SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
COCCO[C@H](C)C(=O)NC[C@H](CC(C)C)NC(=O)c1c(Cl)ccc(OC)c1N
|
COCCO[C@H]C)C=O)NC[C@H]CCC)C)))NC=O)ccCl)cccOC))c6N
|
[C][O][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2][N]
|
c1%10c(Cl)ccc7c1N.C8[C@@H]9CC(C)C.[C@@H]6(C)C2=O.C4C5.C3%10=O.CO4.O56.N28.N39.O7C
|
COC(=O)c1nc(NC(=O)[C@H]2C[C@H]3C[C@@H]3N2Cc2ccccc2N(C)C)sc1Br
|
COC=O)cncNC=O)[C@H]C[C@H]C[C@@H]3N6Ccccccc6NC)C)))))))))))))))))sc5Br
|
[C][O][C][=Branch1][C][=O][C][N][=C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C@H1][C][C@H1][C][C@@H1][Ring1][Ring1][N][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][S][C][=Ring2][Ring1][Branch2][Br]
|
c1%10nc7sc1Br.[C@H]19C[C@H]2C[C@@H]2N16.c1%11ccccc18.C4%10=O.C59=O.N8(C)C.CO4.N57.C6%11
|
O=C(N[C@H]1CCCN(C(=O)c2cnc3occc3c2)C1)C(F)=CC1CCCCC1
|
O=CN[C@H]CCCNC=O)ccncoccc5c9))))))))))C6)))))))CF)=CCCCCCC6
|
[O][=C][Branch2][Ring1][=C][N][C@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][N][=C][O][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring1][P][C][Branch1][C][F][=C][C][C][C][C][C][C][Ring1][=Branch1]
|
c17cnc2occc2c1.[C@H]16CCCN5C1.C=8C1CCCCC1.O=C4C=8F.C57=O.N46
|
O=C([C@@H]1CCCN(Cc2ccc(Cl)cc2Br)CC1)N1C[C@@H]2COC[C@H]2C1
|
O=C[C@@H]CCCNCccccCl)cc6Br))))))))CC7)))))))NC[C@@H]COC[C@H]5C8
|
[O][=C][Branch2][Ring1][=Branch2][C@@H1][C][C][C][N][Branch1][=C][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Br][C][C][Ring1][S][N][C][C@@H1][C][O][C][C@H1][Ring1][Branch1][C][Ring1][Branch2]
|
[C@@H]15CCCN4CC1.c16ccc(Cl)cc1Br.N13C[C@@H]2COC[C@H]2C1.O=C35.C46
|
C#CCOCC(=O)N[C@H]1CC=C(C(=O)NC[C@]2(F)C[C@H](CO)C2)C1
|
C#CCOCC=O)N[C@H]CC=CC=O)NC[C@]F)C[C@H]CO))C4)))))))C5
|
[C][#C][C][O][C][C][=Branch1][C][=O][N][C@H1][C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@H1][Branch1][Ring1][C][O][C][Ring1][#Branch1][C][Ring1][S]
|
[C@H]18CC=C(C4=O)C1.[C@]19(F)C[C@@H]%10C1.C6C3=O.C#CC5.O56.N38.N47.C79.C%10O
|
CC[C@H](C)C(=O)N1CC[C@@H](CNC(=O)Cc2ccc(F)cc2)C12CC2
|
CC[C@H]C)C=O)NCC[C@@H]CNC=O)CccccF)cc6))))))))))C5CC3
|
[C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][P][C][C][Ring1][Ring1]
|
N13CC[C@@H]6C12CC2.c17ccc(F)cc1.CC[C@H](C)C3=O.C4(=O)C7.C56.N45
|
Cn1ccc(-c2cccc(CC(=O)NC[C@H]3CCCc4ccccc43)n2)c1
|
Cnccc-cccccCC=O)NC[C@H]CCCcccccc6%10))))))))))))))n6))))))c5
|
[C][N][C][=C][C][Branch2][Ring2][C][C][=C][C][=C][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=N][Ring2][Ring1][Branch1][=C][Ring2][Ring1][#Branch2]
|
C6[C@H]1CCCc2ccccc21.c18cccc7n1.Cn1ccc8c1.C7C5=O.N56
|
CC[C@H](C(=O)N1CC2(CC(NC(=O)c3ccc([N+](=O)[O-])o3)C2)C1)C(C)(C)CC
|
CC[C@H]C=O)NCCCCNC=O)cccc[N+]=O)[O-]))o5)))))))C4)))C4)))))CC)C)CC
|
[C][C][C@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][N][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][O][Ring1][Branch2][C][Ring1][#C][C][Ring2][Ring1][C][C][Branch1][C][C][Branch1][C][C][C][C]
|
CC[C@H](C4=O)C(C)(C)CC.N14CC2(CC6C2)C1.c17ccc([N+](=O)[O-])o1.C57=O.N56
|
COC(=O)[C@H]1[C@@H](N)CCCN1C(=O)C(=O)N1CCC(c2c[nH]nc2C)CC1
|
COC=O)[C@H][C@@H]N)CCCN6C=O)C=O)NCCCcc[nH]nc5C))))))CC6
|
[C][O][C][=Branch1][C][=O][C@H1][C@@H1][Branch1][C][N][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Branch1][=Branch2][C][=C][NH1][N][=C][Ring1][Branch1][C][C][C][Ring1][N]
|
[C@H]16[C@@H](N)CCCN14.N15CCC7CC1.c17c[nH]nc1C.C4(=O)C5=O.C36=O.CO3
|
CSc1ccccc1NC(=O)[C@@H]1CC[C@H](NC(=O)[C@H](C)C2CCC2)C1
|
CScccccc6NC=O)[C@@H]CC[C@H]NC=O)[C@H]C)CCCC4)))))))C5
