SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
Cc1cccc([C@H](CNC(=O)[C@]23CSC[C@H]2C3)NC(=O)CCCn2ccnc2)c1
|
Cccccc[C@H]CNC=O)[C@]CSC[C@H]5C6)))))))))NC=O)CCCnccnc5)))))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Ring1][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@][C][S][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][N][C][=C][N][=C][Ring1][Branch1][=C][Ring2][Ring1][N]
|
Cc1cccc%10c1.[C@]128CSC[C@H]1C2.C5(=O)CCC9.n19ccnc1.[C@@H]6%10C7.C48=O.N47.N56
|
COc1ccc(/C=C/C(=O)N[C@H]2C[C@@H]2CNC(=O)C#CC2(C)COC2)c(OC)c1
|
COcccc/C=C/C=O)N[C@H]C[C@@H]3CNC=O)C#CCC)COC4))))))))))))))))cOC))c6
|
[C][O][C][=C][C][=C][Branch2][Ring1][=C][/C][=C][/C][=Branch1][C][=O][N][C@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][C][O][C][Ring1][Branch1][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][O]
|
c15ccc(C=9)c6c1.C4(=O)C#CC1(C)COC1.C=9C3=O.[C@H]18C[C@@H]1%10.CO5.N38.C7%10.N47.O6C
|
CC(C)CC1(C(=O)NC[C@@H]2CCCC[C@@H]2NC(=O)[C@]2(F)CCCOC2)CC1
|
CCC)CCC=O)NC[C@@H]CCCC[C@@H]6NC=O)[C@]F)CCCOC6)))))))))))))))))CC3
|
[C][C][Branch1][C][C][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@][Branch1][C][F][C][C][C][O][C][Ring1][#Branch1][C][C][Ring2][Ring1][#Branch1]
|
[C@@H]1%10CCCC[C@@H]16.[C@@]18(F)CCCOC1.CC(C)C9.C179CC1.C37=O.C48=O.N35.C5%10.N46
|
C=CC[C@@]1(NC(=O)c2c[nH]c(C)c2)CCN(C(=O)[C@@H]2CCc3cnn(C)c3C2)C1
|
C=CC[C@@]NC=O)cc[nH]cC)c5)))))))CCNC=O)[C@@H]CCccnnC)c5C9))))))))))C5
|
[C][=C][C][C@@][Branch1][S][N][C][=Branch1][C][=O][C][=C][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][#Branch2][C][Ring2][Ring1][#Branch2]
|
[C@@H]17CCc2cnn(C)c2C1.[C@@]169CCN5C1.c18c[nH]c(C)c1.C=CC9.C48=O.C57=O.N46
|
Cc1cc(Cl)c(C(=O)NC[C@H]2CCN(C(=O)[C@H]3C[C@H](C#N)C3)CC2(F)F)s1
|
CcccCl)cC=O)NC[C@H]CCNC=O)[C@H]C[C@H]C#N))C4)))))CC6F)F))))))))))s5
|
[C][C][=C][C][Branch1][C][Cl][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C@H1][Branch1][Ring1][C][#N][C][Ring1][=Branch1][C][C][Ring1][=C][Branch1][C][F][F][S][Ring2][Ring1][#Branch2]
|
[C@H]19CCN5CC1(F)F.Cc1cc(Cl)c7s1.[C@H]18C[C@H](C#N)C1.C47=O.C58=O.N46.C69
|
CC1(C)CC[C@@H](C(=O)NC[C@@H](NC(=O)c2c[nH]nc2Br)C2CCCC2)C1
|
CCC)CC[C@@H]C=O)NC[C@@H]NC=O)cc[nH]nc5Br))))))))CCCCC5)))))))))C5
|
[C][C][Branch1][C][C][C][C][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][Br][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
CC1(C)CC[C@@H]7C1.c18c[nH]nc1Br.C19CCCC1.C5[C@@H]69.C37=O.C48=O.N35.N46
|
CC1(C)CC(C(=O)NC2CC3(CCN(C(=O)CCc4cccs4)CC3)C2)=NO1
|
CCC)CCC=O)NCCCCCNC=O)CCccccs5))))))))CC6)))))C4))))))=NO5
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C][=N][O][Ring2][Ring1][O]
|
C17CC2(CCN6CC2)C1.CC1(C)CC(C5=O)=NO1.C6(=O)CC8.c18cccs1.N57
|
COc1cccc(C(=O)N(CCNC(=O)C(F)(F)[C@H](O)C2CC2)CC2CC2)n1
|
COcccccC=O)NCCNC=O)CF)F)[C@H]O)CCC3)))))))))CCCC3))))))n6
|
[C][O][C][=C][C][=C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C@H1][Branch1][C][O][C][C][C][Ring1][Ring1][C][C][C][C][Ring1][Ring1][=N][Ring2][Ring1][#Branch2]
|
C4(=O)C(F)(F)[C@@H]%10O.c15cccc9n1.C39=O.N368.C6C7.C1%10CC1.C1%11CC1.CO5.N47.C8%11
|
Cc1cc(F)c(F)c(C(=O)N2CC[C@@H](N3CCC(C(=O)OC(C)(C)C)CC3)C2)c1
|
CcccF)cF)cC=O)NCC[C@@H]NCCCC=O)OCC)C)C))))CC6))))))C5))))))c6
|
[C][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch2][N][C][C][C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][C][Ring2][Ring1][C][=C][Ring2][Ring1][N]
|
Cc1cc9c(F)c(F)c1.N17CCC8CC1.N15CC[C@@H]7C1.C6(C)(C)C.C59=O.C48=O.O46
|
CCC[C@@H](CCCNC(=O)[C@H]1CCCSC1)NC(=O)c1c(C)nn(CC)c1C
|
CCC[C@@H]CCCNC=O)[C@H]CCCSC6)))))))))))NC=O)ccC)nnCC))c5C
|
[C][C][C][C@@H1][Branch1][P][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][S][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][N][Branch1][Ring1][C][C][C][=Ring1][Branch2][C]
|
CCC[C@H]4CCC5.c17c(C)nn8c1C.[C@H]16CCCSC1.C26=O.C37=O.N25.N34.C8C
|
Cc1nc(CN(C)C(=O)C2=CCCN(C(=O)[C@H](C)C3CCCC3)C2)n[nH]1
|
CcncCNC)C=O)C=CCCNC=O)[C@H]C)CCCCC5)))))))C6)))))))))n[nH]5
|
[C][C][=N][C][Branch2][Ring2][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][C][C][C][Ring1][Branch1][C][Ring1][#C][=N][NH1][Ring2][Ring1][=Branch2]
|
C4(=O)C1=CCCN5C1.Cc1nc7n[nH]1.C5(=O)[C@@H]8C.C18CCCC1.N46C.C67
|
CCc1nc[nH]c1C(=O)N1CCO[C@@H](CNC(=O)C(=O)CCc2ccccc2)C1
|
CCcnc[nH]c5C=O)NCCO[C@@H]CNC=O)C=O)CCcccccc6))))))))))))C6
|
[C][C][C][N][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring2]
|
N13CCO[C@@H]7C1.C4(=O)C(=O)CC9.c18nc[nH]c16.c19ccccc1.C36=O.CC8.C57.N45
|
CS[C@H](C)CCC(=O)NC[C@@H]1CCCN(c2ccc(C#N)c(C)n2)CC1
|
CS[C@H]C)CCC=O)NC[C@@H]CCCNccccC#N))cC)n6))))))CC7
|
