SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCC1(O)CN(C(=O)C=C(C)CNC(=O)Cn2ncnn2)C1
|
CCCO)CNC=O)C=CC)CNC=O)Cnncnn5))))))))))))C4
|
[C][C][C][Branch1][C][O][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][N][N][=C][N][=N][Ring1][Branch1][C][Ring2][Ring1][Ring2]
|
C18(O)CN3C1.n17ncnn1.C3(=O)C=6.C=6(C)C5.C4(=O)C7.CC8.N45
|
O=C(N[C@H]1C=CCN(C(=O)[C@H]2CCCc3cccnc32)C1)c1c[nH]c(Br)c1
|
O=CN[C@H]C=CCNC=O)[C@H]CCCccccnc6%10)))))))))))C6)))))))cc[nH]cBr)c5
|
[O][=C][Branch2][Ring1][S][N][C@H1][C][=C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring1][#Branch2][C][Ring2][Ring1][C][C][=C][NH1][C][Branch1][C][Br][=C][Ring1][=Branch1]
|
C5(=O)[C@H]1CCCc2cccnc21.[C@H]16C=CCN5C1.c17c[nH]c(Br)c1.O=C47.N46
|
COc1nccc(C(=O)NCC2=CCCN(C(=O)[C@@]34CSC[C@@H]3C4)C2)n1
|
COcncccC=O)NCC=CCCNC=O)[C@@]CSC[C@@H]5C6)))))))C6)))))))))n6
|
[C][O][C][=N][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][=C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@][C][S][C][C@@H1][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][=C][=N][Ring2][Ring1][Branch2]
|
C8C1=CCCN6C1.c17nccc9n1.[C@@]12%10CSC[C@@H]1C2.C59=O.C6%10=O.CO7.N58
|
CCn1nnnc1[C@H](N[C@H](C)COc1cccc(F)c1)c1csc(Cl)n1
|
CCnnnnc5[C@H]N[C@H]C)COcccccF)c6))))))))))ccscCl)n5
|
[C][C][N][N][=N][N][=C][Ring1][Branch1][C@H1][Branch2][Ring1][Ring1][N][C@H1][Branch1][C][C][C][O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][S][C][Branch1][C][Cl][=N][Ring1][=Branch1]
|
c13cccc(F)c1.n16nnnc17.c18csc(Cl)n1.[C@@H]5(C)C2.[C@H]478.CC6.N45.O23
|
CC[C@](C)(CNC(=O)c1ncoc1C)C(=O)N[C@@H](C)C1CC(F)(F)C1
|
CC[C@]C)CNC=O)cncoc5C)))))))))C=O)N[C@@H]C)CCCF)F)C4
|
[C][C][C@][Branch1][C][C][Branch1][#C][C][N][C][=Branch1][C][=O][C][N][=C][O][C][=Ring1][Branch1][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1]
|
CC[C@](C)(C4)C3=O.c16ncoc1C.C17CC(F)(F)C1.C26=O.[C@@H]57C.N24.N35
|
CC[C@@](C)(COC)C(=O)N1CC[C@H](N(C)C(=O)CNS(=O)(=O)C2CC2)C1
|
CC[C@@]C)COC)))C=O)NCC[C@H]NC)C=O)CNS=O)=O)CCC3))))))))C5
|
[C][C][C@@][Branch1][C][C][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][#Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][Ring1][P]
|
CC[C@@](C)(C5)C3=O.N13CC[C@H]8C1.S7(=O)(=O)C1CC1.C4(=O)C6.N48C.O5C.N67
|
Cc1cc(C(=O)NCC[C@]2(O)CCCN(C(=O)CCO[C@H]3CCOC3)C2)n[nH]1
|
CcccC=O)NCC[C@]O)CCCNC=O)CCO[C@H]CCOC5)))))))))C6))))))))))n[nH]5
|
[C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][O][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][O][C@H1][C][C][O][C][Ring1][Branch1][C][Ring1][P][=N][NH1][Ring2][Ring1][O]
|
[C@@]1%10(O)CCCN5C1.Cc1cc9n[nH]1.C5(=O)CC6.[C@H]17CCOC1.C49=O.C8C%10.N48.O67
|
C=C1C[C@H]1C(=O)NCCCC1CCN(C(=O)Cc2c[nH]c3cccnc23)CC1
|
C=CC[C@H]3C=O)NCCCCCCNC=O)Ccc[nH]ccccnc96)))))))))))CC6
|
[C][=C][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][NH1][C][=C][C][=C][N][=C][Ring1][=Branch2][Ring1][=Branch1][C][C][Ring2][Ring1][C]
|
c19c[nH]c2cccnc12.C18CCN5CC1.C=C1C[C@H]17.C6CC8.C5(=O)C9.C47=O.N46
|
CCN(CC)CC(=O)NCC1(O)CCN(C(=O)[C@@H]2CC(=O)N(C(C)C)C2)CC1
|
CCNCC))CC=O)NCCO)CCNC=O)[C@@H]CC=O)NCC)C))C5))))))CC6
|
[C][C][N][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring1][=Branch2][C][C][Ring2][Ring1][C]
|
C1%11(O)CCN4CC1.[C@@H]19CC(=O)N%10C1.C7C3=O.N567.C49=O.C%10(C)C.CC5.C6C.N38.C8%11
|
O=C(CCc1ccccc1)N1C[C@@H]2CN(S(=O)(=O)c3ccccc3Br)C[C@H]21
|
O=CCCcccccc6))))))))NC[C@@H]CNS=O)=O)cccccc6Br))))))))C[C@H]57
|
[O][=C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C@@H1][C][N][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][C][C@H1][Ring1][#C][Ring1][P]
|
S5(=O)(=O)c1ccccc1Br.N14C[C@@H]2CN5C[C@H]21.c16ccccc1.O=C4CC6
|
Cn1c(C#N)ccc1C(=O)N1CC2(C1)CN(C(=O)C1CCCCC1)C2
|
CncC#N))ccc5C=O)NCCC4)CNC=O)CCCCCC6)))))))C4
|
[C][N][C][Branch1][Ring1][C][#N][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][=Branch1][C][Ring1][=N]
|
Cn1c5ccc1C#N.N13CC2(C1)CN4C2.C16CCCCC1.C35=O.C46=O
|
C=C[C@](C)(O)c1cn(CCCCCCNC(=O)[C@@H](C)c2ccccc2Cl)nn1
|
C=C[C@]C)O)ccnCCCCCCNC=O)[C@@H]C)cccccc6Cl))))))))))))))))nn5
|
[C][=C][C@][Branch1][C][C][Branch1][C][O][C][=C][N][Branch2][Ring1][=Branch2][C][C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][=N][Ring2][Ring1][#Branch1]
|
C5CCCCC4.c17ccccc1Cl.c16cn5nn1.C=C[C@]6(C)O.C3(=O)[C@H]7C.N34
|
CCc1nc(C(=O)NC[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3ccn(C)n3)CC2)cs1
|
CCcncC=O)NC[C@@H]CCCNC=O)[C@@H]C[C@H]3cccnC)n5)))))))))CC7))))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][C][Ring2][Ring1][C][=C][S][Ring2][Ring1][O]
|
[C@@H]1%10CCCN5CC1.c19nc7cs1.c1%11ccn(C)n1.[C@@H]18C[C@H]1%11.C47=O.C58=O.CC9.N46.C6%10
