[C@H]1CC[C@H](CN(C)C(=O)c2cn3ccnc3s2)CC1
|
COC[C@]C)OC))C=O)N[C@H]CC[C@H]CNC)C=O)ccnccnc5s8)))))))))))CC6
|
[C][O][C][C@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][C][=C][N][=C][Ring1][Branch1][S][Ring1][Branch2][C][C][Ring2][Ring1][Ring1]
|
c1%10cn2ccnc2s1.C6[C@@]7(C)C4=O.[C@H]19CC[C@H]%11CC1.N58C.C5%10=O.CO6.O7C.N49.C8%11
|
COCC[C@@]1(NC(=O)C2=C(C)S(=O)(=O)CC2)CCN(C(=O)C2=CCCCCC2)C1
|
COCC[C@@]NC=O)C=CC)S=O)=O)CC5)))))))CCNC=O)C=CCCCCC7))))))))C5
|
[C][O][C][C][C@@][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][Branch2][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][=Branch2]
|
C3(=O)C1=C(C)S(=O)(=O)CC1.C4(=O)C1=CCCCCC1.[C@@]167CCN4C1.C5C7.CO5.N36
|
CC(C)(C)OC(=O)N1CC(C(=O)NCCCCNC(=O)CN2CC(=O)NC2=O)C1
|
CCC)C)OC=O)NCCC=O)NCCCCNC=O)CNCC=O)NC5=O)))))))))))))))C4
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C][C][N][C][=Branch1][C][=O][C][N][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][Ring2][Ring1][=Branch1]
|
N1%11CC(=O)NC1=O.N14CC%10C1.C8CCC9.CC7(C)C.C6(=O)C%11.C34=O.C5%10=O.O37.N58.N69
|
Cc1cnn(C)c1CC(=O)N[C@H](C)C[C@H](C)NC(=O)/C=C/C(F)(F)F
|
CccnnC)c5CC=O)N[C@H]C)C[C@H]C)NC=O)/C=C/CF)F)F
|
[C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][/C][=C][/C][Branch1][C][F][Branch1][C][F][F]
|
Cc1cnn(C)c17.[C@@H]4(C)C[C@@H]5C.C=6C(F)(F)F.C7C2=O.C3(=O)C=6.N24.N35
|
C[C@@]1(CNC(=O)CCc2cc[nH]n2)CCN(C(=O)c2ccc3c(c2)CCCO3)C1
|
C[C@@]CNC=O)CCccc[nH]n5))))))))))CCNC=O)cccccc6)CCCO6))))))))))C5
|
[C][C@@][Branch1][S][C][N][C][=Branch1][C][=O][C][C][C][C][=C][NH1][N][=Ring1][Branch1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][N]
|
c17ccc2c(c1)CCCO2.C[C@@]19CCN5C1.C4(=O)CC8.c18cc[nH]n1.C57=O.C69.N46
|
CCC[C@H](OC)C(=O)N1CCCO[C@@H](CNC(=O)Cc2cccc(F)c2O)C1
|
CCC[C@H]OC))C=O)NCCCO[C@@H]CNC=O)CcccccF)c6O)))))))))))C7
|
[C][C][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][O][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][O][C][Ring2][Ring1][Ring2]
|
N13CCCO[C@@H]7C1.c18cccc(F)c1O.CCC[C@H]5C3=O.C4(=O)C8.O5C.C67.N46
|
CC[C@@H](C)[C@H](O)C(=O)NC[C@@H]1CCCN1C(=O)c1cccc(NC(N)=O)c1
|
CC[C@@H]C)[C@H]O)C=O)NC[C@@H]CCCN5C=O)cccccNCN)=O)))c6
|
[C][C][C@@H1][Branch1][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#Branch1][N][C][Branch1][C][N][=O][=C][Ring1][#Branch2]
|
CC[C@@H](C)[C@H](O)C2=O.c17cccc6c1.[C@@H]18CCCN13.C37=O.C4(N)=O.N25.C58.N46
|
C=CCC1(C(=O)N2CC=C[C@@H](NC(=O)[C@@H](C)CCOc3ccccc3)C2)CC1
|
C=CCCC=O)NCC=C[C@@H]NC=O)[C@@H]C)CCOcccccc6))))))))))))C6)))))))CC3
|
[C][=C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][=C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][=Branch2]
|
N14CC=C[C@@H]8C1.C5(=O)[C@@H](C)CC6.c17ccccc1.C19%10CC1.C=CC%10.C49=O.N58.O67
|
Cc1cccc(/C=C/C(=O)N[C@@H](C(=O)N2CCC(CO)CC2)c2ccccc2)c1
|
Cccccc/C=C/C=O)N[C@@H]C=O)NCCCCO))CC6)))))))cccccc6)))))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Ring1][/C][=C][/C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][O][C][C][Ring1][Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][N]
|
Cc1cccc(C=6)c1.N14CCC7CC1.c18ccccc1.[C@@H]58C4=O.C=6C3=O.N35.C7O
|
Cn1nnc(Br)c1C(=O)N1CCC(C)(CNC(=O)C2[C@H]3COC[C@H]23)CC1
|
CnnncBr)c5C=O)NCCCC)CNC=O)C[C@H]COC[C@H]65)))))))))CC6
|
[C][N][N][=N][C][Branch1][C][Br][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C@H1][C][O][C][C@H1][Ring1][=Branch1][Ring1][Branch1][C][C][Ring1][P]
|
N14CCC9(C)CC1.Cn1nnc(Br)c17.C18[C@H]2COC[C@H]12.C47=O.C58=O.C69.N56
|
CCC1(C(=O)N2CCN(C(=O)c3cc(SC)ccc3O)C3(CC3)C2)CC1
|
CCCC=O)NCCNC=O)cccSC))ccc6O))))))))CCC3))C6)))))))CC3
|
[C][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][S][C][=C][C][=C][Ring1][Branch2][O][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][Branch2]
|
N14CCN5C2(CC2)C1.c17cc9ccc1O.C168CC1.C46=O.C57=O.CC8.S9C
|
Cc1cccnc1CN1CC[C@@]2(CCN(C(=O)c3occ4c3CCOC4)C2)C1
|
Cccccnc6CNCC[C@@]CCNC=O)coccc5CCOC6))))))))))C5))))C5
|
[C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][N][C][C][C@@][Branch2][Ring1][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][C][O][C][Ring1][=Branch1][C][Ring1][S][C][Ring2][Ring1][Ring2]