[C][S][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Branch1][S][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][C][C][=N][Ring1][=Branch2][C][C][Ring1][S]
|
c16ccc(C#N)c(C)n1.[C@@H]17CCCN6CC1.[C@@H]5(C)CCC3=O.CS5.N34.C47
|
CC(=O)N1CSC[C@H]1C(=O)N1[C@H]2CC[C@H]1CN(C(=O)c1c(Br)ccc(F)c1F)C2
|
CC=O)NCSC[C@H]5C=O)N[C@H]CC[C@H]5CNC=O)ccBr)cccF)c6F))))))))C7
|
[C][C][=Branch1][C][=O][N][C][S][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][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][Ring2][Ring1][C]
|
N14[C@H]2CC[C@H]1CN5C2.c17c(Br)ccc(F)c1F.N13CSC[C@H]16.CC3=O.C46=O.C57=O
|
CC(=O)N(C)[C@@H](C)CN(C)C(=O)COC1CN(C(=O)C2(O)CC2)C1
|
CC=O)NC)[C@@H]C)CNC)C=O)COCCNC=O)CO)CC3))))C4
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][O][C][C][Ring1][Ring2][C][Ring1][#Branch2]
|
C17CN5C1.[C@H]8(C)C9.C4(=O)C6.C1%10(O)CC1.CC3=O.N38C.N49C.C5%10=O.O67
|
CC(=CC(C)(C)C)C(=O)N[C@](C)(CO)C(=O)N[C@H](CO)CC1CCC1
|
CC=CCC)C)C)))C=O)N[C@]C)CO))C=O)N[C@H]CO))CCCCC4
|
[C][C][=Branch1][#Branch2][=C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@][Branch1][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][C][C][C][C][Ring1][Ring2]
|
[C@]4(C)(CO)C3=O.CC=6C2=O.C=6C(C)(C)C.[C@H]5(C7)CO.C17CCC1.N24.N35
|
CCSCC1CCN(C(=O)c2cnc(O)c3c2ccn3C)CC1
|
CCSCCCCNC=O)ccncO)cc6ccn5C)))))))))))CC6
|
[C][C][S][C][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=C][N][Ring1][Branch1][C][C][C][Ring2][Ring1][Ring1]
|
c17cnc(O)c2c1ccn2C.C18CCN4CC1.C47=O.CC5.S56.C68
|
C#CCCC(=O)N(C)C[C@@H](C)CNC(=O)C[C@@H]1CC(CC)=NO1
|
C#CCCC=O)NC)C[C@@H]C)CNC=O)C[C@@H]CCCC))=NO5
|
[C][#C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][Branch1][Ring1][C][C][=N][O][Ring1][#Branch1]
|
[C@@H]16CC(CC)=NO1.C#CCCC2=O.C4[C@@H](C)C5.C3(=O)C6.N24C.N35
|
CN(C[C@@H]1CN(C(=O)c2cncn2C)CCO1)C(=O)C=Cc1ccc(Cl)nc1
|
CNC[C@@H]CNC=O)ccncn5C)))))))CCO6)))))))C=O)C=CccccCl)nc6
|
[C][N][Branch2][Ring1][Branch2][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][C][C][O][Ring1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1]
|
C=7c1ccc(Cl)nc1.[C@@H]18CN3CCO1.c16cncn1C.C4(=O)C=7.CN45.C36=O.C58
|
N=c1[nH]cncc1C(=O)N1C[C@@H]2[C@@H](CC(=O)NC(CO)(CO)CO)[C@@H]2C1
|
N=c[nH]cncc6C=O)NC[C@@H][C@@H]CC=O)NCCO))CO))CO))))))[C@@H]3C6
|
[N][=C][NH1][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C@@H1][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][O][Branch1][Ring1][C][O][C][O][C@@H1][Ring1][=C][C][Ring1][P]
|
N=c1[nH]cncc16.N13C[C@@H]2[C@@H]7[C@@H]2C1.C5(CO)(CO)CO.C7C4=O.C36=O.N45
|
Cn1ncc(C(=O)NC[C@@H]2CCCN(CC(=O)O)C2)c1-c1ccccc1
|
CnnccC=O)NC[C@@H]CCCNCC=O)O)))C6)))))))))c5-cccccc6
|
[C][N][N][=C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][Ring1][#Branch2][=C][Ring2][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
Cn1ncc6c18.[C@@H]17CCCN5C1.c18ccccc1.C5C(=O)O.C36=O.N34.C47
|
O=C(N[C@H]1CO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4n3)C2)C1)c1sccc1Cl
|
O=CN[C@H]CO[C@]CCNC=O)ccccnn[nH]c5n9))))))))))C5))))C5))))))csccc5Cl
|
[O][=C][Branch2][Ring2][#Branch1][N][C@H1][C][O][C@][Branch2][Ring1][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][N][=N][NH1][C][Ring1][Branch1][=N][Ring1][=Branch2][C][Ring1][S][C][Ring2][Ring1][Ring2][C][S][C][=C][C][=Ring1][Branch1][Cl]
|
[C@H]17CO[C@]2(CCN6C2)C1.c19ccc2nn[nH]c2n1.c18sccc1Cl.O=C58.C69=O.N57
|
C[C@H](NC(=O)c1csnn1)[C@@H]1CN(C(=O)C2(CCCF)CC2)CCO1
|
C[C@H]NC=O)ccsnn5)))))))[C@@H]CNC=O)CCCCF))))CC3))))CCO6
|
[C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][S][N][=N][Ring1][Branch1][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][Branch1][C][C][C][F][C][C][Ring1][#Branch1][C][C][O][Ring1][#C]
|
[C@@H]18CN4CCO1.c16csnn1.C179CC1.C9CCF.C[C@H]58.C36=O.C47=O.N35
|
C[C@@H](CCCNC(=O)c1ccsc1Br)NC(=O)[C@@H]1CCC2(CCC2)OC1
|
C[C@@H]CCCNC=O)cccsc5Br)))))))))))NC=O)[C@@H]CCCCCC4)))OC6
|
[C][C@@H1][Branch1][P][C][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][Br][N][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][O][C][Ring1][=Branch2]
|
[C@@H]17CCC2(CCC2)OC1.C[C@H]5CCC6.c18ccsc1Br.C38=O.C47=O.N36.N45
|
CC(C)N(C)C[C@H](C)Nc1ncccc1S(=O)(=O)NCc1csc(Cl)n1
|
CCC)NC)C[C@H]C)Ncncccc6S=O)=O)NCccscCl)n5
|
[C][C][Branch1][C][C][N][Branch1][C][C][C][C@H1][Branch1][C][C][N][C][=N][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][S][C][Branch1][C][Cl][=N][Ring1][=Branch1]
|
c17ncccc1S6(=O)=O.c18csc(Cl)n1.C3[C@@H]4C.CC2C.N23C.N47.N56.C58
|
O=C(N[C@@H]1C[C@@H]1[C@@H]1CCCN(C(=O)CN2C[C@H]3C[C@@H]3C2)C1)c1cccc(F)c1F
|
O=CN[C@@H]C[C@@H]3[C@@H]CCCNC=O)CNC[C@H]C[C@@H]3C6))))))))C6))))))))))cccccF)c6F