|
C[C@H](Cc1ccco1)C(=O)NCC1(CN(C)C(=O)C(F)(F)c2ccnn2C)CC1
|
C[C@H]Ccccco5))))))C=O)NCCCNC)C=O)CF)F)cccnn5C))))))))))CC3
|
[C][C@H1][Branch1][=Branch2][C][C][=C][C][=C][O][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][C][=N][N][Ring1][Branch1][C][C][C][Ring1][P]
|
C[C@H](C7)C3=O.C4(=O)C8(F)F.c18ccnn1C.c17ccco1.C19%10CC1.N46C.N35.C59.C6%10
|
CC(C)Cc1ncc(C(=O)N2CCN(C3CN(C(=O)C(N)=O)C3)CC2)[nH]1
|
CCC)CcnccC=O)NCCNCCNC=O)CN)=O)))C4))))CC6)))))))[nH]5
|
[C][C][Branch1][C][C][C][C][=N][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][N][=O][C][Ring1][=Branch2][C][C][Ring1][#C][NH1][Ring2][Ring1][=Branch1]
|
N14CCN6CC1.c18ncc7[nH]1.C16CN5C1.C5(=O)C(N)=O.CC(C)C8.C47=O
|
C#C[C@H](C)N1CCN(C(=O)CCN(CCO)C(=O)[C@@H](C)C2(O)CCC2)CC1
|
C#C[C@H]C)NCCNC=O)CCNCCO)))C=O)[C@@H]C)CO)CCC4))))))))))CC6
|
[C][#C][C@H1][Branch1][C][C][N][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C][C][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][C][Ring2][Ring1][#Branch1]
|
N15CCN3CC1.C3(=O)CC6.C4(=O)[C@H]8C.C18(O)CCC1.C#C[C@@H]5C.N467.C7CO
|
Cc1ccc2c(C(=O)N[C@@H]3CC[C@H]3NC(=O)C3=NO[C@H](C)C3)coc2c1
|
CcccccC=O)N[C@@H]CC[C@H]4NC=O)C=NO[C@H]C)C5)))))))))))))coc5c9
|
[C][C][=C][C][=C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=N][O][C@H1][Branch1][C][C][C][Ring1][=Branch1][=C][O][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][=Branch2]
|
Cc1ccc2c8coc2c1.C5(=O)C1=NO[C@H](C)C1.[C@@H]16CC[C@H]17.C48=O.N46.N57
|
COC1(C(=O)NC[C@H](NC(=O)CSc2ccc3c(c2)CCC3)C(C)C)CCCC1
|
COCC=O)NC[C@H]NC=O)CScccccc6)CCC5))))))))))))CC)C))))))CCCC5
|
[C][O][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][C][Branch1][C][C][C][C][C][C][C][Ring2][Ring1][O]
|
c1%11ccc2c(c1)CCC2.C16%10CCCC1.C7[C@H]8C(C)C.C5(=O)C9.C4%10=O.CO6.N47.N58.S9%11
|
COc1cnccc1C(=O)NC1(C2CN(C(=O)[C@@H](C)CC(C)(C)C)C2)CC1
|
COccnccc6C=O)NCCCNC=O)[C@@H]C)CCC)C)C)))))C4))))CC3
|
[C][O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=N][C][C][Ring1][S]
|
C4(=O)[C@@H](C)CC(C)(C)C.C16(C2CN4C2)CC1.c15cnccc17.C37=O.CO5.N36
|
O=C(NCCc1ccc(-n2cc(-c3cn[nH]c3)nn2)cc1)[C@@H]1CC[C@@H](C2CC2)C1
|
O=CNCCcccc-ncc-ccn[nH]c5)))))nn5)))))cc6)))))))))[C@@H]CC[C@@H]CCC3)))C5
|
[O][=C][Branch2][Ring1][=C][N][C][C][C][=C][C][=C][Branch1][P][N][C][=C][Branch1][Branch2][C][C][=N][NH1][C][=Ring1][Branch1][N][=N][Ring1][#Branch2][C][=C][Ring1][S][C@@H1][C][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][Branch2]
|
[C@@H]16CC[C@@H](C2CC2)C1.c17ccc8cc1.n18cc9nn1.c19cn[nH]c1.O=C46.C5C7.N45
|
COCCN=C(NCc1ccc(OC(F)(F)F)cc1)N[C@H](C)CCS(C)(=O)=O
|
COCCN=CNCccccOCF)F)F)))cc6))))))))N[C@H]C)CCSC)=O)=O
|
[C][O][C][C][N][=C][Branch2][Ring1][=Branch1][N][C][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][N][C@H1][Branch1][C][C][C][C][S][Branch1][C][C][=Branch1][C][=O][=O]
|
C2CN=C(N4)N5.[C@@H]5(C)CCS(C)(=O)=O.c16ccc3cc1.O3C(F)(F)F.CO2.C46
|
CCC(CC)[C@H](CNC(=O)N1CCC[C@H](CCF)C1)N1CCCC1
|
CCCCC))[C@H]CNC=O)NCCC[C@H]CCF)))C6)))))))))NCCCC5
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][Ring2][C][C][F][C][Ring1][=Branch2][N][C][C][C][C][Ring1][Branch1]
|
CCC(CC)[C@@H]4C5.N13CCC[C@H]6C1.N14CCCC1.C23=O.C6CF.N25
|
C[C@H]1C[C@@H](C(=O)N[C@]2(C(=O)NCC34CC(CCO3)C4)CC2(C)C)CC(=O)N1
|
C[C@H]C[C@@H]C=O)N[C@]C=O)NCCCCCCO6)))C4)))))))CC3C)C))))))CC=O)N6
|
[C][C@H1][C][C@@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][Ring1][#Branch1][C][C][Ring1][=C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][Ring2][Ring1][#Branch2]
|
C[C@H]1C[C@@H]9CC(=O)N1.C12%11CC(CCO1)C2.[C@@]17%10CC1(C)C.C59=O.C6%10=O.N57.N68.C8%11
|
COCC1(CN[C@H](c2[nH]cnc2C)c2nnnn2[C@H](C)c2ccccc2)COC1
|
COCCCN[C@H]c[nH]cnc5C))))))cnnnn5[C@H]C)cccccc6)))))))))))))))COC4
|
[C][O][C][C][Branch2][Ring1][P][C][N][C@H1][Branch1][=Branch2][C][NH1][C][=N][C][=Ring1][Branch1][C][C][=N][N][=N][N][Ring1][Branch1][C@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][C][Ring2][Ring1][#Branch2]
|
c17[nH]cnc1C.c18nnnn16.c1%11ccccc1.C19%10COC1.[C@@H]578.[C@H]6%11C.CO3.C39.C4%10.N45
|
COC(=O)[C@H](NC(=O)c1sccc1S(=O)(=O)Nc1cnn(C)c1)c1cscn1
|
COC=O)[C@H]NC=O)csccc5S=O)=O)NccnnC)c5))))))))))))))ccscn5
|
[C][O][C][=Branch1][C][=O][C@H1][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=C][S][C][=N][Ring1][Branch1]
|
c17sccc1S5(=O)=O.c16cnn(C)c1.C2(=O)[C@H]48.c18cscn1.C37=O.CO2.N34.N56
|
O=C(N[C@@]12CCC[C@H]1N(C(=O)c1cccnc1CO)CC2)c1csc([N+](=O)[O-])c1
|
O=CN[C@@]CCC[C@H]5NC=O)ccccnc6CO)))))))))CC8)))))))))ccsc[N+]=O)[O-]))c5
|