|
N16CC[C@@]2(CCN5C2)C1.c17occ2c1CCOC2.Cc1cccnc18.C57=O.C68
|
C[C@H](CC1CN(C(=O)c2ccc(Cl)cc2Cl)C1)NC(=O)COCCCF
|
C[C@H]CCCNC=O)ccccCl)cc6Cl))))))))C4)))))NC=O)COCCCF
|
[C][C@H1][Branch2][Ring1][#Branch2][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][Ring1][=C][N][C][=Branch1][C][=O][C][O][C][C][C][F]
|
c18ccc(Cl)cc1Cl.C19CN3C1.C[C@@H]7C9.C4(=O)C5.C6CCF.C38=O.N47.O56
|
C[C@H](CCN(C)C(=O)[C@@H](C)n1cncn1)NC(=O)C(F)(F)C1CCCC1
|
C[C@H]CCNC)C=O)[C@@H]C)ncncn5))))))))))NC=O)CF)F)CCCCC5
|
[C][C@H1][Branch2][Ring1][=Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][=N][C][=N][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][C][C][C][C][Ring1][Branch1]
|
C3(=O)C7(F)F.C[C@@H]4CC5.C2(=O)[C@H]6C.n16cncn1.C17CCCC1.N25C.N34
|
COc1cc(C(=O)NC[C@@H]2CC[C@H]2NC(=O)c2cc(C)c(C)c(C)c2)ccn1
|
COcccC=O)NC[C@@H]CC[C@H]4NC=O)cccC)cC)cC)c6)))))))))))))))ccn6
|
[C][O][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][=Branch2][=C][C][=N][Ring2][Ring1][#Branch2]
|
c19cc(C)c(C)c(C)c1.c15cc8ccn1.[C@@H]1%10CC[C@H]17.C38=O.C49=O.CO5.N36.C6%10.N47
|
CCN(CCNC(=O)c1ccnc2c1nnn2C)Cc1ncc(Cl)n1C
|
CCNCCNC=O)cccncc6nnn5C))))))))))))))CcnccCl)n5C
|
[C][C][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][N][=N][N][Ring1][Branch1][C][C][C][=N][C][=C][Branch1][C][Cl][N][Ring1][=Branch1][C]
|
c18ccnc2c1nnn2C.c19ncc(Cl)n1C.N457.C5C6.C38=O.CC4.N36.C79
|
Cn1cc(N)c(C(=O)NC[C@@]2(CNC(=O)CNC=O)CC23CCC3)n1
|
CnccN)cC=O)NC[C@@]CNC=O)CNC=O)))))))CC3CCC4)))))))))n5
|
[C][N][C][=C][Branch1][C][N][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@@][Branch1][O][C][N][C][=Branch1][C][=O][C][N][C][=O][C][C][Ring1][O][C][C][C][Ring1][Ring2][=N][Ring2][Ring1][Branch2]
|
Cn1cc(N)c9n1.[C@]1%10%11CC12CCC2.C5(=O)C8.C49=O.N8C=O.N46.C6%10.C7%11.N57
|
COc1ccccc1O[C@H](C)C(=O)N1C[C@H](C)[C@H](NC(=O)c2cccc(C)c2)C1
|
COcccccc6O[C@H]C)C=O)NC[C@H]C)[C@H]NC=O)cccccC)c6))))))))C5
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Ring1][S]
|
c16ccccc17.N13C[C@@H]8[C@@H](C)C1.c19cccc(C)c1.[C@@H]5(C)C3=O.C49=O.CO6.O57.N48
|
Cn1cc(C(=O)NC[C@H]2CC[C@H](NC(=O)[C@@H]3C[C@]34CCOC4)CC2)nc1C(F)F
|
CnccC=O)NC[C@H]CC[C@H]NC=O)[C@@H]C[C@]3CCOC5)))))))))CC6)))))))))nc5CF)F
|
[C][N][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C@][Ring1][Ring1][C][C][O][C][Ring1][Branch1][C][C][Ring1][S][N][=C][Ring2][Ring1][=Branch2][C][Branch1][C][F][F]
|
Cn1cc9nc1%11.[C@H]1%12CC[C@H]8CC1.[C@@H]1%10C[C@]12CCOC2.C59=O.C6%10=O.C%11(F)F.N57.C7%12.N68
|
Cc1[nH]nc2ccc(C(=O)N3C[C@@H]4CN(C(=O)C[C@@H](C)CN(C)C)CC[C@@H]43)cc12
|
Cc[nH]nccccC=O)NC[C@@H]CNC=O)C[C@@H]C)CNC)C))))))CC[C@@H]68)))))))))cc96
|
[C][C][NH1][N][=C][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][C][C][C@@H1][Ring1][#C][Ring1][P][=C][C][=Ring2][Ring1][N][Ring2][Ring1][=Branch2]
|
Cc1[nH]nc2ccc8cc12.N15C[C@@H]2CN6CC[C@@H]21.C6(=O)C[C@@H](C)C7.C58=O.N7(C)C
|
Cc1nnc(CN2CCC[C@@H](N(C)C(=O)Cc3ccc4c[nH]nc4c3)CC2)s1
|
CcnncCNCCC[C@@H]NC)C=O)Cccccc[nH]nc5c9))))))))))))CC7))))))))s5
|
[C][C][=N][N][=C][Branch2][Ring2][Branch1][C][N][C][C][C][C@@H1][Branch2][Ring1][#Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][NH1][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C][C][Ring2][Ring1][Branch1][S][Ring2][Ring1][O]
|
c19ccc2c[nH]nc2c1.N16CCC[C@@H]7CC1.Cc1nnc8s1.C5(=O)C9.N57C.C68
|
Cn1cc(C(=O)NCC2CN(C(=O)c3ccc(SC(F)(F)F)o3)C2)nc1C(F)F
|
CnccC=O)NCCCNC=O)ccccSCF)F)F)))o5))))))C4)))))))nc5CF)F
|
[C][N][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][S][C][Branch1][C][F][Branch1][C][F][F][O][Ring1][#Branch2][C][Ring1][S][N][=C][Ring2][Ring1][=Branch2][C][Branch1][C][F][F]
|
Cn1cc7nc19.c18ccc%11o1.C1%10CN5C1.S%11C(F)(F)F.C47=O.C58=O.C9(F)F.N46.C6%10
|
O=C(CCC(=O)C1CC1)N[C@H]1CCCCC[C@H]1C(=O)NCc1nc(C2CC2)no1
|
O=CCCC=O)CCC3))))))N[C@H]CCCCC[C@H]7C=O)NCcncCCC3)))no5
|
[O][=C][Branch1][N][C][C][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][N][C@H1][C][C][C][C][C][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2]
|
[C@H]16CCCCC[C@H]18.O=C3CCC7=O.c19nc%10no1.C17CC1.C48=O.C1%10CC1.N36.N45.C59
|