|
[C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][C][C][Ring1][Ring2][C][Ring1][=C]
|
c19ccccc15.[C@@H]17CC[C@H]6C1.C4(=O)[C@@H]8C.C18CCC1.C37=O.CS9.N35.N46
|
COC[C@H](C)C(=O)N1CCC[C@@]12CCCN(C(=O)c1cccc(NC(C)C)c1)C2
|
COC[C@H]C)C=O)NCCC[C@@]5CCCNC=O)cccccNCC)C)))c6)))))))C6
|
[C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@][Ring1][Branch1][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#Branch1][N][C][Branch1][C][C][C][=C][Ring1][#Branch2][C][Ring2][Ring1][C]
|
N13CCC[C@@]12CCCN4C2.c18cccc7c1.C5[C@H](C)C3=O.C48=O.C6(C)C.CO5.N67
|
O=C(Nc1ccc(S(=O)(=O)NC[C@H]2CCCS2)cc1)C(F)(F)F
|
O=CNccccS=O)=O)NC[C@H]CCCS5))))))))cc6)))))))CF)F)F
|
[O][=C][Branch2][Ring1][N][N][C][=C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@H1][C][C][C][S][Ring1][Branch1][C][=C][Ring1][S][C][Branch1][C][F][Branch1][C][F][F]
|
c16ccc(S5(=O)=O)cc1.O=C3C(F)(F)F.[C@H]17CCCS1.N36.N45.C47
|
CCOC(=O)NCC(=O)NC[C@@H](CO)NC(=O)c1cnc(OC)s1
|
CCOC=O)NCC=O)NC[C@@H]CO))NC=O)ccncOC))s5
|
[C][C][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring1][O][C][S][Ring1][#Branch1]
|
c13cnc8s1.C%10[C@H]%11CO.C9C5=O.C24=O.C63=O.CC7.O27.N49.N5%10.N6%11.O8C
|
CCNC(=O)c1cc2nc(-c3cc(F)ccc3CNC)ccc2[nH]1
|
CCNC=O)cccnc-cccF)ccc6CNC)))))))))ccc6[nH]9
|
[C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][#C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][N][C][=C][C][=C][Ring1][S][NH1][Ring2][Ring1][Ring1]
|
c17cc2nc9ccc2[nH]1.c19cc(F)ccc18.C47=O.CC5.N45.C68.N6C
|
CC(C)c1ccoc1C(=O)N[C@@H]1CCOC[C@@H]1NC(=O)CCC(F)(F)F
|
CCC)cccoc5C=O)N[C@@H]CCOC[C@@H]6NC=O)CCCF)F)F
|
[C][C][Branch1][C][C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][O][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)CCC(F)(F)F.[C@@H]14CCOC[C@@H]15.c17ccoc16.CC7C.C26=O.N24.N35
|
CCCN1C[C@H](C(=O)N2C[C@H](NC(=O)CNC=O)CC2(C)C)CC1=O
|
CCCNC[C@H]C=O)NC[C@H]NC=O)CNC=O))))))CC5C)C)))))))CC5=O
|
[C][C][C][N][C][C@H1][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C@H1][Branch1][#Branch2][N][C][=Branch1][C][=O][C][N][C][=O][C][C][Ring1][N][Branch1][C][C][C][C][C][Ring2][Ring1][Branch1][=O]
|
N13C[C@H]6CC1(C)C.N18C[C@H]7CC1=O.C4(=O)C5.CCC8.C37=O.N5C=O.N46
|
CN1CCN(C(=O)CC2(O)CCCCC2)[C@H](CNC(=O)COC2CCOCC2)C1
|
CNCCNC=O)CCO)CCCCC6))))))))[C@H]CNC=O)COCCCOCC6)))))))))))C6
|
[C][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][C][C][C][Ring1][#Branch1][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][O][C][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][N]
|
CN1CCN3[C@H]8C1.C19(O)CCCCC1.C16CCOCC1.C3(=O)C9.C4(=O)C5.C78.N47.O56
|
CCC[C@@H](O)CN(C)C(=O)[C@@H]1C[C@H](F)CN1C(=O)CC[C@@H]1CCCN1C
|
CCC[C@@H]O)CNC)C=O)[C@@H]C[C@H]F)CN5C=O)CC[C@@H]CCCN5C
|
[C][C][C][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C]
|
[C@@H]15C[C@H](F)CN13.CCC[C@@H](O)C4.[C@@H]16CCCN1C.C3(=O)CC6.N24C.C25=O
|
O=C(CN1C(=O)CCC1=O)N[C@@H]1C[C@H]2CN(C(=O)c3cnn4c3CCCN4)C[C@@H]21
|
O=CCNC=O)CCC5=O)))))))N[C@@H]C[C@H]CNC=O)ccnnc5CCCN6))))))))))C[C@@H]57
|
[O][=C][Branch1][=N][C][N][C][=Branch1][C][=O][C][C][C][Ring1][=Branch1][=O][N][C@@H1][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][C@@H1][Ring1][S][Ring2][Ring1][C]
|
c18cnn2c1CCCN2.[C@@H]17C[C@H]2CN6C[C@@H]21.N19C(=O)CCC1=O.O=C5C9.C68=O.N57
|
CCCC[C@H](O)CC(=O)N1CC[C@@H](CNC(=O)COC(C)C)C(F)(F)CC1
|
CCCC[C@H]O)CC=O)NCC[C@@H]CNC=O)COCC)C)))))))CF)F)CC7
|
[C][C][C][C][C@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring2][Ring1][C]