|
[O][=C][Branch2][Ring1][S][N][C@@H1][C][C@@H1][Ring1][Ring1][C@@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][N][C][C@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][Ring1][#C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F]
|
[C@@H]17C[C@@H]1[C@@H]1CCCN5C1.c18cccc(F)c1F.N16C[C@H]2C[C@@H]2C1.C5(=O)C6.O=C48.N47
|
C[C@@H]1CCS[C@@H]1C(=O)N(C)CC(=O)N1CCN(C(=O)C2(CF)CCOCC2)CC1
|
C[C@@H]CCS[C@@H]5C=O)NC)CC=O)NCCNC=O)CCF))CCOCC6)))))))CC6
|
[C][C@@H1][C][C][S][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][C][O][C][C][Ring1][Branch2][C][C][Ring1][S]
|
N14CCN5CC1.C189CCOCC1.C[C@@H]1CCS[C@@H]17.C6C4=O.C37=O.N36C.C58=O.C9F
|
CC1(C)CN(C(=O)[C@@H]2C[C@]23CCOC3)CC[C@H]1NC(=O)c1cc2sccc2s1
|
CCC)CNC=O)[C@@H]C[C@]3CCOC5))))))))CC[C@H]6NC=O)cccsccc5s8
|
[C][C][Branch1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C@][Ring1][Ring1][C][C][O][C][Ring1][Branch1][C][C][C@H1][Ring1][S][N][C][=Branch1][C][=O][C][=C][C][S][C][=C][C][=Ring1][Branch1][S][Ring1][Branch2]
|
CC1(C)CN4CC[C@H]16.c17cc2sccc2s1.[C@@H]18C[C@]12CCOC2.C48=O.C57=O.N56
|
CCCC(CCC)C(=O)N1C[C@@H]2C[C@H](N=c3cc(C)c(C#N)c[nH]3)[C@@H]2C1
|
CCCCCCC)))C=O)NC[C@@H]C[C@H]N=cccC)cC#N))c[nH]6)))))))[C@@H]4C7
|
[C][C][C][C][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch1][P][N][=C][C][=C][Branch1][C][C][C][Branch1][Ring1][C][#N][=C][NH1][Ring1][=Branch2][C@@H1][Ring1][=C][C][Ring1][P]
|
N14C[C@@H]2C[C@H](N=c3cc(C)c(C#N)c[nH]3)[C@@H]2C1.CCCC(CCC)C4=O
|
Cc1c[nH]c(C(=O)NC2CCC(NC(=O)c3cnn4ccncc34)CC2)c1
|
Ccc[nH]cC=O)NCCCCNC=O)ccnnccncc96)))))))))))CC6))))))))c5
|
[C][C][=C][NH1][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=N][N][C][=C][N][=C][C][=Ring1][=Branch2][Ring1][=Branch1][C][C][Ring2][Ring1][C][=C][Ring2][Ring1][#Branch2]
|
c1%10cnn2ccncc12.C17CCC8CC1.Cc1c[nH]c9c1.C59=O.C6%10=O.N57.N68
|
O=C(CCc1cncnc1)N[C@H]1COC[C@H]1NC(=O)c1cnn2ncccc12
|
O=CCCccncnc6))))))))N[C@H]COC[C@H]5NC=O)ccnnncccc96
|
[O][=C][Branch1][O][C][C][C][=C][N][=C][N][=C][Ring1][=Branch1][N][C@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][=N][N][N][=C][C][=C][C][=Ring1][=Branch2][Ring1][=Branch1]
|
c17cnn2ncccc12.c18cncnc1.[C@H]15COC[C@H]16.O=C3CC8.C47=O.N35.N46
|
CCOC(=O)C(C)(C)C(=O)N[C@@H](C)[C@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1
|
CCOC=O)CC)C)C=O)N[C@@H]C)[C@H]C)NC=O)CCcccccCl)c6)))))))CC3
|
[C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][Ring1][O]
|
C3(=O)C(C)(C)C4=O.c1%11cccc(Cl)c1.[C@H]7(C)[C@@H]8C.C19%10CC1.C59=O.CC6.O36.N47.N58.C%10%11
|
CCn1ccnc1C(=O)N1CCCC[C@H](C(=O)N[C@@H](C)CCn2cncn2)C1
|
CCnccnc5C=O)NCCCC[C@H]C=O)N[C@@H]C)CCncncn5))))))))))C7
|
[C][C][N][C][=C][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][N][C][=N][C][=N][Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
N13CCCC[C@H]7C1.n18ccnc16.[C@H]5(C)CC9.n19cncn1.C36=O.C47=O.CC8.N45
|
CC[C@H](CN(C)C(=O)c1ccc(CN2CCOCC2)o1)NC(=O)[C@@H](C)C(=O)OC
|
CC[C@H]CNC)C=O)ccccCNCCOCC6)))))))o5))))))))NC=O)[C@@H]C)C=O)OC
|
[C][C][C@H1][Branch2][Ring1][N][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][O][Ring1][N][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][O][C]
|
C5(=O)[C@@H](C)C3=O.c19ccc%10o1.N18CCOCC1.CC[C@@H]6C7.N47C.C49=O.C8%10.N56.O3C
|
Cc1ccn2ncc(C(=O)N3C[C@H](O)C[C@H]3C(=O)Nc3cnc(Br)nc3)c2c1
|
CcccnnccC=O)NC[C@H]O)C[C@H]5C=O)NccncBr)nc6))))))))))))))c5c9
|
[C][C][C][=C][N][N][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][N][=C][Branch1][C][Br][N][=C][Ring1][#Branch1][=C][Ring2][Ring1][#Branch1][C][=Ring2][Ring1][O]
|
Cc1ccn2ncc8c2c1.N14C[C@H](O)C[C@H]17.c16cnc(Br)nc1.C48=O.C57=O.N56
|
C[C@@H]1CCC[C@@H]1CC(=O)NCC(=O)NCC(=O)N1CC(O)C1
|
C[C@@H]CCC[C@@H]5CC=O)NCC=O)NCC=O)NCCO)C4
|
[C][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][Ring1][Branch1]
|
C[C@@H]1CCC[C@@H]17.N14CC(O)C1.C7C2=O.C5C3=O.C6C4=O.N25.N36
|
Cc1cocc1C(=O)NCCCCNC(=O)C1CCC2(CCCC2)CC1
|
Cccocc5C=O)NCCCCNC=O)CCCCCCCC5))))CC6
|
[C][C][=C][O][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][C][Ring1][#Branch2]
|
C17CCC2(CCCC2)CC1.Cc1cocc18.C5CCC6.C38=O.C47=O.N35.N46
|
C=C[C@H](CCC)CC(=O)N1C[C@H](C)C[C@H](CNC(=O)c2cc(C3(C)CC3)on2)C1
|
C=C[C@H]CCC)))CC=O)NC[C@H]C)C[C@H]CNC=O)cccCC)CC3)))on5))))))))C6
|
[C][=C][C@H1][Branch1][Ring2][C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][C][C][Ring1][Ring2][O][N][=Ring1][=Branch2][C][Ring2][Ring1][Ring2]
|
C=C[C@H](CCC)CC4=O.N14C[C@@H]8C[C@@H](C)C1.c17cc9on1.C19(C)CC1.C57=O.C68.N56
|
C=C1CC(C(=O)N2CC[C@](O)([C@@H](C)NC(=O)[C@H](F)CCC(C)C)C2)C1
|
C=CCCC=O)NCC[C@]O)[C@@H]C)NC=O)[C@H]F)CCCC)C))))))))C5))))))C4