CCC(CC)CN(C(=O)CCCCCNC(=O)c1cc(C#N)ccc1N)C1CC1
|
CCCCC))CNC=O)CCCCCNC=O)cccC#N))ccc6N)))))))))))))))CCC3
|
[C][C][C][Branch1][Ring1][C][C][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][#N][=C][C][=C][Ring1][Branch2][N][C][C][C][Ring1][Ring1]
|
c17cc(C#N)ccc1N.C2(=O)CCCCC5.CCC(C4)CC.N246.C37=O.C16CC1.N35
|
CC(C)SCC(=O)NC1(C(=O)N2CC3(CCCC3)C[C@@H]2C)CC(F)(F)C1
|
CCC)SCC=O)NCC=O)NCCCCCC5))))C[C@@H]5C)))))))CCF)F)C4
|
[C][C][Branch1][C][C][S][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][C@@H1][Ring1][=Branch2][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][C]
|
N15CC2(CCCC2)C[C@@H]1C.C169CC(F)(F)C1.C8C4=O.CC7C.C59=O.S78.N46
|
COC(=O)CC(=O)N1CC[C@H]2[C@@H](C1)CN2C(=O)c1cc(-c2cnn(C)c2)no1
|
COC=O)CC=O)NCC[C@H][C@@H]C6)CN4C=O)ccc-ccnnC)c5)))))no5
|
[C][O][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][=N][O][Ring1][O]
|
N14CC[C@H]2[C@@H](C1)CN25.C3(=O)CC4=O.c16cc7no1.c17cnn(C)c1.C56=O.CO3
|
CCC=CC=CC(=O)N1CCN(C(=O)c2cc(Br)c3[nH]cnc3c2)C[C@@H]1CF
|
CCC=CC=CC=O)NCCNC=O)cccBr)c[nH]cnc5c9))))))))))C[C@@H]6CF
|
[C][C][C][=C][C][=C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][NH1][C][=N][C][Ring1][Branch1][=C][Ring1][#Branch2][C][C@@H1][Ring2][Ring1][C][C][F]
|
c16cc(Br)c2[nH]cnc2c1.N14CCN5C[C@@H]19.C=8C4=O.CCC=7.C=7C=8.C56=O.C9F
|
CC(C)CCOCC(=O)N[C@H]1CC[C@@H](CCN=c2[nH]nc(C(C)C)o2)C1
|
CCC)CCOCC=O)N[C@H]CC[C@@H]CCN=c[nH]ncCC)C))o5))))))))C5
|
[C][C][Branch1][C][C][C][C][O][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch2][Ring1][C][C][C][N][=C][NH1][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][O][Ring1][Branch2][C][Ring1][S]
|
C8CN=c1[nH]nc7o1.[C@H]16CC[C@@H]8C1.CC(C)CC4.C5C3=O.C7(C)C.O45.N36
|
C=C1CC(C)(C(=O)NC[C@@H](O)CN(C)C(=O)c2ccc(CC)s2)C1
|
C=CCCC)C=O)NC[C@@H]O)CNC)C=O)ccccCC))s5))))))))))))C4
|
[C][=C][C][C][Branch1][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][C][S][Ring1][#Branch1][C][Ring2][Ring1][#Branch1]
|
C=C1CC8(C)C1.c17ccc9s1.C5[C@@H](O)C6.C38=O.N46C.C47=O.N35.C9C
|
CSc1cccc(CC(=O)N(C)CC2(CNC(=O)C[C@H]3CCOC3=O)CC2)c1
|
CScccccCC=O)NC)CCCNC=O)C[C@H]CCOC5=O))))))))))CC3)))))))c6
|
[C][S][C][=C][C][=C][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C@H1][C][C][O][C][Ring1][Branch1][=O][C][C][Ring1][=C][=C][Ring2][Ring1][#Branch2]
|
c1%12cccc%11c1.[C@H]1%10CCOC1=O.C%11C4=O.C189CC1.C5(=O)C%10.N46C.CS%12.C68.C79.N57
|
C=C1CN2C(=O)CC[C@]2(C(=O)NCC[C@H](C)NC(=O)CN(C)c2ccncc2)C1
|
C=CCNC=O)CC[C@]5C=O)NCC[C@H]C)NC=O)CNC)cccncc6)))))))))))))))C8
|
[C][=C][C][N][C][=Branch1][C][=O][C][C][C@][Ring1][=Branch1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring2][Ring1][N]
|
C=C1CN2C(=O)CC[C@]29C1.c18ccncc1.C5C[C@@H]6C.C4(=O)C7.C39=O.N78C.N35.N46
|
C=CCCC(=O)N[C@@H]1CCCCC[C@H]1NC(=O)[C@@]12CCC[C@]1(C(N)=O)C2
|
C=CCCC=O)N[C@@H]CCCCC[C@H]7NC=O)[C@@]CCC[C@]5CN)=O))C6
|
[C][=C][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C][C@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@][C][C][C][C@][Ring1][Branch1][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring1][=Branch2]
|
[C@@H]15CCCCC[C@H]16.[C@@]127CCC[C@]18C2.C=CCCC3=O.C47=O.C8(N)=O.N35.N46
|
CC(C)[C@@]1(C)C[C@H]1C(=O)NCc1cccc(Cl)c1F
|
CCC)[C@@]C)C[C@H]3C=O)NCcccccCl)c6F
|
[C][C][Branch1][C][C][C@@][Branch1][C][C][C][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F]
|
c16cccc(Cl)c1F.[C@]15(C)C[C@H]14.CC5C.C24=O.N23.C36
|
CC1CC(CC(=O)N2CC3(CC(NC(=O)COc4ccccc4C(F)F)C3)C2)C1
|
CCCCCC=O)NCCCCNC=O)COcccccc6CF)F))))))))))))C4)))C4))))))C4
|
[C][C][C][C][Branch2][Ring2][=N][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][F][C][Ring2][Ring1][C][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][N]
|
N15CC2(CC9C2)C1.c18ccccc1%11.CC1CC%10C1.C%10C5=O.C6(=O)C7.C%11(F)F.N69.O78
|
CCCN=C(NCCc1sccc1C)N(C)C[C@@](C)(O)c1ccccc1
|
CCCN=CNCCcsccc5C)))))))))NC)C[C@@]C)O)cccccc6
|
[C][C][C][N][=C][Branch1][N][N][C][C][C][S][C][=C][C][=Ring1][Branch1][C][N][Branch1][C][C][C][C@@][Branch1][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CCCN=C(N2)N3C.c14sccc1C.c15ccccc1.C3[C@@]5(C)O.C2C4
|
CCC(CC)(OC)C(=O)N[C@H]1COCC[C@H]1C(=O)NCc1[nH]cnc1C