|
N12CC[C@@H]7C(F)(F)CC1.CCCC[C@H](O)CC2=O.C3(=O)C4.C5(C)C.C67.N36.O45
|
C[C@H]1C[C@H](NC(=O)C23CC(CO)(C2)C3)CN1C(=O)c1cc(N)ccn1
|
C[C@H]C[C@H]NC=O)CCCCO))C4)C4))))))CN5C=O)cccN)ccn6
|
[C][C@H1][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][Ring1][C][O][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][#Branch1][C][N][Ring1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][N][=C][C][=N][Ring1][#Branch1]
|
C[C@H]1C[C@H]6CN15.c17cc(N)ccn1.C128CC9(C1)C2.C48=O.C57=O.N46.C9O
|
Cc1ccc(C#N)cc1C(=O)N1CC(C)(C(=O)NCc2ncc(CO)o2)C1
|
CccccC#N))cc6C=O)NCCC)C=O)NCcnccCO))o5))))))))C4
|
[C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=N][C][=C][Branch1][Ring1][C][O][O][Ring1][#Branch1][C][Ring1][S]
|
Cc1ccc(C#N)cc17.N13CC6(C)C1.c18ncc9o1.C37=O.C46=O.N45.C58.C9O
|
COc1ccc(F)cc1C(=O)NC12CCC(NCc3ccc(Cl)nn3)(CC1)C2
|
COccccF)cc6C=O)NCCCCNCccccCl)nn6))))))))CC6))C5
|
[C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][=C][N][C][C][=C][C][=C][Branch1][C][Cl][N][=N][Ring1][#Branch1][Branch1][Branch1][C][C][Ring1][#C][C][Ring1][S]
|
c15ccc(F)cc19.C127CCC8(CC1)C2.c1%10ccc(Cl)nn1.C49=O.CO5.N47.N68.C6%10
|
CCNc1cccc(C(=O)N[C@@H](C)CCCNC(=O)C[C@@H](C)CC)c1
|
CCNcccccC=O)N[C@@H]C)CCCNC=O)C[C@@H]C)CC))))))))))))c6
|
[C][C][N][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][C][=C][Ring2][Ring1][=Branch1]
|
c17cccc8c1.C3(=O)C[C@@H](C)CC.[C@H]5(C)CCC6.C28=O.CC4.N47.N25.N36
|
CC(=O)N(C)[C@H](C)C(=O)N1CCCN(C(=O)C2(c3ccccc3)CCC2)CC1
|
CC=O)NC)[C@H]C)C=O)NCCCNC=O)Ccccccc6))))))CCC4)))))CC7
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring1]
|
N15CCCN6CC1.c19ccccc1.[C@@H]7(C)C5=O.C189CCC1.CC4=O.N47C.C68=O
|
CCCCC(CCCC)C(=O)N[C@@H]1C[C@@H]2C[C@@H](NC(=O)C[C@@H](O)C(C)C)C[C@@H]21
|
CCCCCCCCC))))C=O)N[C@@H]C[C@@H]C[C@@H]NC=O)C[C@@H]O)CC)C))))))C[C@@H]57
|
[C][C][C][C][C][Branch1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][Branch1][C][C][C][C][C@@H1][Ring1][=C][Ring1][S]
|
CCCCC(CCCC)C3=O.[C@@H]15C[C@@H]2C[C@@H]6C[C@@H]21.C4(=O)C[C@@H](O)C(C)C.N35.N46
|
Cc1nc(C(=O)N2CC(N(C)Cc3ccc(Cl)nc3)C2)co1
|
CcncC=O)NCCNC)CccccCl)nc6))))))))C4)))))co5
|
[C][C][=N][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][Branch1][P][N][Branch1][C][C][C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][C][Ring1][=C][=C][O][Ring2][Ring1][Branch1]
|
c18ccc(Cl)nc1.Cc1nc7co1.N14CC6C1.C47=O.N56C.C58
|
O=C(CN1CCOC1=O)N[C@@H](Cc1cc[nH]n1)C(=O)Nc1cccc([N+](=O)[O-])c1
|
O=CCNCCOC5=O)))))))N[C@@H]Cccc[nH]n5))))))C=O)Nccccc[N+]=O)[O-]))c6
|
[O][=C][Branch1][#Branch2][C][N][C][C][O][C][Ring1][Branch1][=O][N][C@@H1][Branch1][=Branch2][C][C][C][=C][NH1][N][=Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2]
|
c15cccc([N+](=O)[O-])c1.N16CCOC1=O.[C@H]4(C7)C3=O.c17cc[nH]n1.O=C2C6.N24.N35
|
COc1ccc(C(=O)N2CCC[C@@](O)(CNC(=O)c3cn(C)[nH]c3=N)C2)c(F)c1
|
COccccC=O)NCCC[C@@]O)CNC=O)ccnC)[nH]c5=N)))))))))C6)))))))cF)c6
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][O][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][NH1][C][Ring1][=Branch1][=N][C][Ring2][Ring1][C][C][Branch1][C][F][=C][Ring2][Ring1][O]
|
c16ccc8c(F)c1.N14CCC[C@]%10(O)C1.c19cn(C)[nH]c1=N.C48=O.C59=O.CO6.C7%10.N57
|
C[C@H]1C[C@@H](NC(=O)COCC2CCCC2)CN1C(=O)c1nc(Cl)c(=O)[nH]c1N
|
C[C@H]C[C@@H]NC=O)COCCCCCC5))))))))))CN5C=O)cncCl)c=O)[nH]c6N
|
[C][C@H1][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][O][C][C][C][C][C][C][Ring1][Branch1][C][N][Ring1][S][C][=Branch1][C][=O][C][N][=C][Branch1][C][Cl][C][=Branch1][C][=O][NH1][C][=Ring1][Branch2][N]