|
[C][=C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][O][Branch2][Ring1][Branch1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][C][C][Branch1][C][C][C][C][Ring2][Ring1][C][C][Ring2][Ring1][Branch2]
|
C4(=O)[C@H](F)CCC(C)C.N13CC[C@@]7(O)C1.C=C1CC6C1.C36=O.[C@H]57C.N45
|
COc1ccc(CC(=O)NC[C@@H]2C[C@@H]3C[C@@H]3N2C(=O)[C@@H]2CCCCN2N=O)nc1
|
COccccCC=O)NC[C@@H]C[C@@H]C[C@@H]3N6C=O)[C@@H]CCCCN6N=O)))))))))))))))))))nc6
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][C][N][Ring1][=Branch1][N][=O][N][=C][Ring2][Ring1][O]
|
[C@@H]18CCCCN1N=O.c16ccc%10nc1.[C@@H]19C[C@@H]2C[C@@H]2N15.C%10C4=O.C58=O.CO6.N47.C79
|
C[C@H](c1ccc(C(C)(C)C)cc1)N(C)C(=O)[C@@H](C)Cc1cnc2ccccc2n1
|
C[C@H]ccccCC)C)C))cc6))))))NC)C=O)[C@@H]C)Cccncccccc6n%10
|
[C][C@H1][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=C][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2]
|
c15cnc2ccccc2n1.c16ccc7cc1.C3(=O)[C@@H](C)C5.C7(C)(C)C.C[C@@H]46.N34C
|
C[C@@H](NC(=O)CC1CCN(C(=O)[C@@]2(C)CCCS2)CC1)c1nncs1
|
C[C@@H]NC=O)CCCCNC=O)[C@@]C)CCCS5))))))CC6)))))))))cnncs5
|
[C][C@@H1][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][S][Ring1][=Branch1][C][C][Ring1][=C][C][=N][N][=C][S][Ring1][Branch1]
|
C18CCN4CC1.[C@]16(C)CCCS1.c17nncs1.C3(=O)C8.C[C@@H]57.C46=O.N35
|
Cc1cc(C)cc(OCC(=O)N2C[C@@H](N(C)C(=O)CCn3cccn3)[C@@H](F)C2)c1
|
CcccC)ccOCC=O)NC[C@@H]NC)C=O)CCncccn5)))))))))[C@@H]F)C5))))))))c6
|
[C][C][=C][C][Branch1][C][C][=C][C][Branch2][Ring2][Branch1][O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][C][=C][C][=N][Ring1][Branch1][C@@H1][Branch1][C][F][C][Ring1][P][=C][Ring2][Ring1][N]
|
Cc1cc7cc(C)c1.N14C[C@@H]8[C@@H](F)C1.C5(=O)CC9.n19cccn1.C6C4=O.N58C.O67
|
CN1CCC(C2(C(=O)N[C@@H]3C[C@H](O)CN(C(=O)CCc4nc[nH]n4)C3)CC2)CC1
|
CNCCCCC=O)N[C@@H]C[C@H]O)CNC=O)CCcnc[nH]n5))))))))C6))))))))CC3)))CC6
|
[C][N][C][C][C][Branch2][Ring2][=Branch2][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][C][O][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][N][=C][NH1][N][=Ring1][Branch1][C][Ring1][S][C][C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][N]
|
CN1CCC(C28CC2)CC1.[C@@H]17C[C@H](O)CN6C1.C6(=O)CC9.c19nc[nH]n1.C58=O.N57
|
CCCC1(C(=O)NCCC(C)(C)CNC(=O)c2ccc3n[nH]cc3n2)CCC1
|
CCCCC=O)NCCCC)C)CNC=O)ccccn[nH]cc5n9)))))))))))))))))CCC4
|
[C][C][C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=N][NH1][C][=C][Ring1][Branch1][N][=Ring1][=Branch2][C][C][C][Ring2][Ring1][=Branch2]
|
c18ccc2n[nH]cc2n1.C6CC(C)(C)C7.C19%10CCC1.CCC%10.C49=O.C58=O.N46.N57
|
COc1ccc(CC(=O)NCC2=CCN(C(=O)[C@@H]3C4CCN3CC4)CC2)cn1
|
COccccCC=O)NCC=CCNC=O)[C@@H]CCCN5CC6))))))))CC6))))))))))cn6
|
[C][O][C][=C][C][=C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][=C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][#C][C][=N][Ring2][Ring1][#Branch2]
|
C8C1=CCN6CC1.c17ccc%10cn1.[C@@H]19C2CCN1CC2.C%10C5=O.C69=O.CO7.N58
|
CN(C[C@H](O)C(C)(C)C)C(=O)[C@H](C1CC1)N(C)C(=O)[C@@H]1[C@@H]2CC[C@H](F)[C@@H]21
|
CNC[C@H]O)CC)C)C))))C=O)[C@H]CCC3)))NC)C=O)[C@@H][C@@H]CC[C@H]F)[C@@H]56
|
[C][N][Branch1][=C][C][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C@@H1][C][C][C@H1][Branch1][C][F][C@@H1][Ring1][=Branch1][Ring1][#Branch1]
|
C5[C@H](O)C(C)(C)C.[C@@H]17[C@@H]2CC[C@H](F)[C@H]12.C3(=O)[C@@H]68.CN35.C18CC1.N46C.C47=O
|
CC[C@H](CCOC)C(=O)N[C@@H]1CCN(C(=O)C#C[C@H]2CCCOC2)[C@H](C)C1
|
CC[C@H]CCOC))))C=O)N[C@@H]CCNC=O)C#C[C@H]CCCOC6)))))))))[C@H]C)C6
|
[C][C][C@H1][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][#C][C@H1][C][C][C][O][C][Ring1][=Branch1][C@H1][Branch1][C][C][C][Ring1][P]
|
C4(=O)C#C[C@H]1CCCOC1.CC[C@H](CC5)C3=O.[C@@H]16CCN4[C@H](C)C1.O5C.N36
|
O=C([C@H]1CC2(CC2)CN1Cc1ccc([N+](=O)[O-])cc1O)N1CCC[C@H](Br)C1
|
O=C[C@H]CCCC3))CN5Ccccc[N+]=O)[O-]))cc6O)))))))))))))NCCC[C@H]Br)C6
|
[O][=C][Branch2][Ring1][#C][C@H1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][N][Ring1][#Branch1][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][O][N][C][C][C][C@H1][Branch1][C][Br][C][Ring1][#Branch1]
|
c16ccc([N+](=O)[O-])cc1O.[C@H]15CC2(CC2)CN14.N13CCC[C@H](Br)C1.O=C35.C46
|
COc1ccc(F)c(C(=O)N[C@H]2CCN(C(=O)c3ccnn3C)[C@@H](C)C2)n1
|
COccccF)cC=O)N[C@H]CCNC=O)cccnn5C)))))))[C@@H]C)C6))))))))n6
|
[C][O][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C@@H1][Branch1][C][C][C][Ring1][#C][=N][Ring2][Ring1][=Branch2]
|
c16ccc(F)c8n1.[C@H]17CCN5[C@@H](C)C1.c19ccnn1C.C48=O.C59=O.CO6.N47
|
O=C(N1C[C@@H]2C[C@H](N=c3c(Br)c[nH]cc3[N+](=O)[O-])[C@@H]2C1)C1(F)CC2(CCC2)C1
|
O=CNC[C@@H]C[C@H]N=ccBr)c[nH]cc6[N+]=O)[O-])))))))))[C@@H]4C7)))))))CF)CCCCC4)))C4