|
CCCCC))OC))C=O)N[C@H]COCC[C@H]6C=O)NCc[nH]cnc5C
|
[C][C][C][Branch1][Ring1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@H1][C][O][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][NH1][C][=N][C][=Ring1][Branch1][C]
|
CCC4(CC)C2=O.[C@H]16COCC[C@H]17.c18[nH]cnc1C.C37=O.O4C.N26.N35.C58
|
COc1cccc([C@@H](CNC(=O)c2c(C)oc(C)c2Br)OC)c1
|
COccccc[C@@H]CNC=O)ccC)ocC)c5Br)))))))))OC)))c6
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][O][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][O][C][Branch1][C][C][=C][Ring1][#Branch1][Br][O][C][=C][Ring2][Ring1][Branch1]
|
c17c(C)oc(C)c1Br.c15cccc8c1.[C@H]48C6.C37=O.CO5.N36.O4C
|
C=CCC1(NC(=O)[C@H]2CCCN2C(=O)C=CC(C)C)CC=CC1
|
C=CCCNC=O)[C@H]CCCN5C=O)C=CCC)C))))))))))))CC=CC5
|
[C][=C][C][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][C][C][C][=C][C][Ring2][Ring1][Ring2]
|
C158CC=CC1.[C@H]16CCCN14.C4(=O)C=7.C=7C(C)C.C=CC8.C36=O.N35
|
CCC[C@@H]1CN(C(=O)c2cnncc2C)CCN1C(=O)COCCOCC
|
CCC[C@@H]CNC=O)ccnncc6C))))))))CCN6C=O)COCCOCC
|
[C][C][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][N][=N][C][=C][Ring1][=Branch1][C][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][O][C][C][O][C][C]
|
[C@@H]1%10CN3CCN14.c19cnncc1C.C4(=O)C5.CCC%10.C39=O.C6C7.O56.O78.C8C
|
O=C(C[C@@H]1CCCS1(=O)=O)NC[C@@H]1CCN1C(=O)c1c[nH]nc1OCC(F)F
|
O=CC[C@@H]CCCS5=O)=O)))))))NC[C@@H]CCN4C=O)cc[nH]nc5OCCF)F
|
[O][=C][Branch1][=N][C][C@@H1][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O][N][C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][O][C][C][Branch1][C][F][F]
|
[C@@H]18CCCS1(=O)=O.c17c[nH]nc15.[C@@H]19CCN13.O=C2C8.C4C(F)F.C37=O.N26.C69.O45
|
CCCSCC(=O)N1CCN(C(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)C[C@@H]1CC(F)(F)F
|
CCCSCC=O)NCCNC=O)[C@@H]OC[C@@H]CCC[C@@H]58)))))))))C[C@@H]6CCF)F)F
|
[C][C][C][S][C][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][O][C][C@@H1][C][C][C][C@@H1][Ring1][Branch1][Ring1][Branch2][C][C@@H1][Ring1][S][C][C][Branch1][C][F][Branch1][C][F][F]
|
N14CCN5C[C@@H]19.[C@@H]18OC[C@@H]2CCC[C@@H]21.C9C(F)(F)F.C7C4=O.CCC6.C58=O.S67
|
CN(C[C@@H]1CCCCO1)c1nc(=NC2CC(C)(C)C2)[nH]c2c1COCC2
|
CNC[C@@H]CCCCO6)))))))cnc=NCCCC)C)C4)))))[nH]cc6COCC6
|
[C][N][Branch1][#Branch2][C][C@@H1][C][C][C][C][O][Ring1][=Branch1][C][=N][C][=Branch1][=C][=N][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][NH1][C][=C][Ring1][=N][C][O][C][C][Ring1][=Branch1]
|
c14nc(=NC2CC(C)(C)C2)[nH]c2c1COCC2.[C@@H]15CCCCO1.CN34.C35
|
CC(C)n1cccc1C(=O)NCC1(O)CC(CNC(=O)[C@@]23C[C@H]2COC3(C)C)C1
|
CCC)ncccc5C=O)NCCO)CCCNC=O)[C@@]C[C@H]3COC6C)C))))))))))C4
|
[C][C][Branch1][C][C][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@][C][C@H1][Ring1][Ring1][C][O][C][Ring1][=Branch1][Branch1][C][C][C][C][Ring1][P]
|
[C@@]129C[C@H]1COC2(C)C.n1%10cccc18.C1%11(O)CC%12C1.CC%10C.C48=O.C59=O.N46.C6%11.C7%12.N57
|
CN(C)C(=O)CCC(=O)N1CC[C@@H](NC(=O)[C@H](O)c2ccc(C(F)(F)F)cc2)C1
|
CNC)C=O)CCC=O)NCC[C@@H]NC=O)[C@H]O)ccccCF)F)F))cc6)))))))))C5
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][N][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring2]
|
C3(=O)CCC4=O.c17ccc8cc1.N14CC[C@@H]6C1.C5(=O)[C@@H]7O.C8(F)(F)F.CN3C.N56
|
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)N[C@H]1COc2c(Cl)cccc21
|
CNC=O)[C@@H]CCC[C@H]5NC=O)N[C@H]COccCl)cccc69
|
[C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][N][C@H1][C][O][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Ring1][#Branch2]
|
N5[C@H]1COc2c(Cl)cccc21.[C@@H]17CCC[C@H]16.C37=O.C45=O.CN3.N46
|
CCSc1cccc(CC(=O)N[C@](C)(CNC(=O)c2cnc(S)[nH]2)C(C)C)c1
|
CCScccccCC=O)N[C@]C)CNC=O)ccncS)[nH]5))))))))CC)C))))))c6
|
[C][C][S][C][=C][C][=C][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C@][Branch1][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][S][NH1][Ring1][=Branch1][C][Branch1][C][C][C][=C][Ring2][Ring1][=Branch2]
|
c1%10cccc9c1.[C@]5(C)(C6)C(C)C.c18cnc(S)[nH]1.C9C3=O.C48=O.CC7.S7%10.N35.N46
|
Cc1cc(C)c(C(=O)NC[C@@H]2CC[C@@H]2NC(=O)C2CN(C3CCC3)C2)s1
|
CcccC)cC=O)NC[C@@H]CC[C@@H]4NC=O)CCNCCCC4))))C4)))))))))))))s5