[O][=C][Branch2][Ring1][#C][N][C@@][C][C][C][C@H1][Ring1][Branch1][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][O][C][C][Ring2][Ring1][C][C][=C][S][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][Branch2]
|
[C@@]125CCC[C@H]1N4CC2.c16csc([N+](=O)[O-])c1.c17cccnc18.O=C36.C47=O.N35.C8O
|
Cc1ccc2cnc(C(=O)N3CCN(C(=O)Cc4ccc(C)o4)[C@@H](C)C3)cc2c1
|
CcccccncC=O)NCCNC=O)CccccC)o5)))))))[C@@H]C)C6)))))))cc6c%10
|
[C][C][=C][C][=C][C][=N][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][C][O][Ring1][=Branch1][C@@H1][Branch1][C][C][C][Ring1][S][=C][C][Ring2][Ring1][Branch2][=C][Ring2][Ring1][N]
|
Cc1ccc2cnc7cc2c1.N15CCN6[C@@H](C)C1.c18ccc(C)o1.C6(=O)C8.C57=O
|
CC(C)(CO)C(=O)N1C[C@H](C(=O)NCc2ccc(O)nc2)CCC1(C)C
|
CCC)CO))C=O)NC[C@H]C=O)NCccccO)nc6)))))))))CCC6C)C
|
[C][C][Branch1][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][O][N][=C][Ring1][#Branch1][C][C][C][Ring1][P][Branch1][C][C][C]
|
N13C[C@H]6CCC1(C)C.CC(C)(CO)C3=O.c17ccc(O)nc1.C46=O.N45.C57
|
CCC(=O)C(=O)N1CCN2CCN(C(=O)c3cc4c(C)snc4s3)C[C@H]2C1
|
CCC=O)C=O)NCCNCCNC=O)ccccC)snc5s8)))))))))C[C@H]6C%10
|
[C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][S][N][=C][Ring1][=Branch1][S][Ring1][=Branch2][C][C@H1][Ring1][P][C][Ring2][Ring1][Branch1]
|
N15CCN2CCN6C[C@H]2C1.c17cc2c(C)snc2s1.CCC(=O)C5=O.C67=O
|
C[C@H](CNC(=O)c1cc(F)cnc1O)[C@H](F)C(=O)N1C[C@H](O)C[C@@H]1CN(C)C
|
C[C@H]CNC=O)cccF)cnc6O))))))))))[C@H]F)C=O)NC[C@H]O)C[C@@H]5CNC)C
|
[C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][N][=C][Ring1][#Branch1][O][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@@H1][Ring1][=Branch1][C][N][Branch1][C][C][C]
|
C[C@H](C4)[C@H](F)C3=O.c16cc(F)cnc1O.N13C[C@H](O)C[C@@H]17.C26=O.N5(C)C.N24.C57
|
C#CCn1cccc1C(=O)NC[C@@H]1CCC[C@@H]1NC(=O)C(F)(F)c1ccccc1
|
C#CCncccc5C=O)NC[C@@H]CCC[C@@H]5NC=O)CF)F)cccccc6
|
[C][#C][C][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
n17cccc16.[C@@H]18CCC[C@@H]15.C3(=O)C9(F)F.c19ccccc1.C#CC7.C26=O.N24.C48.N35
|
CCC(=O)N[C@@H]1CCN(C(=O)c2cc(C3CC3)nc3c2c(O)nn3C)C[C@H]1C
|
CCC=O)N[C@@H]CCNC=O)cccCCC3)))ncc6cO)nn5C)))))))))))C[C@H]6C
|
[C][C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=C][Ring1][=Branch2][C][Branch1][C][O][=N][N][Ring1][=Branch1][C][C][C@H1][Ring2][Ring1][=Branch1][C]
|
c17cc8nc2c1c(O)nn2C.[C@@H]16CCN5C[C@H]1C.CCC4=O.C57=O.C18CC1.N46
|
[N-]=[N+]=Nc1ccc(C(=O)NCC[C@H]2CCN(C(=O)[C@@H]3CCOC3=O)C2)cc1
|
[N-]=[N+]=NccccC=O)NCC[C@H]CCNC=O)[C@@H]CCOC5=O)))))))C5)))))))))cc6
|
[N-1][=N+1][=N][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][C][O][C][Ring1][Branch1][=O][C][Ring1][=N][C][=C][Ring2][Ring1][Branch2]
|
[N-]=[N+]=Nc1ccc8cc1.[C@H]19CCN5C1.[C@@H]17CCOC1=O.C48=O.C6C9.C57=O.N46
|
Cc1ccccc1S(=O)(=O)CC(=O)NC[C@@](C)(NC(=O)[C@H](F)C(C)C)C1CC1
|
Ccccccc6S=O)=O)CC=O)NC[C@@]C)NC=O)[C@H]F)CC)C)))))CCC3
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][#C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][Branch1][C][C][C][C][C][C][Ring1][Ring1]
|
Cc1ccccc1S(=O)(=O)CC2=O.C3(=O)[C@H](F)C(C)C.C4[C@@]56C.C16CC1.N24.N35
|
Cc1ccnnc1C(=O)N[C@@H]1C=CCN(C(=O)Cc2c(C)nn(C(F)F)c2C)C1
|
Ccccnnc6C=O)N[C@@H]C=CCNC=O)CccC)nnCF)F))c5C))))))))C6
|
[C][C][=C][C][=N][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][=C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][C][C][Branch1][C][C][=N][N][Branch1][=Branch1][C][Branch1][C][F][F][C][=Ring1][=Branch2][C][C][Ring2][Ring1][Ring1]
|
c18c(C)nn7c1C.Cc1ccnnc16.[C@@H]15C=CCN4C1.C4(=O)C8.C36=O.C7(F)F.N35
|
CCCCCCn1nnnc1[C@H](CC(C)(C)C#N)NCc1cc(C(=O)OC)co1
|
CCCCCCnnnnc5[C@H]CCC)C)C#N))))NCcccC=O)OC)))co5
|
[C][C][C][C][C][C][N][N][=N][N][=C][Ring1][Branch1][C@H1][Branch1][O][C][C][Branch1][C][C][Branch1][C][C][C][#N][N][C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][O][Ring1][=Branch2]
|
[C@@H]37CC(C)(C)C#N.CCCCCC6.n16nnnc17.c18cc5co1.C25=O.N34.C48.O2C
|
O=C1CC[C@@H](CCNC(=O)C2=CC3(CCNCC3)C2)N1
|
O=CCC[C@@H]CCNC=O)C=CCCCNCC6)))))C4))))))))N5
|
[O][=C][C][C][C@@H1][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][Branch2][C][C][N][C][C][Ring1][=Branch1][C][Ring1][=Branch2][N][Ring2][Ring1][Ring1]
|
C4(=O)C1=CC2(CCNCC2)C1.O=C1CC[C@@H]6N1.C6C5.N45
|
CS[C@@H]1CN([C@@H](C(=O)NCC2CC2)c2nn(C)cc2Cl)C2(CCC2)C1
|
CS[C@@H]CN[C@@H]C=O)NCCCC3))))))cnnC)cc5Cl)))))))CCCC4)))C5
|
[C][S][C@@H1][C][N][Branch2][Ring1][#Branch2][C@@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][Cl][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][#Branch1]
|
[C@@H]18CN4C2(CCC2)C1.c16nn(C)cc1Cl.[C@@H]46C3=O.C17CC1.CS8.N35.C57
|
C[C@@H](C(=O)NCc1n[nH]cc1C(=O)Nc1ccc(O)nc1)[C@H]1CCC(=O)N1
|