|
[O][=C][Branch2][Ring1][P][N][C][C@@H1][C][C@H1][Branch2][Ring1][C][N][=C][C][Branch1][C][Br][=C][NH1][C][=C][Ring1][#Branch1][N+1][=Branch1][C][=O][O-1][C@@H1][Ring1][#C][C][Ring2][Ring1][C][C][Branch1][C][F][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][Branch2]
|
N14C[C@@H]2C[C@H](N=c3c(Br)c[nH]cc3[N+](=O)[O-])[C@@H]2C1.C15(F)CC2(CCC2)C1.O=C45
|
C[C@@H](CNC(=O)CN(C)C)C1CCN(C(=O)[C@H]2CCC[C@@H](C(C)(C)C)C2)CC1
|
C[C@@H]CNC=O)CNC)C))))))CCCNC=O)[C@H]CCC[C@@H]CC)C)C))C6)))))))CC6
|
[C][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#Branch2][C][C][Ring2][Ring1][C]
|
C18CCN4CC1.[C@H]17CCC[C@@H]9C1.C[C@H]8C5.C3(=O)C6.C9(C)(C)C.N6(C)C.C47=O.N35
|
C#CC[C@](C)(NC(=O)[C@H]1CCC1(F)F)C(=O)N[C@@H](C)c1nc(C)oc1C
|
C#CC[C@]C)NC=O)[C@H]CCC4F)F)))))))C=O)N[C@@H]C)cncC)oc5C
|
[C][#C][C][C@][Branch1][C][C][Branch1][S][N][C][=Branch1][C][=O][C@H1][C][C][C][Ring1][Ring2][Branch1][C][F][F][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][=C][Branch1][C][C][O][C][=Ring1][=Branch1][C]
|
C#CC[C@@]4(C)C3=O.c17nc(C)oc1C.[C@H]16CCC1(F)F.C26=O.[C@@H]57C.N24.N35
|
C=CC[C@]1(NC(=O)c2ccc(C)c3c2CCC3)CCCN(C(=O)[C@@H](C)N(C)C)C1
|
C=CC[C@]NC=O)ccccC)cc6CCC5)))))))))))CCCNC=O)[C@@H]C)NC)C))))C6
|
[C][=C][C][C@][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][C][C][Ring1][Branch1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][Branch1][C][C][C][C][Ring2][Ring1][#Branch2]
|
c18ccc(C)c2c1CCC2.[C@]169CCCN5C1.C5(=O)[C@H]7C.C=CC9.C48=O.N7(C)C.N46
|
C[C@@H](O)COCc1cn(CCN(C)C(=O)C2(c3c(F)cccc3F)CC2)nn1
|
C[C@@H]O)COCccnCCNC)C=O)CccF)cccc6F)))))))CC3)))))))nn5
|
[C][C@@H1][Branch1][C][O][C][O][C][C][=C][N][Branch2][Ring1][=C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][=N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][C][Ring1][O][N][=N][Ring2][Ring1][=Branch1]
|
c1%11c(F)cccc1F.c1%10cn9nn1.C[C@@H](O)C5.C18%11CC1.C9C7.N47C.C48=O.O56.C6%10
|
C[C@@H](C(=O)N[C@@H](CN=[N+]=[N-])C(=O)N1CCC[C@H](CO)CC1)n1cnnn1
|
C[C@@H]C=O)N[C@@H]CN=[N+]=[N-]))))C=O)NCCC[C@H]CO))CC7)))))))))))ncnnn5
|
[C][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch1][C][N][=N+1][=N-1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][Ring1][C][O][C][C][Ring1][=Branch2][N][C][=N][N][=N][Ring1][Branch1]
|
[C@H]4(CN=[N+]=[N-])C3=O.N13CCC[C@H]6CC1.C[C@H]5C2=O.n15cnnn1.N24.C6O
|
Cc1cn(C)cc1C(=O)NCC1(NC(=O)[C@H]2CCC[C@H]3CCCN32)CCCCC1
|
CccnC)cc5C=O)NCCNC=O)[C@H]CCC[C@H]CCCN59)))))))))))CCCCC6
|
[C][C][=C][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][C][C@H1][C][C][C][N][Ring1][Branch1][Ring1][=Branch2][C][C][C][C][C][Ring2][Ring1][C]
|
[C@H]18CCC[C@H]2CCCN21.Cc1cn(C)cc19.C17%10CCCCC1.C49=O.C58=O.N46.C6%10.N57
|
Cc1conc1C(=O)N[C@H]1CCN(C(=O)Cc2cccnc2Br)C[C@H]1O
|
Ccconc5C=O)N[C@H]CCNC=O)Cccccnc6Br)))))))))C[C@H]6O
|
[C][C][=C][O][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Br][C][C@H1][Ring1][S][O]
|
[C@H]15CCN4C[C@H]1O.c17cccnc1Br.Cc1conc16.C4(=O)C7.C36=O.N35
|
Cc1csc(C(=O)N2CCC[C@]23CCCN(C(=O)C[C@@H]2COC[C@H]2O)C3)c1Cl
|
CccscC=O)NCCC[C@]5CCCNC=O)C[C@@H]COC[C@H]5O))))))))C6)))))))))))c5Cl
|
[C][C][=C][S][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C@][Ring1][Branch1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@@H1][C][O][C][C@H1][Ring1][Branch1][O][C][Ring1][#C][=C][Ring2][Ring1][#Branch2][Cl]
|
N14CCC[C@]12CCCN5C2.Cc1csc6c1Cl.[C@@H]17COC[C@H]1O.C5(=O)C7.C46=O
|
O=C(c1cc2n(n1)CCC2)N1CC2(C[C@H]2C(=O)N2CCN3C(=O)OC[C@H]3C2)C1
|
O=Ccccnn5)CCC5)))))))NCCC[C@H]3C=O)NCCNC=O)OC[C@H]5C9))))))))))))C4
|
[O][=C][Branch1][#C][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][C][Ring1][=Branch1][N][C][C][Branch2][Ring1][=Branch2][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][O][C][C@H1][Ring1][=Branch1][C][Ring1][#Branch2][C][Ring2][Ring1][C]
|
N15CCN2C(=O)OC[C@H]2C1.c16cc2n(n1)CCC2.N14CC2(C[C@H]27)C1.O=C46.C57=O
|
C[C@H]1CO[C@H](C(=O)NC[C@H]2C[C@](F)(CNC(=O)c3ccoc3C(F)(F)F)C2)C1
|
C[C@H]CO[C@H]C=O)NC[C@H]C[C@]F)CNC=O)cccoc5CF)F)F))))))))))C4)))))))C5
|
[C][C@H1][C][O][C@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C@][Branch1][C][F][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][C][C][Ring2][Ring1][O]
|
C[C@H]1CO[C@H]8C1.[C@H]1%11C[C@@]%12(F)C1.c19ccoc1%10.C%10(F)(F)F.C48=O.C59=O.N46.C6%11.C7%12.N57
|
CCc1c[nH]cc1C(=O)N(C)C[C@H](O)CNC(=O)C1(c2ccc(C)cc2F)CC1
|
CCcc[nH]cc5C=O)NC)C[C@H]O)CNC=O)CccccC)cc6F)))))))CC3
|
[C][C][C][=C][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][Branch1][=N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][F][C][C][Ring1][O]
|