|
[C][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][Branch2][S][Ring2][Ring1][=Branch2]
|
Cc1cc(C)c9s1.[C@@H]1%11CC[C@@H]17.C1%10CN8C1.C18CCC1.C49=O.C5%10=O.N46.C6%11.N57
|
COCCN(CCNC(=O)C[C@H]1C[C@H](OC)C1(C)C)C(=O)c1n[nH]c(=N)s1
|
COCCNCCNC=O)C[C@H]C[C@H]OC))C4C)C))))))))))C=O)cn[nH]c=N)s5
|
[C][O][C][C][N][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][C@H1][C][C@H1][Branch1][Ring1][O][C][C][Ring1][=Branch1][Branch1][C][C][C][C][=Branch1][C][=O][C][=N][NH1][C][=Branch1][C][=N][S][Ring1][=Branch1]
|
[C@H]1%10C[C@H]5C1(C)C.c19n[nH]c(=N)s1.C2(=O)C%10.C4C6.N367.C7C8.C39=O.CO4.N28.O5C
|
C=C=CCC(=O)N1CCC[C@@H](C2CN(C(=O)[C@H]3CCCN(S(=O)(=O)CC)C3)C2)C1
|
C=C=CCC=O)NCCC[C@@H]CCNC=O)[C@H]CCCNS=O)=O)CC)))C6)))))))C4))))C6
|
[C][=C][=C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][P][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][O][C][Ring1][P][C][Ring2][Ring1][#Branch1]
|
N14CCC[C@@H](C2CN5C2)C1.[C@H]17CCCN6C1.C=C=CCC4=O.S6(=O)(=O)CC.C57=O
|
O=C(C=CC=C(Cl)Cl)NCCN(C(=O)C[C@@H]1CN2CCN1CC2)C1CCCC1
|
O=CC=CC=CCl)Cl)))))NCCNC=O)C[C@@H]CNCCN6CC6))))))))))CCCCC5
|
[O][=C][Branch1][=Branch2][C][=C][C][=C][Branch1][C][Cl][Cl][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C@@H1][C][N][C][C][N][Ring1][=Branch1][C][C][Ring1][=Branch1][C][C][C][C][C][Ring1][Branch1]
|
[C@@H]19CN2CCN1CC2.C=8C=C(Cl)Cl.C17CCCC1.O=C3C=8.C4(=O)C9.C5C6.N467.N35
|
CC(C)(C)NS(=O)(=O)CC(=O)NC[C@@]1(C)CC(F)(F)CN1C(=O)[C@H]1CCOC1
|
CCC)C)NS=O)=O)CC=O)NC[C@@]C)CCF)F)CN5C=O)[C@H]CCOC5
|
[C][C][Branch1][C][C][Branch1][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][N][Ring1][Branch2][C][=Branch1][C][=O][C@H1][C][C][O][C][Ring1][Branch1]
|
[C@]18(C)CC(F)(F)CN13.S6(=O)(=O)CC2=O.[C@H]17CCOC1.CC4(C)C.C37=O.N46.N25.C58
|
C#CCN(C)C(=O)C1(CNC(=O)[C@@]23CSC[C@@H]2C3)CC(C)(C)C1
|
C#CCNC)C=O)CCNC=O)[C@@]CSC[C@@H]5C6)))))))))CCC)C)C4
|
[C][#C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][P][C][N][C][=Branch1][C][=O][C@@][C][S][C][C@@H1][Ring1][Branch1][C][Ring1][=Branch1][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][S]
|
C18%10CC(C)(C)C1.[C@@]129CSC[C@@H]1C2.C#CC6.N46C.C48=O.C59=O.C7%10.N57
|
COC(=O)N[C@@H](C)C(=O)NCC(C)=CC(=O)NC1(CN(C)C)CC1
|
COC=O)N[C@@H]C)C=O)NCCC)=CC=O)NCCNC)C)))CC3
|
[C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][C][Branch1][#Branch1][C][N][Branch1][C][C][C][C][C][Ring1][#Branch1]
|
[C@H]7(C)C5=O.C8C=%11C.C=%11C6=O.C193CC1.C24=O.N%10(C)C.CO2.N47.N58.N69.C%103
|
COC[C@H](C)CNC(=O)CN(C(=O)[C@@H]1CC[C@@H]1C)C1CC(C#N)C1
|
COC[C@H]C)CNC=O)CNC=O)[C@@H]CC[C@@H]4C))))))CCCC#N))C4
|
[C][O][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Ring1][Ring2][C][C][C][C][Branch1][Ring1][C][#N][C][Ring1][=Branch1]
|
C17CC(C#N)C1.C4[C@H](C)C5.[C@@H]18CC[C@@H]1C.C2(=O)C6.N367.C38=O.CO4.N25
|
O=C(NCC1CCC(NC(=O)[C@H]2C=CCC2)CC1)C1CC2(C1)CS(=O)(=O)C2
|
O=CNCCCCCNC=O)[C@H]C=CCC5)))))))CC6))))))))CCCC4)CS=O)=O)C4
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C][C][C][C][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][=C][C][C][Ring1][Branch1][C][C][Ring1][=C][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1]
|
C17CC2(C1)CS(=O)(=O)C2.C19CCC6CC1.[C@H]18C=CCC1.O=C37.C48=O.N35.C59.N46
|
C=CCCO[C@@H](C)C(=O)N(CC(=O)NCCCc1ccccn1)CC(C)C
|
C=CCCO[C@@H]C)C=O)NCC=O)NCCCcccccn6))))))))))))CCC)C
|
[C][=C][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][Branch1][C][C][C]
|
c19ccccn1.[C@H]5(C)C2=O.C=CCC4.C6C3=O.C7CC9.C8C(C)C.N268.O45.N37
|
Cc1ncc(CC(=O)N2CCCN(C(=O)c3cc(C4CC4)ccc3F)CC2)o1
|
CcnccCC=O)NCCCNC=O)cccCCC3)))ccc6F))))))))CC7)))))))))o5
|
[C][C][=N][C][=C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][C][=C][Ring1][=Branch2][F][C][C][Ring2][Ring1][Ring1][O][Ring2][Ring1][O]
|
N15CCCN6CC1.c17cc9ccc1F.Cc1ncc8o1.C8C5=O.C67=O.C19CC1
|
Cc1csc(CCCC(=O)N2CC[C@@H](NC(=O)CCCn3ccnc3)C[C@H]2C)n1
|
CccscCCCC=O)NCC[C@@H]NC=O)CCCnccnc5))))))))))C[C@H]6C)))))))))))n5
|
[C][C][=C][S][C][Branch2][Ring2][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][C@H1][Ring1][P][C][=N][Ring2][Ring1][N]
|