|
c18nc(Cl)c(=O)[nH]c1N.C[C@H]1C[C@@H]7CN14.C19CCCC1.C3(=O)C5.C48=O.N37.O56.C69
|
CN(C(=O)c1cnnc(Cl)c1)[C@@H]1CCN(c2ncnc(Cl)c2F)C1
|
CNC=O)ccnncCl)c6)))))))[C@@H]CCNcncncCl)c6F)))))))C5
|
[C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][C@@H1][C][C][N][Branch1][=N][C][=N][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][C][Ring1][=N]
|
c14ncnc(Cl)c1F.c16cnnc(Cl)c1.[C@@H]15CCN4C1.CN35.C36=O
|
C[C@H]1C[C@H](NC(=O)Cc2cn3ccsc3n2)CN(C(=O)CCC(C)(F)F)C1
|
C[C@H]C[C@H]NC=O)Cccnccsc5n8)))))))))))CNC=O)CCCC)F)F)))))C6
|
[C][C@H1][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][N][C][=C][S][C][Ring1][Branch1][=N][Ring1][Branch2][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][F][F][C][Ring2][Ring1][#Branch2]
|
C[C@H]1C[C@H]6CN5C1.c17cn2ccsc2n1.C5(=O)CCC(C)(F)F.C4(=O)C7.N46
|
CC[C@@]1(C(=O)NC2CCC(NC(=O)CN3CCCC3=O)CC2)CCOC1
|
CC[C@@]C=O)NCCCCNC=O)CNCCCC5=O)))))))))CC6))))))))CCOC5
|
[C][C][C@@][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][N][C][C][C][C][Ring1][Branch1][=O][C][C][Ring1][S][C][C][O][C][Ring2][Ring1][Branch2]
|
C16CCC7CC1.[C@@]18%10CCOC1.N19CCCC1=O.C5(=O)C9.C48=O.CC%10.N46.N57
|
Cc1coc(C)c1C(=O)N[C@H](C)C[C@H](C)N=c1cc(Cl)nc(C(C)C)[nH]1
|
CccocC)c5C=O)N[C@H]C)C[C@H]C)N=cccCl)ncCC)C))[nH]6
|
[C][C][=C][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][N][=C][C][=C][Branch1][C][Cl][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][NH1][Ring1][#Branch2]
|
[C@@H]3(C)C[C@H](C)N=c1cc(Cl)nc5[nH]1.Cc1coc(C)c14.C24=O.C5(C)C.N23
|
CCO[C@H](C)C(=O)N1CCC[C@@H]1[C@@H]1CCN(C(=O)c2ccc(F)c(OC)c2F)C1
|
CCO[C@H]C)C=O)NCCC[C@@H]5[C@@H]CCNC=O)ccccF)cOC))c6F))))))))C5
|
[C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C@@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2][F][C][Ring1][P]
|
c18ccc(F)c7c1F.N13CCC[C@@H]19.[C@@H]19CCN4C1.[C@@H]6(C)C3=O.C48=O.CC5.O56.O7C
|
Cc1csc2nc(CC(=O)Nc3ccc(F)cc3N3CCOCC3)cn12
|
CccscncCC=O)NccccF)cc6NCCOCC6)))))))))))))))cn85
|
[C][C][=C][S][C][=N][C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][C][C][O][C][C][Ring1][=Branch1][=C][N][Ring2][Ring1][=Branch2][Ring2][Ring1][=Branch1]
|
Cc1csc2nc7cn12.c15ccc(F)cc16.N16CCOCC1.C7C4=O.N45
|
CC[C@@H](C)c1nccc(N(C)CCOCCNC(=O)CCC[N+](=O)[O-])n1
|
CC[C@@H]C)cncccNC)CCOCCNC=O)CCC[N+]=O)[O-])))))))))))))n6
|
[C][C][C@@H1][Branch1][C][C][C][=N][C][=C][C][Branch2][Ring1][#Branch1][N][Branch1][C][C][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][C][N+1][=Branch1][C][=O][O-1][=N][Ring2][Ring1][=Branch1]
|
C2(=O)CCC[N+](=O)[O-].c18nccc7n1.CC[C@H]8C.N57C.C5C3.C4C6.O34.N26
|
CC(=O)c1ncccc1C(=O)NC[C@H]1CCCCN1C(=O)CC(C)(C)C1CC1
|
CC=O)cncccc6C=O)NC[C@H]CCCCN6C=O)CCC)C)CCC3
|
[C][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Ring1]
|
c15ncccc16.[C@H]17CCCCN13.C3(=O)CC8(C)C.CC5=O.C26=O.C18CC1.N24.C47
|
C[C@@H](NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)c1c[nH]c(=S)cn1)c1cc[nH]n1
|
C[C@@H]NC=O)[C@@H]C[C@@H]C[C@@H]3N6C=O)cc[nH]c=S)cn6)))))))))))))))ccc[nH]n5
|
[C][C@@H1][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=S][C][=N][Ring1][#Branch1][C][C][=C][NH1][N][=Ring1][Branch1]
|
[C@@H]16C[C@@H]2C[C@@H]2N14.c17c[nH]c(=S)cn1.c18cc[nH]n1.C[C@@H]58.C36=O.C47=O.N35
|
C[C@H](O)[C@@H](C)CNC(=O)C[C@@H]1CCCN(C(=O)CCCN=[N+]=[N-])C1
|
C[C@H]O)[C@@H]C)CNC=O)C[C@@H]CCCNC=O)CCCN=[N+]=[N-])))))))C6
|