c1%10ccc(C)cc1F.c19c[nH]cc18.C5[C@H](O)C6.C17%10CC1.C38=O.N35C.C47=O.CC9.N46
|
COc1ccnc(-c2nc(CCCc3nncn3C)n(-c3ccc(F)nc3)n2)c1
|
COcccnc-cncCCCcnncn5C)))))))))n-ccccF)nc6))))))n5)))))c6
|
[C][O][C][=C][C][=N][C][Branch2][Ring2][Ring1][C][N][=C][Branch1][N][C][C][C][C][=N][N][=C][N][Ring1][Branch1][C][N][Branch1][N][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][N][=Ring2][Ring1][Branch1][=C][Ring2][Ring1][O]
|
c14ccnc8c1.c18nc5n7n1.c17ccc(F)nc1.c16nncn1C.C5CC6.CO4
|
O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)C1(C(F)(F)F)CC(F)(F)C1)[C@H]1CC12CC2
|
O=CN[C@H]C[C@H]CC[C@@H]6N5C=O)CCF)F)F))CCF)F)C4)))))))))))))[C@H]CC3CC3
|
[O][=C][Branch2][Ring2][#Branch1][N][C@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch2][C@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1]
|
[C@H]15C[C@H]2CC[C@@H]1N24.C178CC(F)(F)C1.[C@H]16CC12CC2.C8(F)(F)F.O=C36.C47=O.N35
|
CCc1ccc(C(=O)N2CCN(C(=O)C(=O)Cc3ccc(Cl)cc3)C[C@@H]2C)[nH]1
|
CCccccC=O)NCCNC=O)C=O)CccccCl)cc6)))))))))C[C@@H]6C))))))))[nH]5
|
[C][C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C@@H1][Ring2][Ring1][C][C][NH1][Ring2][Ring1][#Branch2]
|
N14CCN5C[C@@H]1C.c18ccc(Cl)cc1.c17ccc6[nH]1.C5(=O)C(=O)C8.C46=O.CC7
|
CC[C@H](CC(=O)NCC(F)F)NC(=O)c1cnsc1
|
CC[C@H]CC=O)NCCF)F))))))NC=O)ccnsc5
|
[C][C][C@H1][Branch1][=N][C][C][=Branch1][C][=O][N][C][C][Branch1][C][F][F][N][C][=Branch1][C][=O][C][C][=N][S][C][=Ring1][Branch1]
|
CC[C@@H]4CC2=O.c16cnsc1.C5C(F)F.C36=O.N25.N34
|
COCCN(CCNC(=O)[C@@]12CC[C@@](C)(C1)OC2)C(=O)C1[C@H]2CCC[C@H]12
|
COCCNCCNC=O)[C@@]CC[C@@]C)C5)OC6))))))))))C=O)C[C@H]CCC[C@H]65
|
[C][O][C][C][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C@@][C][C][C@@][Branch1][C][C][Branch1][Ring2][C][Ring1][=Branch1][O][C][Ring1][Branch2][C][=Branch1][C][=O][C][C@H1][C][C][C][C@H1][Ring1][=Branch1][Ring1][Branch1]
|
[C@@]129CC[C@@](C)(C1)OC2.C1%10[C@H]2CCC[C@H]12.C5C6.N467.C7C8.C39=O.C4%10=O.CO5.N38
|
COCCC(=O)N1CC(CCO)(NC(=O)[C@H](C)CN(C)C)C1
|
COCCC=O)NCCCCO)))NC=O)[C@H]C)CNC)C))))))C4
|
[C][O][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][C][O][Branch1][S][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][N][Branch1][C][C][C][C][Ring1][S]
|
N12CC57C1.C3(=O)[C@H](C)C6.C4CC2=O.C7CO.N6(C)C.CO4.N35
|
C=CC(C)(C)CC(=O)NC[C@H](CCCC)NC(=O)C1CC(CC2CC2)C1
|
C=CCC)C)CC=O)NC[C@H]CCCC))))NC=O)CCCCCCC3))))C4
|
[C][=C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][Branch2]
|
C=CC(C)(C)CC3=O.C5[C@@H]6CCCC.C17CC8C1.C47=O.C19CC1.N35.N46.C89
|
COCCCOCC(=O)N[C@@H]1C[C@@H](C)CN(C(=O)[C@@H]2CCCCN2C)C1
|
COCCCOCC=O)N[C@@H]C[C@@H]C)CNC=O)[C@@H]CCCCN6C))))))))C6
|
[C][O][C][C][C][O][C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Branch1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][C][Ring1][S]
|
[C@@H]18C[C@@H](C)CN4C1.[C@@H]19CCCCN1C.C5CC6.C7C3=O.C49=O.CO5.O67.N38
|
CC1(C=CC(=O)N2Cc3n[nH]cc3[C@H]2C(=O)NC2CC(CF)C2)COC1
|
CCC=CC=O)NCcn[nH]cc5[C@H]8C=O)NCCCCF))C4)))))))))))))))))COC4
|
[C][C][Branch2][Ring2][C][C][=C][C][=Branch1][C][=O][N][C][C][=N][NH1][C][=C][Ring1][Branch1][C@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][F][C][Ring1][=Branch1][C][O][C][Ring2][Ring1][=Branch2]
|
N14Cc2n[nH]cc2[C@H]1C5=O.CC1(C=7)COC1.C16CC8C1.C=7C4=O.N56.C8F
|
C[C@@H]1CCC[C@H]1C(=O)N(C)[C@H](CNC(=O)c1cccn2cnnc12)C1CC1
|
C[C@@H]CCC[C@H]5C=O)NC)[C@H]CNC=O)ccccncnnc95))))))))))))CCC3
|
[C][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][C][=N][N][=C][Ring1][=Branch2][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
c18cccn2cnnc12.C[C@@H]1CCC[C@H]17.[C@H]59C6.C37=O.N35C.C48=O.C19CC1.N46
|
CCOC(=O)NCCNC(=O)[C@@]12C[C@@H](CO1)N(C(=O)C[C@]1(C)CCOC1)C2
|
CCOC=O)NCCNC=O)[C@@]C[C@@H]CO5))NC=O)C[C@]C)CCOC5)))))))C5
|
[C][C][O][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C@@][C][C@@H1][Branch1][Branch1][C][O][Ring1][Branch1][N][Branch1][S][C][=Branch1][C][=O][C][C@][Branch1][C][C][C][C][O][C][Ring1][=Branch1][C][Ring1][S]
|
[C@@]12%10C[C@@H](CO1)N6C2.[C@@]1%11(C)CCOC1.C6(=O)C%11.C34=O.C8C9.C5%10=O.CC7.O37.N48.N59
|
CC(C)(CCNC(=O)CCNC(=O)c1ccoc1)NC(=O)[C@@H]1CCC[C@H](O)C1
|
CCC)CCNC=O)CCNC=O)cccoc5)))))))))))))NC=O)[C@@H]CCC[C@H]O)C6
|
[C][C][Branch1][C][C][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][C@H1][Branch1][C][O][C][Ring1][#Branch1]
|
[C@@H]18CCC[C@H](O)C1.CC5(C)CC6.C2(=O)CC7.c19ccoc1.C39=O.C48=O.N26.N37.N45
|
C[C@@H]1[C@@H](NC(=O)CN(C)C(N)=O)CCCN1C(=O)[C@@H](F)c1ccc(F)cc1
|
C[C@@H][C@@H]NC=O)CNC)CN)=O))))))CCCN6C=O)[C@@H]F)ccccF)cc6
|
[C][C@@H1][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][Branch1][C][N][=O][C][C][C][N][Ring1][#C][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