N14CC[C@@H]6C[C@H]1C.Cc1csc8n1.C8CCC4=O.C5(=O)CCC7.n17ccnc1.N56
|
Cc1ccc(Br)c(C(=O)N2[C@@H]3CC[C@H]2[C@H](NC(=O)C(C)(C)N2CCCC2)C3)n1
|
CccccBr)cC=O)N[C@@H]CC[C@H]5[C@H]NC=O)CC)C)NCCCC5))))))))C6))))))))n6
|
[C][C][=C][C][=C][Branch1][C][Br][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][N][C][C][C][C][Ring1][Branch1][C][Ring1][P][=N][Ring2][Ring1][O]
|
Cc1ccc(Br)c8n1.N14[C@@H]2CC[C@H]1[C@H]7C2.C5(=O)C6(C)C.N16CCCC1.C48=O.N57
|
COCC1(C(=O)Nc2ccc(F)nc2C)CN(C(=O)C[C@@H](O)C(C)C)C1
|
COCCC=O)NccccF)nc6C)))))))))CNC=O)C[C@@H]O)CC)C)))))C4
|
[C][O][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch1]
|
c16ccc(F)nc1C.C4(=O)C[C@@H](O)C(C)C.C178CN4C1.C37=O.CO5.C58.N36
|
C[C@@H]1C[C@H](C(=O)NC[C@H](O)CNC(=O)CCc2ccncc2)[C@H](C)O1
|
C[C@@H]C[C@H]C=O)NC[C@H]O)CNC=O)CCcccncc6)))))))))))))))[C@H]C)O5
|
[C][C@@H1][C][C@H1][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C@H1][Branch1][C][C][O][Ring2][Ring1][Branch2]
|
C[C@@H]1C[C@H]7[C@H](C)O1.c18ccncc1.C5[C@H](O)C6.C4(=O)CC8.C37=O.N35.N46
|
CCCc1ccccc1OC(=O)c1cccc(C(=O)N2CCCCC2)c1
|
CCCcccccc6OC=O)cccccC=O)NCCCCC6)))))))c6
|
[C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][=C][Ring1][=C]
|
c18ccccc15.c16cccc7c1.N14CCCCC1.CCC8.C36=O.C47=O.O35
|
C#CCO[C@@H](C)C(=O)NCCN1CCN(CCc2ccc(CC)cc2)CC1
|
C#CCO[C@@H]C)C=O)NCCNCCNCCccccCC))cc6))))))))CC6
|
[C][#C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][C][C][N][Branch1][#C][C][C][C][=C][C][=C][Branch1][Ring1][C][C][C][=C][Ring1][Branch2][C][C][Ring1][S]
|
N17CCN8CC1.c19ccc%10cc1.[C@H]5(C)C3=O.C#CC4.C6C7.C8C9.O45.N36.C%10C
|
Cn1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2CN(C(=O)[C@](C)(F)CC2CCCC2)C3)n1
|
CncccC=O)N[C@@H]C[C@H]CC[C@@H]6CNC=O)[C@]C)F)CCCCCC5))))))))C7)))))))))))n5
|
[C][N][C][=C][C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][C][F][C][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][C][=N][Ring2][Ring1][N]
|
[C@@H]16C[C@H]2CC[C@@H]1CN5C2.C5(=O)[C@](C)(F)C8.Cn1ccc7n1.C18CCCC1.C47=O.N46
|
CCc1nnsc1C(=O)N1CC[C@@H]2CCN(C(=O)/C=C/CCC(C)C)C[C@@H]21
|
CCcnnsc5C=O)NCC[C@@H]CCNC=O)/C=C/CCCC)C)))))))C[C@@H]69
|
[C][C][C][N][=N][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][/C][=C][/C][C][C][Branch1][C][C][C][C][C@@H1][Ring1][#C][Ring2][Ring1][C]
|
N13CC[C@@H]2CCN4C[C@@H]21.c17nnsc15.C=6CCC(C)C.C4(=O)C=6.C35=O.CC7
|
C[C@H](Oc1ccccc1)C(=O)NCc1cn(CCNC(=O)c2coc(O)n2)nn1
|
C[C@H]Occcccc6)))))))C=O)NCccnCCNC=O)ccocO)n5)))))))))nn5
|
[C][C@H1][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=C][N][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][O][=N][Ring1][=Branch1][N][=N][Ring1][S]
|
c16ccccc1.c1%11cn%10nn1.c19coc(O)n1.C[C@H]5C3=O.C%10C8.C49=O.O56.N37.C7%11.N48
|
CC[C@@H]1[C@@H](NC(=O)C2CCCC2)CCN1C(=O)c1cncc2ncccc12
|
CC[C@@H][C@@H]NC=O)CCCCC5)))))))CCN5C=O)ccnccncccc%106
|
[C][C][C@@H1][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][C][N][Ring1][=N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1]
|
c17cncc2ncccc12.[C@@H]18[C@@H]5CCN14.C16CCCC1.C36=O.C47=O.CC8.N35
|
CCOC1CC(C(=O)N[C@H]2CN(C(=O)c3c(C)c[nH]c3CC(N)=O)CC2(C)C)C1
|
CCOCCCC=O)N[C@H]CNC=O)ccC)c[nH]c5CCN)=O)))))))))CC5C)C))))))))C4
|
[C][C][O][C][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][Branch1][C][C][=C][NH1][C][=Ring1][=Branch1][C][C][Branch1][C][N][=O][C][C][Ring1][P][Branch1][C][C][C][C][Ring2][Ring1][#Branch2]
|
[C@H]18CN5CC1(C)C.c1%10c(C)c[nH]c1%11.C17CC9C1.C%11C(N)=O.C49=O.C5%10=O.CC6.O67.N48
|
C[C@@H](CCNC(=O)c1ccc2cc[nH]c2n1)NC(=O)c1n[nH]c2ccc(F)cc12
|
C[C@@H]CCNC=O)cccccc[nH]c5n9)))))))))))))NC=O)cn[nH]ccccF)cc96
|
[C][C@@H1][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][NH1][C][Ring1][Branch1][=N][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch2][Ring1][#Branch1]
|
c18n[nH]c2ccc(F)cc12.c17ccc2cc[nH]c2n1.C[C@H]5CC6.C37=O.C48=O.N36.N45
|
CC(C)[C@H](NC(=O)N1CC[C@H](N2CCNC(=O)C2)C1)c1ncccn1
|
CCC)[C@H]NC=O)NCC[C@H]NCCNC=O)C6))))))C5)))))))cncccn6
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][N][N][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring1][N][C][=N][C][=C][C][=N][Ring1][=Branch1]