C[C@@H]C=O)NCcn[nH]cc5C=O)NccccO)nc6))))))))))))))))[C@H]CCC=O)N5
|
[C][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][O][N][=C][Ring1][#Branch1][C@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1]
|
c15ccc(O)nc1.c18n[nH]cc16.[C@H]17CCC(=O)N1.C[C@H]7C2=O.C36=O.N24.C48.N35
|
CC1(C)CN(C(=O)[C@@H]2COc3ccccc32)CC[C@@H]1NC(=O)c1ccncc1Cl
|
CCC)CNC=O)[C@@H]COcccccc69))))))))))CC[C@@H]6NC=O)cccncc6Cl
|
[C][C][Branch1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][C][C@@H1][Ring2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][Cl]
|
C4(=O)[C@@H]1COc2ccccc21.CC1(C)CN4CC[C@@H]16.c17ccncc1Cl.C57=O.N56
|
CCC1(NC(=O)[C@@H](C)Cn2ccc(C)n2)CCN(C(=O)C2=CCCSC2)CC1
|
CCCNC=O)[C@@H]C)CncccC)n5)))))))))CCNC=O)C=CCCSC6)))))))CC6
|
[C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][C][=C][C][Branch1][C][C][=N][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][C][S][C][Ring1][=Branch1][C][C][Ring2][Ring1][#Branch2]
|
C157CCN4CC1.C4(=O)C1=CCCSC1.C3(=O)[C@@H](C)C6.n16ccc(C)n1.CC7.N35
|
Cn1ccc2cc(C(=O)NCC[C@H]3CCCN3C(=O)C[C@]3(C)CCCO3)cnc21
|
CncccccC=O)NCC[C@H]CCCN5C=O)C[C@]C)CCCO5))))))))))))))))cnc69
|
[C][N][C][=C][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@][Branch1][C][C][C][C][C][O][Ring1][=Branch1][=C][N][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][N]
|
Cn1ccc2cc7cnc21.[C@H]18CCCN15.[C@@]19(C)CCCO1.C5(=O)C9.C47=O.C6C8.N46
|
CC1=C(C)C[C@](C)(C(=O)NC[C@@H](NC(=O)C=Cc2sccc2C)C2CCC2)CC1
|
CC=CC)C[C@]C)C=O)NC[C@@H]NC=O)C=Ccsccc5C))))))))))CCCC4))))))))CC6
|
[C][C][=C][Branch1][C][C][C][C@][Branch1][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][S][C][=C][C][=Ring1][Branch1][C][C][C][C][C][Ring1][Ring2][C][C][Ring2][Ring1][N]
|
CC1=C(C)C[C@@]7(C)CC1.C=8c1sccc1C.C5[C@@H]69.C4(=O)C=8.C19CCC1.C37=O.N35.N46
|
CC1(C)CC(O)(C(=O)N2CC3(CC(NC(=O)C4=CCCOC4)C3)C2)C1
|
CCC)CCO)C=O)NCCCCNC=O)C=CCCOC6))))))))C4)))C4)))))C4
|
[C][C][Branch1][C][C][C][C][Branch1][C][O][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][C][O][C][Ring1][=Branch1][C][Ring1][=N][C][Ring1][S][C][Ring2][Ring1][Branch2]
|
N15CC2(CC7C2)C1.C6(=O)C1=CCCOC1.CC1(C)CC8(O)C1.C58=O.N67
|
C[C@@H]1CN(C(=O)c2cc3ccccc3nc2O)C[C@@H]1NC(=O)C1(Cl)CC1
|
C[C@@H]CNC=O)cccccccc6nc%10O))))))))))))C[C@@H]5NC=O)CCl)CC3
|
[C][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][#Branch2][O][C][C@@H1][Ring2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][Cl][C][C][Ring1][Ring2]
|
c18cc2ccccc2nc1O.C[C@@H]1CN4C[C@@H]16.C17(Cl)CC1.C48=O.C57=O.N56
|
Cc1cc(CNC(=O)c2ccc(Cn3nc(C)cc3C)o2)ncn1
|
CcccCNC=O)ccccCnncC)cc5C)))))))o5))))))))ncn6
|
[C][C][=C][C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][C][N][N][=C][Branch1][C][C][C][=C][Ring1][=Branch1][C][O][Ring1][=N][=N][C][=N][Ring2][Ring1][#Branch1]
|
Cc1cc8ncn1.n17nc(C)cc1C.c16ccc9o1.C46=O.C58.N45.C79
|
CSCCOCC(=O)N1CC[C@@H]2[C@H](C1)CN2C(=O)c1ccnc2ncnn12
|
CSCCOCC=O)NCC[C@@H][C@H]C6)CN4C=O)cccncncnn95
|
[C][S][C][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][=N][C][=N][C][=N][N][Ring1][=Branch2][Ring1][Branch1]
|
N13CC[C@@H]2[C@H](C1)CN24.c18ccnc2ncnn12.C6C3=O.C7C5.C48=O.CS7.O56
|
CO[C@H](C(=O)NCC[C@@H](C)N1CCC1)C1CN(C(=O)[C@@H]2CCS2(=O)=O)C1
|
CO[C@H]C=O)NCC[C@@H]C)NCCC4)))))))))CCNC=O)[C@@H]CCS4=O)=O))))))C4
|
[C][O][C@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][N][C][C][C][Ring1][Ring2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][C][C][S][Ring1][Ring2][=Branch1][C][=O][=O][C][Ring1][N]
|
[C@@H]18CCS1(=O)=O.[C@H]59C3=O.C6C[C@H]7C.C19CN4C1.N17CCC1.C48=O.CO5.N36
|
CCC1=NO[C@H](C(=O)N2C[C@H](NC(=O)CCSCc3ccccc3)C[C@H]2C)C1
|
CCC=NO[C@H]C=O)NC[C@H]NC=O)CCSCcccccc6))))))))))))C[C@H]5C)))))))C5
|
[C][C][C][=N][O][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Ring2][Ring1][C][C][C][Ring2][Ring1][#Branch2]
|
CCC1=NO[C@H]9C1.N14C[C@H]8C[C@H]1C.c1%10ccccc1.C5(=O)CC6.C49=O.N58.S67.C7%10
|
N#Cc1ccc(C(=O)N[C@@H]2C[C@H](NC(=O)Cn3cncn3)C23CCOCC3)nc1
|
N#CccccC=O)N[C@@H]C[C@H]NC=O)Cncncn5))))))))C4CCOCC6)))))))))))nc6
|
[N][#C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][N][C][=N][C][=N][Ring1][Branch1][C][Ring1][=N][C][C][O][C][C][Ring1][=Branch1][N][=C][Ring2][Ring1][O]
|
[C@@H]16C[C@H]7C12CCOCC2.N#Cc1ccc8nc1.n19cncn1.C5(=O)C9.C48=O.N46.N57
|
CC[S@@+]([O-])CC(=O)N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1
|
CC[S@@+][O-])CC=O)N[C@H]CO[C@H][C@@H]5OC[C@@H]5NC=O)ccccO)c[N+]=O)[O-]))c6
|
[C][C][S@@+1][Branch1][C][O-1][C][C][=Branch1][C][=O][N][C@H1][C][O][C@H1][C@@H1][Ring1][Branch1][O][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][#Branch2]