C[C@@H]1[C@@H]6CCCN14.c17ccc(F)cc1.C4(=O)[C@H]7F.C2(=O)C5.N35C.C3(N)=O.N26
|
COc1ccc(C(=O)N2C[C@H]3[C@H](C2)N3C(=O)c2cc3ccccc3o2)c(OC)n1
|
COccccC=O)NC[C@H][C@H]C5)N3C=O)cccccccc6o9))))))))))))))))cOC))n6
|
[C][O][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][N][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][C][Branch1][Ring1][O][C][=N][Ring2][Ring1][O]
|
c18cc2ccccc2o1.c16ccc9c7n1.N14C[C@H]2[C@H](C1)N25.C49=O.C58=O.CO6.O7C
|
C=C[C@H]1C[C@H]1C(=O)N[C@@H]1CCN(C(=O)C2=CCCOC2)[C@H]1c1ccccc1
|
C=C[C@H]C[C@H]3C=O)N[C@@H]CCNC=O)C=CCCOC6)))))))[C@H]5cccccc6
|
[C][=C][C@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][C][O][C][Ring1][=Branch1][C@H1][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C4(=O)C1=CCCOC1.[C@@H]15CCN4[C@H]17.c17ccccc1.C=C[C@H]1C[C@H]16.C36=O.N35
|
CCCOCC(=O)NC[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCC(=O)c1cccs1
|
CCCOCC=O)NC[C@@H]C[C@@H]CCCC[C@@H]6N9C=O)CCC=O)ccccs5
|
[C][C][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][Ring1][=Branch2][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1]
|
[C@@H]19C[C@@H]2CCCC[C@@H]2N14.C4(=O)CCC8=O.c18cccs1.C6C3=O.CCC5.O56.N37.C79
|
Cc1cocc1C(=O)N1CCC[C@]2(C1)CN(C(=O)[C@]1(O)CC1(C)C)CCO2
|
Cccocc5C=O)NCCC[C@]C6)CNC=O)[C@]O)CC3C)C)))))CCO6
|
[C][C][=C][O][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][Ring2][C][Ring1][=Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C@][Branch1][C][O][C][C][Ring1][Ring2][Branch1][C][C][C][C][C][O][Ring1][#C]
|
N13CCC[C@]2(C1)CN4CCO2.Cc1cocc16.[C@@]15(O)CC1(C)C.C36=O.C45=O
|
C[C@H](CCCNC(=O)c1cnn(C2CCC2)n1)NC(=O)[C@H](O)c1ccnn1C
|
C[C@H]CCCNC=O)ccnnCCCC4))))n5))))))))))NC=O)[C@H]O)cccnn5C
|
[C][C@H1][Branch2][Ring1][Branch2][C][C][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][N][=Ring1][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][C][=N][N][Ring1][Branch1][C]
|
C[C@@H]5CCC6.c17cnn9n1.c18ccnn1C.C4(=O)[C@@H]8O.C19CCC1.C37=O.N36.N45
|
CC(Cl)=CC(=O)N[C@@H](C)CCCNC(=O)c1csc2cc(C)ccc12
|
CCCl)=CC=O)N[C@@H]C)CCCNC=O)ccscccC)ccc96
|
[C][C][Branch1][C][Cl][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][S][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1]
|
c17csc2cc(C)ccc12.[C@H]5(C)CCC6.C=8C3=O.CC=8Cl.C47=O.N35.N46
|
CC(C)CN(CC(=O)NC[C@@H](C)N(C)C1CC1)C(=O)[C@@H]1CC2(CCO1)CC2
|
CCC)CNCC=O)NC[C@@H]C)NC)CCC3)))))))))C=O)[C@@H]CCCCO6)))CC3
|
[C][C][Branch1][C][C][C][N][Branch2][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch1]
|
[C@@H]1%10CC2(CCO1)CC2.CC(C)C5.C6C3=O.C7[C@H]8C.N456.N89C.C19CC1.C4%10=O.N37
|
C=CC[C@](C)(C(=O)N1CC=C(CNC(=O)C[C@@H]2CCC(F)(F)C2)CC1)N(C)C
|
C=CC[C@]C)C=O)NCC=CCNC=O)C[C@@H]CCCF)F)C5)))))))))CC6)))))))NC)C
|
[C][=C][C][C@][Branch1][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][C][Ring2][Ring1][C][N][Branch1][C][C][C]
|
C=CC[C@]5(C)C3=O.N13CC=C(C6)CC1.[C@@H]17CCC(F)(F)C1.C4(=O)C7.N5(C)C.N46
|
CC[C@](C)(C#N)C(=O)NC[C@H]1CC[C@@H](C(=O)N2C[C@H]3C[C@@H](C2)[C@H](OC)C3)O1
|
CC[C@]C)C#N))C=O)NC[C@H]CC[C@@H]C=O)NC[C@H]C[C@@H]C6)[C@H]OC))C5))))))))O5
|
[C][C][C@][Branch1][C][C][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C@H1][Branch1][Ring1][O][C][C][Ring1][Branch2][O][Ring1][P]
|
N15C[C@H]2C[C@@H](C1)[C@H]6C2.CC[C@](C)(C#N)C4=O.[C@H]19CC[C@@H]8O1.C58=O.N47.C79.O6C
|
Cc1cccnc1CCC(=O)N1CCN(C(=O)C[C@H]2CCC23CCC3)C[C@H](O)C1
|
Cccccnc6CCC=O)NCCNC=O)C[C@H]CCC4CCC4)))))))))C[C@H]O)C7
|
[C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C@H1][C][C][C][Ring1][Ring2][C][C][C][Ring1][Ring2][C][C@H1][Branch1][C][O][C][Ring2][Ring1][C]
|
N14CCN5C[C@H](O)C1.Cc1cccnc16.[C@H]17CCC12CCC2.C6CC4=O.C5(=O)C7
|
CSCCC(=O)N1C[C@H]2C[C@H]1CCN2C(=O)[C@@H]1CCCc2ncnn21
|
CSCCC=O)NC[C@H]C[C@H]5CCN6C=O)[C@@H]CCCcncnn59
|
[C][S][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][C][=N][C][=N][N][Ring1][Branch1][Ring1][=Branch2]
|
C4(=O)[C@@H]1CCCc2ncnn21.N13C[C@H]2C[C@H]1CCN24.C5CC3=O.CS5
|
C[C@H]1OCC[C@@]1(F)C(=O)NC1CC(CNC(=O)c2cnc3c(c2)CCCC3)C1
|
C[C@H]OCC[C@@]5F)C=O)NCCCCNC=O)ccnccc6)CCCC6))))))))))))C4
|
[C][C@H1][O][C][C][C@@][Ring1][Branch1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][C]
|
c19cnc2c(c1)CCCC2.C[C@H]1OCC[C@]18F.C17CC%10C1.C48=O.C59=O.N47.C6%10.N56
|
C[C@H](O)C1CC(NC(=O)[C@H](Cc2cnn(C)c2O)NC(=O)[C@H](C)n2cccn2)C1
|
C[C@H]O)CCCNC=O)[C@H]CccnnC)c5O)))))))NC=O)[C@H]C)ncccn5)))))))))))C4
|
[C][C@H1][Branch1][C][O][C][C][C][Branch2][Ring2][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=C][C][=N][Ring1][Branch1][C][Ring2][Ring1][#Branch2]
|