[C][C@H1][Branch1][C][O][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][C][N][=N+1][=N-1][C][Ring1][=C]
|
C3(=O)CCCN=[N+]=[N-].[C@@H]15CCCN3C1.C[C@H](O)[C@@H](C)C4.C2(=O)C5.N24
|
CN(C(=O)C1(NC(N)=O)CC1)[C@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1
|
CNC=O)CNCN)=O)))CC3))))[C@H]CCCNC=O)cn[nH]cc5[N+]=O)[O-]))))))))CC7
|
[C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][C][Ring1][#Branch1][C@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][N+1][=Branch1][C][=O][O-1][C][C][Ring1][P]
|
[C@H]17CCCN5CC1.c18n[nH]cc1[N+](=O)[O-].C169CC1.CN37.C39=O.C4(N)=O.C58=O.N46
|
C[C@@H](CC(=O)N1C[C@H](N=[N+]=[N-])[C@H](NC(=O)c2nn(C)cc2Cl)C1)CC(F)(F)F
|
C[C@@H]CC=O)NC[C@H]N=[N+]=[N-])))[C@H]NC=O)cnnC)cc5Cl))))))))C5)))))))CCF)F)F
|
[C][C@@H1][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring2][N][=N+1][=N-1][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][Cl][C][Ring2][Ring1][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C[C@@H](CC3=O)CC(F)(F)F.N13C[C@@H]5[C@@H](N=[N+]=[N-])C1.c16nn(C)cc1Cl.C46=O.N45
|
C[C@@H]1CN(C(=O)C2=NO[C@H](c3ccccc3)C2)C[C@@H]1NCc1cc(I)ccc1F
|
C[C@@H]CNC=O)C=NO[C@H]cccccc6))))))C5))))))C[C@@H]5NCcccI)ccc6F
|
[C][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=N][O][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][C][C@@H1][Ring2][Ring1][C][N][C][C][=C][C][Branch1][C][I][=C][C][=C][Ring1][#Branch1][F]
|
C4(=O)C1=NO[C@H]8C1.c17cc(I)ccc1F.C[C@@H]1CN4C[C@@H]16.c18ccccc1.N56.C57
|
CSC[C@H](O)C(=O)N[C@@H]1CN(C(=O)c2ccc3c(c2C)CCC3)C[C@H]1C(F)(F)F
|
CSC[C@H]O)C=O)N[C@@H]CNC=O)cccccc6C))CCC5)))))))))C[C@H]5CF)F)F
|
[C][S][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][C][C][C][C][Ring1][#Branch1][C][C@H1][Ring1][P][C][Branch1][C][F][Branch1][C][F][F]
|
c18ccc2c(c1C)CCC2.[C@@H]17CN5C[C@H]19.C6[C@H](O)C4=O.C9(F)(F)F.C58=O.CS6.N47
|
C=C=C[C@H](C)C(=O)NC[C@H]1CCC[C@@H](CNC(=O)CCNC(=O)C=CCl)C1
|
C=C=C[C@H]C)C=O)NC[C@H]CCC[C@@H]CNC=O)CCNC=O)C=CCl))))))))))C6
|
[C][=C][=C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][=C][Cl][C][Ring2][Ring1][C]
|
C=C=C[C@H](C)C2=O.[C@H]18CCC[C@@H]9C1.C3(=O)CC7.C4(=O)C=CCl.N25.C58.C69.N36.N47
|
C=CCC1(NC(=O)[C@@H]2C[C@@]23CCOC3)CN(C(=O)c2ccnn(C)c2=O)C1
|
C=CCCNC=O)[C@@H]C[C@@]3CCOC5)))))))))CNC=O)cccnnC)c6=O))))))))C4
|
[C][=C][C][C][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C@@][Ring1][Ring1][C][C][O][C][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=N][N][Branch1][C][C][C][Ring1][#Branch1][=O][C][Ring2][Ring1][Branch2]
|
c18ccnn(C)c1=O.[C@@H]17C[C@@]12CCOC2.C169CN5C1.C=CC9.C47=O.C58=O.N46
|
Cc1ncc(Cl)cc1CN1C[C@H]2CCN(S(=O)(=O)c3ccc(F)cc3)[C@H]2C1
|
CcnccCl)cc6CNC[C@H]CCNS=O)=O)ccccF)cc6)))))))[C@H]5C8
|
[C][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][N][C][C@H1][C][C][N][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C@H1][Ring1][#C][C][Ring2][Ring1][C]
|
S5(=O)(=O)c1ccc(F)cc1.N14C[C@H]2CCN5[C@H]2C1.Cc1ncc(Cl)cc16.C46
|
NC(=O)C[C@H](NS(=O)(=O)c1ccc2[nH]c(=N[C@H]3C[C@@H]4C[C@@H]4C3)ccc2c1)C1CC1
|
NC=O)C[C@H]NS=O)=O)cccc[nH]c=N[C@H]C[C@@H]C[C@@H]3C6)))))))ccc6c%10))))))))))))CCC3
|
[N][C][=Branch1][C][=O][C][C@H1][Branch2][Ring2][Ring2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][NH1][C][=Branch1][N][=N][C@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][=C][C][Ring1][=N][=C][Ring1][P][C][C][C][Ring1][Ring1]
|
S6(=O)(=O)c1ccc2[nH]c(=N[C@H]3C[C@@H]4C[C@@H]4C3)ccc2c1.NC(=O)C[C@H]57.C17CC1.N56
|
C#C[C@@H]1CN(C(=O)[C@@H]2C=CCS2)CCN1C(=O)c1ccc(O)c(CC)c1