|
c17ccc(O)c([N+](=O)[O-])c1.[C@H]15CO[C@H]2[C@@H]1OC[C@@H]26.CC[S@@+]([O-])CC3=O.C47=O.N35.N46
|
CCc1nonc1C(=O)N1C[C@@H](C)C[C@@H](CNC(=O)c2c(C)coc2CC)C1
|
CCcnonc5C=O)NC[C@@H]C)C[C@@H]CNC=O)ccC)coc5CC))))))))))C6
|
[C][C][C][=N][O][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=C][O][C][=Ring1][=Branch1][C][C][C][Ring2][Ring1][Ring1]
|
N13C[C@H]%10C[C@H](C)C1.c17c(C)coc19.c18nonc16.C36=O.C47=O.CC8.C5%10.N45.C9C
|
Cc1nc(CCNC(=O)[C@@]2(C)CCCN(C(=O)Nc3cccc(I)c3)C2)no1
|
CcncCCNC=O)[C@@]C)CCCNC=O)NcccccI)c6))))))))C6))))))))))no5
|
[C][C][=N][C][Branch2][Ring2][Branch1][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][I][=C][Ring1][#Branch1][C][Ring1][P][=N][O][Ring2][Ring1][O]
|
[C@]19(C)CCCN5C1.c18cccc(I)c1.Cc1nc%10no1.C%10C7.C49=O.C56=O.N47.N68
|
CC(C)[C@H]1CCCCN1[C@H](C(=O)NCCC1CC1)c1cn(-c2ccccc2)nn1
|
CCC)[C@H]CCCCN6[C@H]C=O)NCCCCC3)))))))ccn-cccccc6))))))nn5
|
[C][C][Branch1][C][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C@H1][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Ring1][C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O]
|
[C@H]16CCCCN14.c17cn9nn1.c19ccccc1.[C@H]47C3=O.CC6C.C5C8.C18CC1.N35
|
CCO[C@H](C(=O)N[C@@H]1COC[C@H]1CNC(=O)c1cncc(SC)c1)C1CCCC1
|
CCO[C@H]C=O)N[C@@H]COC[C@H]5CNC=O)ccnccSC))c6))))))))))))))))CCCCC5
|
[C][C][O][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][O][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][Ring1][S][C][=C][Ring1][Branch2][C][C][C][C][C][Ring1][Branch1]
|
c19cncc3c1.[C@@H]18COC[C@H]1%11.[C@H]6%10C2=O.C1%10CCCC1.C49=O.CC5.O56.N28.C7%11.N47.S3C
|
COc1ncncc1NC(=O)[C@]1(C)C=CCN1C(=O)[C@H](O)C1CCCCC1
|
COcncncc6NC=O)[C@]C)C=CCN5C=O)[C@H]O)CCCCCC6
|
[C][O][C][=N][C][=N][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][=C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][C][C][C][Ring1][=Branch1]
|
c14ncncc15.[C@@]16(C)C=CCN13.C17CCCCC1.C3(=O)[C@@H]7O.C26=O.CO4.N25
|
CC1(C)CC(O)(C(=O)NC[C@@H]2CCCN2C(=O)c2cn(CCO)c(=O)nc2O)C1
|
CCC)CCO)C=O)NC[C@@H]CCCN5C=O)ccnCCO)))c=O)nc6O))))))))))))))))C4
|
[C][C][Branch1][C][C][C][C][Branch1][C][O][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][N][=C][Ring1][#Branch2][O][C][Ring2][Ring1][N]
|
c17cn8c(=O)nc1O.CC1(C)CC6(O)C1.[C@@H]19CCCN14.C36=O.C47=O.C8CO.N35.C59
|
Cc1cccc(OCCC(=O)N2CCN(C(=O)c3coc(CO)c3)[C@@H]3CC[C@@H]32)c1
|
CcccccOCCC=O)NCCNC=O)ccocCO))c5))))))[C@@H]CC[C@@H]48))))))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Branch1][O][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][O][C][Branch1][Ring1][C][O][=C][Ring1][#Branch1][C@@H1][C][C][C@@H1][Ring1][Ring2][Ring1][P][=C][Ring2][Ring1][N]
|
N14CCN5[C@@H]2CC[C@@H]21.Cc1cccc7c1.c18coc9c1.C6CC4=O.C58=O.O67.C9O
|
O=C(NCCNC(=O)C1CC(=C2CCC2)C1)c1cn(Cc2cccc(F)c2)nn1
|
O=CNCCNC=O)CCC=CCCC4))))C4)))))))))ccnCcccccF)c6)))))))nn5
|
[O][=C][Branch2][Ring1][#Branch1][N][C][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][#Branch1][=C][C][C][C][Ring1][Ring2][C][Ring1][Branch2][C][=C][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][=N][Ring1][=N]
|
c1%11cccc(F)c1.c17cn%10nn1.C18CC=9C1.C1=9CCC1.O=C37.C5C6.C48=O.N35.N46.C%10%11
|
COCC[C@H](OC)C(=O)N1CC[C@]2(CC[C@@H](NC(=O)[C@@H](C)N3CCCCC3)C2)C1
|
COCC[C@H]OC))C=O)NCC[C@]CC[C@@H]NC=O)[C@@H]C)NCCCCC6)))))))))C5))))C5
|
[C][O][C][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C@][Branch2][Ring1][O][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][Ring1][S][C][Ring2][Ring1][Ring2]
|
N14CC[C@]2(CC[C@@H]9C2)C1.C6C[C@H]7C4=O.N18CCCCC1.C5(=O)[C@H]8C.CO6.O7C.N59
|
COC(=O)c1nc(=N[C@@H]2CCN(C(=O)COCc3nnc(C)s3)[C@@H](C)C2)cc[nH]1
|
COC=O)cnc=N[C@@H]CCNC=O)COCcnncC)s5)))))))))[C@@H]C)C6)))))))cc[nH]6
|
[C][O][C][=Branch1][C][=O][C][=N][C][=Branch2][Ring2][C][=N][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][O][C][C][=N][N][=C][Branch1][C][C][S][Ring1][=Branch1][C@@H1][Branch1][C][C][C][Ring2][Ring1][C][C][=C][NH1][Ring2][Ring1][=Branch2]
|
c18nc(=N[C@@H]2CCN5[C@@H](C)C2)cc[nH]1.c19nnc(C)s1.C5(=O)C6.C48=O.CO4.O67.C79
|
C[C@@H](NC(=O)[C@@H](CC(F)F)NC(=O)C1CC2(CCC2)C1)c1ccncn1
|
C[C@@H]NC=O)[C@@H]CCF)F)))NC=O)CCCCCC4)))C4)))))))))cccncn6
|
[C][C@@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][N][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch1][C][=C][C][=N][C][=N][Ring1][=Branch1]
|
C3(=O)[C@H]6CC(F)F.C17CC2(CCC2)C1.c18ccncn1.C[C@@H]58.C47=O.N35.N46
|
CN(CC=CC(=O)N[C@]1(C)CCCN(C(=O)CC(F)(F)C(F)F)C1)CC(F)(F)F
|
CNCC=CC=O)N[C@]C)CCCNC=O)CCF)F)CF)F)))))C6)))))))))))CCF)F)F
|