c19cnn(C)c1O.C3(=O)[C@@H]5C9.C18CC6C1.C4(=O)[C@@H]7C.n17cccn1.C[C@@H]8O.N36.N45
|
C=C[C@]1(C(=O)N2CC[C@@H](C(C)C)C2)CCN(C(=O)c2cc[nH]c3nccc2-3)C1
|
C=C[C@]C=O)NCC[C@@H]CC)C))C5))))))CCNC=O)ccc[nH]cnccc9-5))))))))))C5
|
[C][=C][C@][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring1][Branch2][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][NH1][C][=N][C][=C][C][=Ring1][=Branch2][Ring1][Branch1][C][Ring2][Ring1][#Branch2]
|
c17cc[nH]c2nccc1-2.C=C[C@]16CCN5C1.N14CC[C@@H]8C1.C46=O.C8(C)C.C57=O
|
CC(=O)OCCC(=O)NC[C@]1(F)C[C@@H](CNC(=O)c2cc(O)ncn2)C1
|
CC=O)OCCC=O)NC[C@]F)C[C@@H]CNC=O)cccO)ncn6)))))))))C4
|
[C][C][=Branch1][C][=O][O][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][=N][Ring1][#Branch1][C][Ring1][S]
|
c19cc(O)ncn1.[C@]1%10(F)C[C@H]%11C1.C6CC4=O.CC3=O.C59=O.O36.N47.C7%10.C8%11.N58
|
C[C@@H](CCOc1ccccc1)C(=O)N1CC(C2CN(C(=O)c3occc3Cl)C2)C1
|
C[C@@H]CCOcccccc6)))))))))C=O)NCCCCNC=O)coccc5Cl)))))))C4))))C4
|
[C][C@@H1][Branch1][N][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][Cl][C][Ring1][N][C][Ring1][S]
|
N14CC(C2CN5C2)C1.C[C@@H](CC6)C4=O.c17ccccc1.c18occc1Cl.C58=O.O67
|
CCCC[C@H](CNC(=O)[C@@H](O)CC(N)=O)NC(=O)c1ncoc1C(C)C
|
CCCC[C@H]CNC=O)[C@@H]O)CCN)=O)))))))NC=O)cncoc5CC)C
|
[C][C][C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C][N][=C][O][C][=Ring1][Branch1][C][Branch1][C][C][C]
|
C2(=O)[C@@H](O)CC(N)=O.CCCC[C@@H]4C5.c16ncoc17.C36=O.C7(C)C.N25.N34
|
CCn1cc(C(=O)N2CCC[C@](C)(NC(=O)[C@H]3CCN(C(C)=O)C3)C2)cn1
|
CCnccC=O)NCCC[C@]C)NC=O)[C@H]CCNCC)=O))C5)))))))C6)))))))cn5
|
[C][C][N][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][Ring1][Branch2][C][Ring2][Ring1][C][C][=N][Ring2][Ring1][=Branch2]
|
N14CCC[C@@]7(C)C1.n1%10cc9cn1.[C@H]18CCN6C1.C49=O.C58=O.C6(C)=O.CC%10.N57
|
O=C(CCc1cscn1)N1CCC[C@@]12CCN(C(=O)[C@]1(Cl)CC1(F)F)C2
|
O=CCCccscn5)))))))NCCC[C@@]5CCNC=O)[C@]Cl)CC3F)F)))))C5
|
[O][=C][Branch1][#Branch2][C][C][C][=C][S][C][=N][Ring1][Branch1][N][C][C][C][C@@][Ring1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@][Branch1][C][Cl][C][C][Ring1][Ring2][Branch1][C][F][F][C][Ring1][=N]
|
N13CCC[C@@]12CCN4C2.[C@@]15(Cl)CC1(F)F.O=C3CC6.c16cscn1.C45=O
|
COCC1(CNc2ccc(S(=O)(=O)N[C@@H](C)C[S@+](C)[O-])cc2Br)CCC1
|
COCCCNccccS=O)=O)N[C@@H]C)C[S@+]C)[O-]))))))cc6Br)))))))))CCC4
|
[C][O][C][C][Branch2][Ring1][P][C][N][C][=C][C][=C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][S@+1][Branch1][C][C][O-1][C][=C][Ring1][S][Br][C][C][C][Ring2][Ring1][#Branch1]
|
c17ccc(S6(=O)=O)cc1Br.[C@H]5(C)C[S@+](C)[O-].C189CCC1.CO3.C38.C49.N47.N56
|
O=C(N[C@H]1C[C@](F)(CNC(=O)C2CCC3(CCCC3)CC2)C1)c1ccnnc1O
|
O=CN[C@H]C[C@]F)CNC=O)CCCCCCCC5))))CC6)))))))))C4)))))cccnnc6O
|
[O][=C][Branch2][Ring2][Branch1][N][C@H1][C][C@][Branch1][C][F][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][C][Ring1][#Branch2][C][Ring2][Ring1][Ring1][C][=C][C][=N][N][=C][Ring1][=Branch1][O]
|
C18CCC2(CCCC2)CC1.c19ccnnc1O.[C@H]17C[C@@]%10(F)C1.O=C49.C58=O.N47.C6%10.N56
|
Cc1n[nH]cc1CCCn1c(C2CC2)nnc1N1CCN(CC(F)(F)F)[C@H](C)C1
|
Ccn[nH]cc5CCCncCCC3)))nnc5NCCNCCF)F)F)))[C@H]C)C6
|
[C][C][=N][NH1][C][=C][Ring1][Branch1][C][C][C][N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][N][=C][Ring1][Branch2][N][C][C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C@H1][Branch1][C][C][C][Ring1][N]
|
N14CCN3[C@H](C)C1.n15c4nnc17.Cc1n[nH]cc16.C3C(F)(F)F.C6CC5.C17CC1
|
CC[C@@]1(C(=O)N2CC(O)(C(F)(F)F)C2)CCCN1C(=O)c1cocn1
|
CC[C@@]C=O)NCCO)CF)F)F))C4)))))CCCN5C=O)ccocn5
|
[C][C][C@@][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=Branch2][C][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][O][C][=N][Ring1][Branch1]
|
[C@@]157CCCN14.N13CC8(O)C1.c16cocn1.C8(F)(F)F.C35=O.C46=O.CC7
|
CC(C)N(CCNC(=O)c1n[nH]c2c1C[C@@H](C)CC2)C(=O)[C@@H]1CC[C@H]2CC[C@H]1O2
|
CCC)NCCNC=O)cn[nH]cc5C[C@@H]C)CC6)))))))))))))C=O)[C@@H]CC[C@H]CC[C@H]7O5
|
[C][C][Branch1][C][C][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][C@@H1][Branch1][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][C][C@H1][C][C][C@H1][Ring1][#Branch1][O][Ring1][Branch1]
|
c18n[nH]c2c1C[C@@H](C)CC2.[C@@H]19CC[C@H]2CC[C@H]1O2.CC5C.N456.C6C7.C38=O.C49=O.N37
|
CC(C)(CNc1ncc2ccnc-2[nH]1)NC(=O)c1nnc2ccccc2n1
|
CCC)CNcnccccnc-5[nH]9)))))))))))NC=O)cnncccccc6n%10
|
[C][C][Branch1][C][C][Branch1][S][C][N][C][=N][C][=C][C][=C][N][=C][Ring1][Branch1][NH1][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=N][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2]
|
c17nnc2ccccc2n1.c16ncc2ccnc-2[nH]1.CC4(C)C5.C37=O.N56.N34
|
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