|
N16CCNC(=O)C1.N14CC[C@H]6C1.c17ncccn1.CC(C)[C@H]57.C34=O.N35
|
CC[C@H](CNC(=O)[C@@]1(CO)CCCO1)NC(=O)CCCN1CCCCC1
|
CC[C@H]CNC=O)[C@@]CO))CCCO5))))))))NC=O)CCCNCCCCC6
|
[C][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][O][C][C][C][O][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][C][N][C][C][C][C][C][Ring1][=Branch1]
|
[C@]178CCCO1.C3(=O)CCC6.N16CCCCC1.CC[C@@H]4C5.C27=O.N25.C8O.N34
|
CN(CCN(C)C(=O)c1cccc(F)c1F)C(=O)c1cc2n(n1)CCCC2
|
CNCCNC)C=O)cccccF)c6F)))))))))))C=O)cccnn5)CCCC6
|
[C][N][Branch2][Ring1][#Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][C][C][Ring1][#Branch1]
|
c17cc2n(n1)CCCC2.c18cccc(F)c1F.CN45.C5C6.N36C.C38=O.C47=O
|
O=C(N[C@H](C1CCC1)C1CC1)[C@@H](O)C1CN(C(=O)COCC2CC2)C1
|
O=CN[C@H]CCCC4))))CCC3)))))[C@@H]O)CCNC=O)COCCCC3)))))))C4
|
[O][=C][Branch1][S][N][C@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][C][C][Ring1][Ring1][C@@H1][Branch1][C][O][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][O][C][C][C][C][Ring1][Ring1][C][Ring1][N]
|
O=C3[C@H]%10O.C1%10CN4C1.C18CCC1.C4(=O)C5.[C@@H]789.C19CC1.C1%11CC1.N37.O56.C6%11
|
C[C@@]1(C(=O)Nc2cc(Cl)c(Br)c(C(F)(F)F)c2)CCN(C(=O)c2ccc(Cl)o2)C1
|
C[C@@]C=O)NcccCl)cBr)cCF)F)F))c6))))))))CCNC=O)ccccCl)o5))))))C5
|
[C][C@@][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Br][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][O][Ring1][=Branch1][C][Ring2][Ring1][N]
|
c15cc8c(Br)c(Cl)c1.C[C@@]17CCN4C1.c16ccc(Cl)o1.C8(F)(F)F.C37=O.C46=O.N35
|
C#CCN(CC(=O)NC1(CCO)CCC1)C(=O)[C@@H]1CCCS[C@H]1C
|
C#CCNCC=O)NCCCO)))CCC4)))))))C=O)[C@@H]CCCS[C@H]6C
|
[C][#C][C][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][Branch1][Ring2][C][C][O][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][S][C@H1][Ring1][=Branch1][C]
|
[C@@H]17CCCS[C@H]1C.C168CCC1.C5C2=O.C#CC4.N345.C8CO.C37=O.N26
|
C[C@]1(C(=O)N[C@@H](CNC(=O)CCc2ccc(Cl)cc2)CC(F)(F)F)COC(=O)C1
|
C[C@]C=O)N[C@@H]CNC=O)CCccccCl)cc6)))))))))))CCF)F)F))))))COC=O)C5
|
[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][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Branch1][C][F][Branch1][C][F][F][C][O][C][=Branch1][C][=O][C][Ring2][Ring1][N]
|
[C@H]5(C6)CC(F)(F)F.C[C@]17COC(=O)C1.c18ccc(Cl)cc1.C4(=O)CC8.C37=O.N35.N46
|
CC(=O)CC1(C(=O)N2CC[C@](C)(CC(=O)N[C@H](CO)c3cscn3)C2)CC1
|
CC=O)CCC=O)NCC[C@]C)CC=O)N[C@H]CO))ccscn5)))))))))C5))))))CC3
|
[C][C][=Branch1][C][=O][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][=C][S][C][=N][Ring1][Branch1][C][Ring2][Ring1][C][C][C][Ring2][Ring1][#Branch1]
|
N14CC[C@@]%10(C)C1.c18cscn1.CC(=O)C9.C179CC1.C%10C5=O.[C@H]68CO.C47=O.N56
|
CC1(C)CN(C(=O)c2c(N)cccc2Cl)C[C@H]1NC(=O)[C@@H]1CCCN1N=O
|
CCC)CNC=O)ccN)cccc6Cl))))))))C[C@H]5NC=O)[C@@H]CCCN5N=O
|
[C][C][Branch1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][Branch1][C][N][C][=C][C][=C][Ring1][#Branch1][Cl][C][C@H1][Ring1][S][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][N][=O]
|
CC1(C)CN3C[C@H]15.c17c(N)cccc1Cl.[C@@H]16CCCN1N=O.C37=O.C46=O.N45
|
CC(C)(C(=O)NC[C@]1(NC(=O)Cc2cc(C3CC3)on2)CCOC1)n1cnnn1
|
CCC)C=O)NC[C@]NC=O)CcccCCC3)))on5))))))))CCOC5))))))))ncnnn5
|
[C][C][Branch1][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][N][=Ring1][Branch2][C][C][O][C][Ring1][P][N][C][=N][N][=N][Ring1][Branch1]
|
CC8(C)C4=O.[C@]17%10CCOC1.c19cc%11on1.n18cnnn1.C5(=O)C9.C1%11CC1.N46.C6%10.N57
|
C[C@@H](CNC(=O)CC(C)(C)C)N(C)C(=O)[C@@H]1[C@H]2C[C@@H]1N(C(=O)OC(C)(C)C)C2
|
C[C@@H]CNC=O)CCC)C)C))))))NC)C=O)[C@@H][C@H]C[C@@H]4NC=O)OCC)C)C))))C5
|
[C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][N]
|
C4(=O)CC(C)(C)C.[C@@H]1%10[C@H]2C[C@@H]1N6C2.C[C@H]8C9.C7(C)(C)C.N58C.C5%10=O.C36=O.N49.O37
|
O=C(N[C@@H]1C=CCN(C(=O)c2cc3c(s2)CCCCCC3)C1)C1CC(F)(F)C1
|
O=CN[C@@H]C=CCNC=O)ccccs5)CCCCCC8)))))))))))C6)))))))CCCF)F)C4
|
[O][=C][Branch2][Ring2][Ring1][N][C@@H1][C][=C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][C][C][C][Ring1][=Branch2][C][Ring2][Ring1][Ring1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1]
|
c17cc2c(s1)CCCCCC2.[C@@H]16C=CCN5C1.C18CC(F)(F)C1.O=C48.C57=O.N46
|