|
C#C[C@@H]CNC=O)[C@@H]C=CCS5))))))CCN6C=O)ccccO)cCC))c6
|
[C][#C][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][=C][C][S][Ring1][Branch1][C][C][N][Ring1][=N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][C][=C][Ring1][=Branch2]
|
C#C[C@@H]1CN3CCN14.c16ccc(O)c7c1.[C@@H]15C=CCS1.C35=O.C46=O.C7C
|
Cn1nc(C(=O)NCCCNC(=O)CO[C@@H]2CCCOC2)c(=O)c2ccccc21
|
CnncC=O)NCCCNC=O)CO[C@@H]CCCOC6)))))))))))))))c=O)cccccc6%10
|
[C][N][N][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][O][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N]
|
Cn1nc9c(=O)c2ccccc21.[C@@H]16CCCOC1.C7CC8.C4(=O)C5.C39=O.N37.N48.O56
|
CC[C@@H]1C(=O)NCCN1C(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccc3c(c2)CC3)C1
|
CC[C@@H]C=O)NCCN6C=O)C[C@H]CC[C@@H]NC=O)Ccccccc6)CC4))))))))))C5
|
[C][C][C@@H1][C][=Branch1][C][=O][N][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C@H1][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Ring1][Branch1][C][Ring1][P]
|
[C@@H]17C(=O)NCCN14.c19ccc2c(c1)CC2.[C@H]18CC[C@@H]6C1.C4(=O)C8.C5(=O)C9.CC7.N56
|
CC[C@@H](NC(N)=O)C(=O)NC1([C@H]2CCCN2C(=O)C(=O)c2ccc(Cl)s2)CC1
|
CC[C@@H]NCN)=O)))C=O)NC[C@H]CCCN5C=O)C=O)ccccCl)s5))))))))))))CC3
|
[C][C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C][Branch2][Ring1][#Branch2][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][C][C][Ring2][Ring1][C]
|
CC[C@@H]6C4=O.[C@H]19CCCN15.c18ccc(Cl)s1.C5(=O)C8=O.C179CC1.C3(N)=O.N36.N47
|
C[C@@H](CC(=O)N1C[C@@H](CC(=O)N(C)Cc2ncc[nH]2)C2(CC2)C1)c1ccco1
|
C[C@@H]CC=O)NC[C@@H]CC=O)NC)Ccncc[nH]5)))))))))CCC3))C5)))))))cccco5
|
[C][C@@H1][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=N][C][=C][NH1][Ring1][Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][C][C][=C][C][=C][O][Ring1][Branch1]
|
N13C[C@@H]8C2(CC2)C1.C[C@H]6CC3=O.c17ncc[nH]1.c16ccco1.C8C4=O.N45C.C57
|
COC(=O)CC(=O)N1CCO[C@@]2(CCCN(C(=O)c3cc(C)nn3C)C2)C1
|
COC=O)CC=O)NCCO[C@@]CCCNC=O)cccC)nn5C)))))))C6)))))C6
|
[C][O][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][O][C@@][Branch2][Ring1][=Branch2][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][N][Ring1][=Branch1][C][C][Ring1][#C][C][Ring2][Ring1][Ring2]
|
N15CCO[C@@]2(CCCN6C2)C1.c17cc(C)nn1C.C4(=O)CC5=O.C67=O.CO4
|
CCSCC(=O)NC[C@@H]1CC[C@@H](C)CN1C(=O)CC1=CCOCC1
|
CCSCC=O)NC[C@@H]CC[C@@H]C)CN6C=O)CC=CCOCC6
|
[C][C][S][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@H1][Branch1][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=C][C][O][C][C][Ring1][=Branch1]
|
C3(=O)CC1=CCOCC1.[C@@H]17CC[C@@H](C)CN13.C6C2=O.CC5.S56.N24.C47
|
COc1ccc([C@H](O)[C@H]2CCCN2c2ccc(P(C)(C)=O)cn2)cc1
|
COcccc[C@H]O)[C@H]CCCN5ccccPC)C)=O))cn6))))))))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring1][=C][C@H1][Branch1][C][O][C@H1][C][C][C][N][Ring1][Branch1][C][=C][C][=C][Branch1][=Branch2][P][Branch1][C][C][Branch1][C][C][=O][C][=N][Ring1][#Branch2][C][=C][Ring2][Ring1][#Branch1]
|
c14ccc(P(C)(C)=O)cn1.c13ccc6cc1.[C@H]15CCCN14.[C@@H]56O.CO3
|
O=C1C[C@@H](NC[C@H]2CC23CC3)CCN1Cc1ccccc1
|
O=CC[C@@H]NC[C@H]CC3CC3)))))))CCN6Ccccccc6
|
[O][=C][C][C@@H1][Branch1][N][N][C][C@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1][C][C][N][Ring1][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
O=C1C[C@@H]5CCN16.c18ccccc1.[C@H]17CC12CC2.N45.C47.C68
|
C=CCCC(=O)N(C)[C@@H]1CC[C@H]2CN(C(=O)c3cc(C4CC4)no3)C[C@H]21
|
C=CCCC=O)NC)[C@@H]CC[C@H]CNC=O)cccCCC3)))no5))))))C[C@H]58
|