[C][N][Branch2][Ring2][Branch2][C][C][=C][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F][C][Ring1][S][C][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)CC(F)(F)C(F)F.[C@@]15(C)CCCN3C1.C6C(F)(F)F.C=7C2=O.CN46.C4C=7.N25
|
CC1=NO[C@@H](CNC(=O)/C(C)=C/CNC(=O)c2cc3n(n2)CCO3)C1
|
CC=NO[C@@H]CNC=O)/CC)=C/CNC=O)cccnn5)CCO5)))))))))))))))C5
|
[C][C][=N][O][C@@H1][Branch2][Ring1][S][C][N][C][=Branch1][C][=O][/C][Branch1][C][C][=C][/C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][O][Ring1][=Branch1][C][Ring2][Ring1][Branch2]
|
c18cc2n(n1)CCO2.CC1=NO[C@@H]%10C1.C4(=O)C=9C.C=9C7.C58=O.C6%10.N46.N57
|
CCn1cc(Cl)c(C(=O)N2CCC[C@@](O)(CNc3cc(O)ncn3)C2)n1
|
CCnccCl)cC=O)NCCC[C@@]O)CNcccO)ncn6))))))))C6)))))))n5
|
[C][C][N][C][=C][Branch1][C][Cl][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][O][Branch1][=C][C][N][C][=C][C][Branch1][C][O][=N][C][=N][Ring1][#Branch1][C][Ring1][S][=N][Ring2][Ring1][Branch2]
|
N14CCC[C@]9(O)C1.n18cc(Cl)c7n1.c16cc(O)ncn1.C47=O.CC8.C59.N56
|
Cc1cc(CCCC(=O)N2CCO[C@@H]([C@H](C)NC(=O)c3ccc(CO)s3)C2)on1
|
CcccCCCC=O)NCCO[C@@H][C@H]C)NC=O)ccccCO))s5))))))))C6))))))))))on5
|
[C][C][C][=C][Branch2][Ring2][Branch2][C][C][C][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][Branch1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][O][S][Ring1][#Branch1][C][Ring2][Ring1][C][O][N][=Ring2][Ring1][N]
|
N14CCO[C@@H]8C1.Cc1cc9on1.C9CCC4=O.c17ccc%10s1.[C@@H]68C.C57=O.N56.C%10O
|
OC1(c2cn(Cc3c(Cl)cccc3Cl)nn2)CCOC1
|
OCccnCccCl)cccc6Cl))))))))nn5)))))CCOC5
|
[O][C][Branch2][Ring1][#Branch1][C][=C][N][Branch1][=C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][N][=N][Ring1][=C][C][C][O][C][Ring2][Ring1][Ring1]
|
c15c(Cl)cccc1Cl.OC16CCOC1.c16cn4nn1.C45
|
Cn1cnnc1CCC(=O)NC1CN(C(=O)C(F)(F)C2(O)CCCC2)C1
|
Cncnnc5CCC=O)NCCNC=O)CF)F)CO)CCCC5)))))))C4
|
[C][N][C][=N][N][=C][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][O][C][C][C][C][Ring1][=Branch1][C][Ring1][#C]
|
Cn1cnnc16.C4(=O)C7(F)F.C17(O)CCCC1.C6CC3=O.C15CN4C1.N35
|
CCCCCC(=O)NCC(=O)N1CCC[C@@H]2CN(C(=O)c3c[nH]nc3F)CC[C@H]21
|
CCCCCC=O)NCC=O)NCCC[C@@H]CNC=O)cc[nH]nc5F)))))))CC[C@H]6%10
|
[C][C][C][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][F][C][C][C@H1][Ring1][=C][Ring2][Ring1][C]
|
N15CCC[C@@H]2CN6CC[C@H]21.CCCCCC4=O.c18c[nH]nc1F.C7C5=O.C68=O.N47
|
CC1(C)[C@H](NC(=O)c2nccs2)CCN1C(=O)CC1CC1
|
CCC)[C@H]NC=O)cnccs5)))))))CCN5C=O)CCCC3
|
[C][C][Branch1][C][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=N][C][=C][S][Ring1][Branch1][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring1]
|
CC1(C)[C@H]5CCN14.c16nccs1.C4(=O)C7.C36=O.C17CC1.N35
|
C[C@@]1(C(=O)N2CC[S+]([O-])CC2)CCCN(c2ncc3c(n2)NC(=O)C3)C1
|
C[C@@]C=O)NCC[S+][O-])CC6)))))))CCCNcncccn6)NC=O)C5))))))))C6
|
[C][C@@][Branch1][S][C][=Branch1][C][=O][N][C][C][S+1][Branch1][C][O-1][C][C][Ring1][#Branch1][C][C][C][N][Branch2][Ring1][Ring1][C][=N][C][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring2][Ring1][=Branch2]
|
c15ncc2c(n1)NC(=O)C2.C[C@@]16CCCN5C1.N14CC[S+]([O-])CC1.C46=O
|
CC(=O)C(=O)N1C[C@@]2(CNC(=O)C3([C@H]4CCCO4)CCC3)C[C@H]1CO2
|
CC=O)C=O)NC[C@@]CNC=O)C[C@H]CCCO5)))))CCC4)))))))C[C@H]5CO5
|
[C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C@@][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][C@H1][C][C][C][O][Ring1][Branch1][C][C][C][Ring1][=Branch2][C][C@H1][Ring2][Ring1][C][C][O][Ring2][Ring1][C]
|
N15C[C@@]29C[C@H]1CO2.CC(=O)C5=O.C18%10CCC1.[C@H]1%10CCCO1.C68=O.C79.N67
|
CC[C@H](C)CCCC(=O)NCCC1(NC(=O)c2ccc(Cl)c(C)c2)CCOCC1
|
CC[C@H]C)CCCC=O)NCCCNC=O)ccccCl)cC)c6))))))))CCOCC6
|
[C][C][C@H1][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][C][=C][Ring1][Branch2][C][C][O][C][C][Ring1][P]
|
CC[C@H](C)CCCC3=O.c17ccc(Cl)c(C)c1.C168CCOCC1.C5C8.C47=O.N35.N46
|
O=C(O)C[C@@H]1CO[C@@H](CN[C@@H](CF)C2CCOCC2)C1
|
O=CO)C[C@@H]CO[C@@H]CN[C@@H]CF))CCCOCC6)))))))))C5
|
[O][=C][Branch1][C][O][C][C@@H1][C][O][C@@H1][Branch1][S][C][N][C@@H1][Branch1][Ring1][C][F][C][C][C][O][C][C][Ring1][=Branch1][C][Ring1][S]
|
[C@@H]16CO[C@@H]5C1.C17CCOCC1.O=C(O)C6.[C@@H]47CF.C35.N34
|
CO[C@]1(C(F)(F)F)C[C@H](C(=O)N2CCN(C(=O)COC(C)=O)C[C@@H]2CF)C1
|
CO[C@]CF)F)F))C[C@H]C=O)NCCNC=O)COCC)=O)))))C[C@@H]6CF)))))))))C4
|
[C][O][C@][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][N][Branch1][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][=O][C][C@@H1][Ring1][=N][C][F][C][Ring2][Ring1][=Branch2]
|
N14CCN5C[C@@H]19.[C@]16%10C[C@@H]8C1.C%10(F)(F)F.C5(=O)C7.C48=O.C3(C)=O.CO6.O37.C9F
|
CCCCCC(=O)N1CC[C@H](CC)C[C@@H]1C(=O)N[C@H](C)CCC1CC1
|
CCCCCC=O)NCC[C@H]CC))C[C@@H]6C=O)N[C@H]C)CCCCC3
|