Cc1ccc2oc(C(=O)NC3(CCNC(=O)[C@@H]4CCO[C@H]4C)CC3)cc2c1
|
CccccocC=O)NCCCNC=O)[C@@H]CCO[C@H]5C))))))))))CC3)))))cc5c9
|
[C][C][=C][C][=C][O][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][Branch1][S][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][O][C@H1][Ring1][Branch1][C][C][C][Ring1][=C][=C][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2]
|
Cc1ccc2oc9cc2c1.[C@@H]1%10CCO[C@H]1C.C17%11CC1.C59=O.C%11C8.C6%10=O.N57.N68
|
CC(C)[C@@](C)(O)C(=O)NCC[C@@H]1CCCN1C(=O)C(=O)c1ccc(Cl)s1
|
CCC)[C@@]C)O)C=O)NCC[C@@H]CCCN5C=O)C=O)ccccCl)s5
|
[C][C][Branch1][C][C][C@@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1]
|
CC(C)[C@@](C)(O)C2=O.[C@@H]16CCCN13.c15ccc(Cl)s1.C3(=O)C5=O.C4C6.N24
|
CSCCCC(=O)N[C@H]1CN(C(=O)C(C)(C)F)C[C@@H]1SC
|
CSCCCC=O)N[C@H]CNC=O)CC)C)F)))C[C@@H]5SC
|
[C][S][C][C][C][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][F][C][C@@H1][Ring1][O][S][C]
|
[C@H]15CN3C[C@@H]16.C4CCC2=O.C3(=O)C(C)(C)F.CS4.N25.S6C
|
O=C1N[C@@H](C(=O)N2CCC3(CN(C(=O)[C@H]4CCC(=O)N(C5CC5)C4)C3)C2)[C@H]2C[C@@H]12
|
O=CN[C@@H]C=O)NCCCCNC=O)[C@H]CCC=O)NCCC3)))C6)))))))C4)))C5))))))[C@H]C[C@@H]63
|
[O][=C][N][C@@H1][Branch2][Ring2][=C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][C][C][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][#Branch2][C][Ring1][S][C][Ring2][Ring1][Ring2][C@H1][C][C@@H1][Ring2][Ring1][N][Ring1][Ring1]
|
N16CCC2(C1)CN7C2.[C@H]19CCC(=O)N%10C1.O=C1N[C@@H]8[C@H]2C[C@@H]12.C68=O.C79=O.C1%10CC1
|
COc1cccnc1CNC(=O)CCn1cc(C(C)(C)C2CC2)nn1
|
COccccnc6CNC=O)CCnccCC)C)CCC3))))nn5
|
[C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][=N][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Ring1][N][=N][Ring1][O]
|
c14cccnc17.n16cc8nn1.C3(=O)CC6.C89(C)C.C19CC1.CO4.C57.N35
|
CCNC(=O)C(=O)N(C)C[C@@H]1CN(C(=O)c2ccn(C(C)(C)C)c2)CC12CC2
|
CCNC=O)C=O)NC)C[C@@H]CNC=O)cccnCC)C)C))c5))))))CC5CC3
|
[C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][=Branch2][C][C][Ring1][S][C][C][Ring1][Ring1]
|
[C@@H]1%10CN5CC12CC2.c18ccn9c1.C3(=O)C4=O.C9(C)(C)C.N47C.C58=O.CC6.N36.C7%10
|
CC1(CC(=O)N2CCC[C@@H]2CCC(=O)N[C@H]2CCOCC2(C)C)CC1
|
CCCC=O)NCCC[C@@H]5CCC=O)N[C@H]CCOCC6C)C))))))))))))))))))CC3
|
[C][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C][C][Ring1][=Branch1][Branch1][C][C][C][C][C][Ring2][Ring1][Branch2]
|
[C@H]15CCOCC1(C)C.N13CCC[C@@H]16.C6CC4=O.CC17CC1.C7C3=O.N45
|
CS[C@@H](C(=O)N1C[C@@H](F)C[C@H]1CNC(=O)c1nc2ccccc2cc1C)C(C)C
|
CS[C@@H]C=O)NC[C@@H]F)C[C@H]5CNC=O)cncccccc6cc%10C))))))))))))))))))))CC)C
|
[C][S][C@@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][F][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][C][C][Branch1][C][C][C]
|
c17nc2ccccc2cc1C.[C@H]6(C3=O)C(C)C.N13C[C@@H](F)C[C@H]18.C47=O.CS6.C58.N45
|
CC[C@@H]1COCC[C@]1(NC1Cc2ccccc2C1)c1nnnn1CCC1CC1
|
CC[C@@H]COCC[C@]6NCCcccccc6C9))))))))))cnnnn5CCCCC3
|
[C][C][C@@H1][C][O][C][C][C@][Ring1][=Branch1][Branch1][#C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C][C][Ring1][Ring1]
|
C14Cc2ccccc2C1.[C@@H]16COCC[C@]138.c18nnnn15.C5C7.C17CC1.CC6.N34
|
COCC[C@@H](CNC(=O)Cc1cnccn1)NC(=O)c1ccnn1CC(F)(F)F
|
COCC[C@@H]CNC=O)Cccnccn6))))))))))NC=O)cccnn5CCF)F)F
|
[C][O][C][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][=C][N][=C][C][=N][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][Branch1][C][F][Branch1][C][F][F]
|
C4C[C@H]5C6.c19cnccn1.c17ccnn18.C8C(F)(F)F.C2(=O)C9.C37=O.CO4.N26.N35
|
Cc1noc(C)c1CCNC(=O)[C@@H](NC(=O)COCC(C)(C)C)C1CCC1
|
CcnocC)c5CCNC=O)[C@@H]NC=O)COCCC)C)C)))))))CCCC4
|
[C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][C][Ring1][Ring2]
|
Cc1noc(C)c19.C2(=O)[C@@H]78.C5C(C)(C)C.C3(=O)C4.C18CCC1.C9C6.N26.N37.O45
|
CC[C@]1(C)C[C@@H]1C(=O)N1CCO[C@H](CNC(=O)[C@@H](C)OCc2ccc(C)cc2)C1
|
CC[C@]C)C[C@@H]3C=O)NCCO[C@H]CNC=O)[C@@H]C)OCccccC)cc6))))))))))))C6
|
[C][C][C@][Branch1][C][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][Ring2][Ring1][Branch1]
|
N13CCO[C@H]9C1.c1%11ccc(C)cc1.[C@@]1%10(C)C[C@@H]18.C4(=O)[C@H]5C.C38=O.CC%10.C79.N47.O56.C6%11
|
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