[C][=C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2][C][C@H1][Ring1][#C][Ring2][Ring1][C]
|
[C@@H]17CC[C@H]2CN6C[C@H]21.C=CCCC5=O.c18cc9no1.N57C.C68=O.C19CC1
|
C[C@@H]1C[C@@H](CNC(=O)[C@]2(C)CCC(=O)N(C)C2)CCN1C(=O)C1=C(Cl)CCOC1
|
C[C@@H]C[C@@H]CNC=O)[C@]C)CCC=O)NC)C6)))))))))CCN6C=O)C=CCl)CCOC6
|
[C][C@@H1][C][C@@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][=Branch2][C][C][N][Ring2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][C][O][C][Ring1][#Branch1]
|
[C@@]16(C)CCC(=O)N(C)C1.C4(=O)C1=C(Cl)CCOC1.C[C@@H]1C[C@@H]7CCN14.C36=O.C57.N35
|
CC[C@](C)(O)C(=O)N[C@@H](CC(=O)NCc1cnccc1Cl)Cc1cccc(Br)c1
|
CC[C@]C)O)C=O)N[C@@H]CC=O)NCccnccc6Cl)))))))))))CcccccBr)c6
|
[C][C][C@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][C][=Branch1][C][=O][N][C][C][=C][N][=C][C][=C][Ring1][=Branch1][Cl][C][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1]
|
CC[C@](C)(O)C2=O.[C@@H]4(C7)CC3=O.c16cnccc1Cl.c17cccc(Br)c1.N24.N35.C56
|
CO[C@@H](C)CC(=O)NCCCCC1CN(C(=O)c2cc(O)nc(CC(C)C)c2)C1
|
CO[C@@H]C)CC=O)NCCCCCCNC=O)cccO)ncCCC)C)))c6)))))))C4
|
[C][O][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][#Branch1][C][C][Branch1][C][C][C][=C][Ring1][O][C][Ring1][P]
|
c17cc8nc(O)c1.[C@H]5(C)CC3=O.C6CCC9.C19CN4C1.C8C(C)C.C47=O.CO5.N36
|
[N-]=[N+]=NCCCCC(=O)N1C[C@H](C(=O)NCCC2CC2)CC12CCC2
|
[N-]=[N+]=NCCCCC=O)NC[C@H]C=O)NCCCCC3)))))))CC5CCC4
|
[N-1][=N+1][=N][C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Ring1][C][C][Ring1][=N][C][C][C][Ring1][Ring2]
|
[N-]=[N+]=NCCCCC3=O.N13C[C@H]6CC12CCC2.C46=O.C5C7.C17CC1.N45
|
C[C@H]1CC[C@H](CNC(=O)c2cn(CCO)nn2)CN1C(=O)c1cc2occc2s1
|
C[C@H]CC[C@H]CNC=O)ccnCCO)))nn5))))))))CN6C=O)cccoccc5s8
|
[C][C@H1][C][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][Ring2][C][C][O][N][=N][Ring1][Branch2][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C][=C][C][O][C][=C][C][=Ring1][Branch1][S][Ring1][Branch2]
|
C[C@H]1CC[C@H]9CN14.c17cc2occc2s1.c16cn8nn1.C36=O.C8CO.C47=O.C59.N35
|
CC1(NC(=O)c2cccc(Cl)c2N)CN(C(=O)[C@@H](F)C[C@H]2CCOC2)C1
|
CCNC=O)cccccCl)c6N)))))))))CNC=O)[C@@H]F)C[C@H]CCOC5))))))))C4
|
[C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C@H1][C][C][O][C][Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
c16cccc(Cl)c1N.CC15CN4C1.C4(=O)[C@@H](F)C7.[C@H]17CCOC1.C36=O.N35
|
Cc1cc(C(=O)NC[C@H]2CCC[C@H]2NC(=O)c2cc(O)cs2)c(C)cc1Cl
|
CcccC=O)NC[C@H]CCC[C@H]5NC=O)cccO)cs5)))))))))))))))cC)cc6Cl
|
[C][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][S][Ring1][=Branch1][=C][Branch1][C][C][C][=C][Ring2][Ring1][=Branch2][Cl]
|
Cc1cc8c(C)cc1Cl.[C@H]19CCC[C@H]16.c17cc(O)cs1.C38=O.C47=O.N35.C59.N46
|
C[C@H]1OCC[C@H]1C(=O)N1CC(C2CN(C(=O)CC3(C#N)CC3)C2)C1
|
C[C@H]OCC[C@H]5C=O)NCCCCNC=O)CCC#N))CC3)))))C4))))C4
|
[C][C@H1][O][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch1][C][Ring1][N][C][Ring1][S]
|
N14CC(C2CN5C2)C1.C[C@H]1OCC[C@H]16.C17(C#N)CC1.C5(=O)C7.C46=O
|
O=C(N[C@@H]1CCCN(C(=O)C23CCC(CC2)CO3)CC1)[C@@H]1CCC12CCOCC2
|
O=CN[C@@H]CCCNC=O)CCCCCC6))CO6)))))))CC7))))))))[C@@H]CCC4CCOCC6
|
[O][=C][Branch2][Ring1][S][N][C@@H1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][O][Ring1][Branch2][C][C][Ring1][P][C@@H1][C][C][C][Ring1][Ring2][C][C][O][C][C][Ring1][=Branch1]
|
[C@@H]18CCC12CCOCC2.[C@@H]16CCCN5CC1.C127CCC(CC1)CO2.O=C48.C57=O.N46
|
COc1ccc(OC)c(NC(=O)C[C@H]2CCN(Cc3c(F)ccc(O)c3F)C2)c1
|
COccccOC))cNC=O)C[C@H]CCNCccF)cccO)c6F))))))))C5))))))))c6
|