[C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][Ring1][C][C][C][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][C][C][Ring1][Ring1]
|
N12CC[C@H]6C[C@@H]15.CCCCCC2=O.[C@@H]4(C)CC7.C35=O.C17CC1.C6C.N34
|
CCCCCOCC(=O)N1C[C@H](O)[C@H](NC(=O)c2cc(O)nc(CC(C)C)c2)C1
|
CCCCCOCC=O)NC[C@H]O)[C@H]NC=O)cccO)ncCCC)C)))c6))))))))C5
|
[C][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][#Branch1][C][C][Branch1][C][C][C][=C][Ring1][O][C][Ring2][Ring1][Ring2]
|
c18cc9nc(O)c1.N13C[C@@H]7[C@@H](O)C1.CCCCC5.C6C3=O.C9C(C)C.C48=O.O56.N47
|
CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NC(=O)NC[C@](C)(O)C(C)(C)O)nn1
|
CCC)O)ccn[C@@H]CCCC[C@@H]6NC=O)NC[C@]C)O)CC)C)O)))))))))))))nn5
|
[C][C][Branch1][C][C][Branch1][C][O][C][=C][N][Branch2][Ring1][#C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][O][N][=N][Ring2][Ring1][#Branch1]
|
C5[C@](C)(O)C(C)(C)O.[C@@H]18CCCC[C@@H]16.c17cn8nn1.CC7(C)O.C34=O.N36.N45
|
CCC(=CC(=O)NC1CCC(C)(NC(=O)[C@@H]2C[C@H](F)CN2C)CC1)CC
|
CCC=CC=O)NCCCCC)NC=O)[C@@H]C[C@H]F)CN5C))))))))CC6)))))))))CC
|
[C][C][C][=Branch2][Ring2][Ring2][=C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][C][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][C][C][Ring1][P][C][C]
|
C16CCC5(C)CC1.[C@@H]17C[C@H](F)CN1C.CCC=8CC.C=8C3=O.C47=O.N36.N45
|
Cc1nc(C2CN(C(=O)[C@H]3CC=CC[C@H]3NC(=O)C[C@H]3CC(=O)NC3=O)C2)no1
|
CcncCCNC=O)[C@H]CC=CC[C@H]6NC=O)C[C@H]CC=O)NC5=O))))))))))))))))C4))))no5
|
[C][C][=N][C][Branch2][Ring2][Branch2][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C@H1][C][C][=C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C@H1][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][Ring2][Ring1][#Branch1][=N][O][Ring2][Ring1][N]
|
[C@H]17CC=CC[C@H]16.[C@H]18CC(=O)NC1=O.Cc1nc9no1.C19CN4C1.C5(=O)C8.C47=O.N56
|
CC1(O)CCC(C(=O)N[C@H]2CCCN(C(=O)C=Cc3ccccc3)C2)CC1
|
CCO)CCCC=O)N[C@H]CCCNC=O)C=Ccccccc6)))))))))C6))))))))CC6
|
[C][C][Branch1][C][O][C][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][S][C][C][Ring2][Ring1][#Branch2]
|
CC1(O)CCC7CC1.[C@H]16CCCN5C1.C=8c1ccccc1.C5(=O)C=8.C47=O.N46
|
C[C@@H](CNC(=O)c1cscn1)NC(=O)c1nccc2c[nH]nc12
|
C[C@@H]CNC=O)ccscn5))))))))NC=O)cncccc[nH]nc95
|
[C][C@@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][=C][S][C][=N][Ring1][Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][NH1][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
c18nccc2c[nH]nc12.c17cscn1.C[C@H]5C6.C37=O.C48=O.N36.N45
|
CCN(C)C[C@@H](C)CNC(=O)[C@]1(C)CCCN(Cc2cc(C)c(Br)s2)C1
|
CCNC)C[C@@H]C)CNC=O)[C@]C)CCCNCcccC)cBr)s5))))))C6
|
[C][C][N][Branch1][C][C][C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][N][Branch1][#C][C][C][=C][C][Branch1][C][C][=C][Branch1][C][Br][S][Ring1][#Branch1][C][Ring1][#C]
|
[C@@]18(C)CCCN7C1.c19cc(C)c(Br)s1.C5[C@@H](C)C6.N45C.C38=O.CC4.N36.C79
|
Cn1nnnc1[C@@]1(NCCCO)CC[C@H]2CC[C@@H](C1)N2Cc1ccccc1
|
Cnnnnc5[C@@]NCCCO)))))CC[C@H]CC[C@@H]C8)N5Ccccccc6
|
[C][N][N][=N][N][=C][Ring1][Branch1][C@@][Branch1][=Branch1][N][C][C][C][O][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][=N][N][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
[C@@]137CC[C@H]2CC[C@@H](C1)N25.Cn1nnnc17.c16ccccc1.C4CCO.N34.C56
|
CCN(CC(C)(C)CNC(=O)c1ccc(OC)cc1N)C(=O)CCC[C@H]1C[C@@H]1C
|
CCNCCC)C)CNC=O)ccccOC))cc6N))))))))))))C=O)CCC[C@H]C[C@@H]3C
|
[C][C][N][Branch2][Ring1][N][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][C][C@H1][C][C@@H1][Ring1][Ring1][C]
|
c18ccc4cc1N.C6C(C)(C)C7.C3(=O)CCC9.[C@H]19C[C@@H]1C.N356.C28=O.CC5.N27.O4C
|
Cn1cc(-n2cc(C34CC(CN3C(=O)c3ccc(Br)c(F)c3F)C4)nn2)cn1
|
Cncc-nccCCCCN5C=O)ccccBr)cF)c6F))))))))))C4))))nn5)))))cn5
|
[C][N][C][=C][Branch2][Ring2][N][N][C][=C][Branch2][Ring1][P][C][C][C][Branch2][Ring1][Branch2][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][F][=C][Ring1][Branch2][F][C][Ring1][P][N][=N][Ring2][Ring1][=Branch1][C][=N][Ring2][Ring1][O]
|
c16ccc(Br)c(F)c1F.C128CC(CN15)C2.Cn1cc7cn1.n17cc8nn1.C56=O
|
O=C(CC(=O)N1CCCC[C@H]1CNC(=O)[C@@H]1CCCOCC1)NCC(F)(F)F
|
O=CCC=O)NCCCC[C@H]6CNC=O)[C@@H]CCCOCC7))))))))))))))))))NCCF)F)F
|
[O][=C][Branch2][Ring1][=N][C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][O][C][C][Ring1][#Branch1][N][C][C][Branch1][C][F][Branch1][C][F][F]
|
N13CCCC[C@H]18.[C@@H]17CCCOCC1.O=C2CC3=O.C6C(F)(F)F.C47=O.C58.N45.N26
|
C=CC[C@H](C)C(=O)N1CCC2(CC[C@H]2N2CCC(CN(C)C)CC2)CC1
|
C=CC[C@H]C)C=O)NCCCCC[C@H]4NCCCCNC)C)))CC6)))))))))CC6
|
[C][=C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][C][C][C@H1][Ring1][Ring2][N][C][C][C][Branch1][#Branch1][C][N][Branch1][C][C][C][C][C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring1]
|
N13CCC2(CC[C@H]25)CC1.C=CC[C@H](C)C3=O.N15CCC6CC1.N4(C)C.C46
|
C#C[C@]1(O)CCCN(C(=O)[C@H](CCNC(=O)C(C)(C)CC(C)(C)C)OC)C1
|
C#C[C@]O)CCCNC=O)[C@H]CCNC=O)CC)C)CCC)C)C))))))))OC))))C6
|
[C][#C][C@][Branch1][C][O][C][C][C][N][Branch2][Ring2][C][C][=Branch1][C][=O][C@H1][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][O][C][C][Ring2][Ring1][=Branch2]
|
C3(=O)C(C)(C)CC(C)(C)C.C#C[C@]1(O)CCCN2C1.C2(=O)[C@@H]4CC5.N35.O4C
|
CCCc1cc(C(=O)N2CCC[C@H]2CNC(=O)C[C@@H](O)CC[C@@H](C)CC)no1
|
CCCcccC=O)NCCC[C@H]5CNC=O)C[C@@H]O)CC[C@@H]C)CC))))))))))))))))no5
|
[C][C][C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][C][C@@H1][Branch1][C][C][C][C][=N][O][Ring2][Ring1][=Branch2]
|
C4(=O)C[C@@H](O)CC[C@@H](C)CC.c18cc6no1.N13CCC[C@H]17.CCC8.C36=O.C57.N45
|
C[C@@H]1C[C@@H]1C(=O)NCC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NC(=O)Cc1ccc2[nH]ccc2c1
|
C[C@@H]C[C@@H]3C=O)NCC=O)NC[C@@H]C[C@H]5[C@@H]4NC=O)Ccccc[nH]ccc5c9
|
[C][C@@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Ring1][Branch1][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][=C][C][=C][NH1][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2]
|
c19ccc2[nH]ccc2c1.N14C[C@@H]2C[C@H]1[C@@H]27.C[C@@H]1C[C@@H]18.C6C4=O.C5(=O)C9.C38=O.N36.N57
|
Cc1nc(-c2cc3cccc(C)c3s2)n(-c2ccnnc2)n1
|
Ccnc-cccccccC)c6s9)))))))))n-cccnnc6))))))n5
|
[C][C][N][=C][Branch1][P][C][=C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][N][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][N][=Ring2][Ring1][Branch1]
|
c15cc2cccc(C)c2s1.Cc1nc5n4n1.c14ccnnc1
|
CC=C(CC)C(=O)N1CCN([C@@H]2CCCN(C(=O)[C@H](O)[C@H](C)CC)C2)CC1
|
CC=CCC))C=O)NCCN[C@@H]CCCNC=O)[C@H]O)[C@H]C)CC)))))C6))))))CC6
|
[C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch2][C@@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][C][C][Ring1][=C][C][C][Ring2][Ring1][Ring2]
|
C4(=O)[C@H](O)[C@H](C)CC.N13CCN5CC1.[C@@H]15CCCN4C1.C=6(CC)C3=O.CC=6
|
Cn1ccc2nc(Nc3cnc(F)cc3C(=O)Nc3cc(Cl)cc(Br)c3)ncc21
|
CncccncNccncF)cc6C=O)NcccCl)ccBr)c6)))))))))))))))ncc69
|
[C][N][C][=C][C][=N][C][Branch2][Ring1][S][N][C][=C][N][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Br][=C][Ring1][Branch2][=N][C][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][N]
|
Cn1ccc2nc5ncc21.c16cnc(F)cc18.c17cc(Cl)cc(Br)c1.C48=O.N56.N47
|
CCc1ccc(C(=O)N2CCC([C@@H](CO)NC(=O)c3cc(Cl)n[nH]3)CC2)c(O)c1
|
CCccccC=O)NCCC[C@@H]CO))NC=O)cccCl)n[nH]5))))))))CC6)))))))cO)c6
|
[C][C][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][NH1][Ring1][=Branch1][C][C][Ring2][Ring1][C][C][Branch1][C][O][=C][Ring2][Ring1][O]
|
c1%10ccc8c(O)c1.N14CCC9CC1.c17cc(Cl)n[nH]1.[C@H]69CO.C48=O.C57=O.CC%10.N56
|
Cc1coc(C(=O)N2CC3(CCN(C(=O)c4csc(O)n4)CC3)C2)c1
|
CccocC=O)NCCCCNC=O)ccscO)n5))))))CC6)))))C4)))))c5
|
[C][C][=C][O][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][O][=N][Ring1][=Branch1][C][C][Ring1][=C][C][Ring1][P][=C][Ring2][Ring1][Branch2]
|
N15CC2(CCN6CC2)C1.Cc1coc7c1.c18csc(O)n1.C57=O.C68=O
|
C[C@@H]1[C@@H](C(=O)N[C@@H]2CCNC23CC3)CC1(F)F
|
C[C@@H][C@@H]C=O)N[C@@H]CCNC5CC3)))))))))CC4F)F
|
[C][C@@H1][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C@@H1][C][C][N][C][Ring1][Branch1][C][C][Ring1][Ring1][C][C][Ring1][=C][Branch1][C][F][F]
|
C[C@@H]1[C@@H]6CC1(F)F.[C@@H]15CCNC12CC2.C46=O.N45
|
C=CC1(CC(=O)N[C@@H](C)c2nnc(O)o2)CN(C(=O)C2=C[C@H]3C=C[C@@H](C2)C3)C1
|
C=CCCC=O)N[C@@H]C)cnncO)o5)))))))))CNC=O)C=C[C@H]C=C[C@@H]C7)C5))))))))C4
|
[C][=C][C][Branch2][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=N][N][=C][Branch1][C][O][O][Ring1][=Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C@H1][C][=C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
C5(=O)C1=C[C@H]2C=C[C@@H](C1)C2.C=CC18CN5C1.c17nnc(O)o1.C8C4=O.[C@@H]67C.N46
|
CCCCS(=O)(=O)N1C[C@H]2C[C@@]2(C(=O)Nc2ccc(I)cc2C(F)(F)F)C1
|
CCCCS=O)=O)NC[C@H]C[C@@]3C=O)NccccI)cc6CF)F)F))))))))))C6
|
[C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@H1][C][C@@][Ring1][Ring1][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][Ring2]
|
c15ccc(I)cc17.CCCCS4(=O)=O.N14C[C@H]2C[C@@]26C1.C7(F)(F)F.C36=O.N35
|
CCC[C@@H](NC(=O)c1nccnc1N)C(=O)N[C@@H]1CCCn2ccnc21
|
CCC[C@@H]NC=O)cnccnc6N)))))))))C=O)N[C@@H]CCCnccnc59
|
[C][C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=N][C][=C][N][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][C][=C][N][=C][Ring1][Branch1][Ring1][=Branch2]
|
N4[C@@H]1CCCn2ccnc21.CCC[C@@H]5C4=O.c16nccnc1N.C36=O.N35
|
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