[C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][C@H1][C][C][N][Branch1][P][C][C][=C][Branch1][C][F][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][F][C][Ring1][#C][=C][Ring2][Ring1][O]
|
c1%10c(F)ccc(O)c1F.c15ccc6c8c1.[C@H]19CCN7C1.C4(=O)C9.CO5.O6C.N48.C7%10
|
Cc1ccnn1CC(=O)NC[C@@H](NC(=O)[C@H]1C[C@@H](OC(F)F)C1)C1CCCCC1
|
Ccccnn5CC=O)NC[C@@H]NC=O)[C@H]C[C@@H]OCF)F)))C4))))))CCCCCC6
|
[C][C][=C][C][=N][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][#Branch1][O][C][Branch1][C][F][F][C][Ring1][Branch2][C][C][C][C][C][C][Ring1][=Branch1]
|
Cc1ccnn18.C19CCCCC1.[C@H]17C[C@@H]4C1.C8C2=O.C5[C@@H]69.O4C(F)F.C37=O.N25.N36
|
COc1cc(F)c(C(=O)NC[C@H]2COCCN(C(=O)c3ccc(C)s3)C2)c(F)c1
|
COcccF)cC=O)NC[C@H]COCCNC=O)ccccC)s5))))))C7))))))))))cF)c6
|
[C][O][C][=C][C][Branch1][C][F][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][S][Ring1][=Branch1][C][Ring1][#C][C][Branch1][C][F][=C][Ring2][Ring1][O]
|
c16cc(F)c9c(F)c1.[C@H]1%10COCCN5C1.c18ccc(C)s1.C49=O.C58=O.CO6.N47.C7%10
|
CCCCCCCCS(=O)(=O)N1C[C@H]2CN(c3cc(C#N)ncn3)C[C@@H]21
|
CCCCCCCCS=O)=O)NC[C@H]CNcccC#N))ncn6))))))C[C@@H]57
|
[C][C][C][C][C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][=N][C][=C][C][Branch1][Ring1][C][#N][=N][C][=N][Ring1][Branch2][C][C@@H1][Ring1][=N][Ring1][#C]
|
CCCCCCCCS4(=O)=O.N14C[C@H]2CN5C[C@@H]21.c15cc(C#N)ncn1
|
O=C(C=Cc1nccs1)NC1CCC(CNC(=O)[C@@H]2CCCC23CC3)CC1
|
O=CC=Ccnccs5)))))))NCCCCCNC=O)[C@@H]CCCC5CC3))))))))))CC6
|
[O][=C][Branch1][#Branch2][C][=C][C][=N][C][=C][S][Ring1][Branch1][N][C][C][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][Ring1][Branch1][C][C][Ring1][Ring1][C][C][Ring1][P]
|
C17CCC%10CC1.[C@@H]18CCCC12CC2.C=9c1nccs1.O=C4C=9.C58=O.N47.C6%10.N56
|
CCn1nncc1C(=O)N1[C@H]2CC[C@@H]1[C@H](C(=O)N(C)CC(=O)N(C)C)C2
|
CCnnncc5C=O)N[C@H]CC[C@@H]5[C@H]C=O)NC)CC=O)NC)C))))))C6
|
[C][C][N][N][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Ring1][Branch1][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Ring1][S]
|
N13[C@H]2CC[C@@H]1[C@H]8C2.n19nncc17.C6C5=O.C37=O.C48=O.N46C.N5(C)C.CC9
|
Cc1ncsc1C(=O)NC[C@H]1C=CCN1C(=O)c1ccc(C(F)(F)F)cc1N
|
Ccncsc5C=O)NC[C@H]C=CCN5C=O)ccccCF)F)F))cc6N
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][N]
|
c16ccc8cc1N.Cc1ncsc15.[C@H]17C=CCN13.C8(F)(F)F.C25=O.C36=O.N24.C47
|
C[C@@H](NC(=O)CSc1n[nH]c(O)n1)C1(O)CCN(C(=O)C[C@H](O)C2CC2)CC1
|
C[C@@H]NC=O)CScn[nH]cO)n5)))))))))CO)CCNC=O)C[C@H]O)CCC3))))))CC6
|
[C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][S][C][=N][NH1][C][Branch1][C][O][=N][Ring1][=Branch1][C][Branch1][C][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@H1][Branch1][C][O][C][C][C][Ring1][Ring1][C][C][Ring1][#C]
|
C17(O)CCN4CC1.c19n[nH]c(O)n1.C4(=O)C[C@@H]8O.C3(=O)C6.C[C@@H]57.C18CC1.N35.S69
|
C[C@H](C(=O)NC(N)=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1
|
C[C@H]C=O)NCN)=O))))NC)[C@H]C)cccc-ncncn5)))))cc6
|
[C][C@H1][Branch1][O][C][=Branch1][C][=O][N][C][Branch1][C][N][=O][N][Branch1][C][C][C@H1][Branch1][C][C][C][=C][C][=C][Branch1][Branch2][N][C][=N][C][=N][Ring1][Branch1][C][=C][Ring1][O]
|
c17ccc8cc1.C[C@@H]5C3=O.n18cncn1.C4(N)=O.N56C.[C@H]67C.N34
|
CCc1scnc1C(=O)N(C)[C@@H]1CCCCN(C(=O)[C@H]2CC2(C)C)C1
|
CCcscnc5C=O)NC)[C@@H]CCCCNC=O)[C@H]CC3C)C)))))C7
|
[C][C][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][Branch1][C][C][C][C][Ring1][=C]
|
[C@@H]15CCCCN4C1.c18scnc16.[C@H]17CC1(C)C.C36=O.N35C.C47=O.CC8
|
C#CC[C@@]1(C(=O)NC[C@H]2CCCN2C(=O)c2cc(C#C)ccn2)CCCOC1
|
C#CC[C@@]C=O)NC[C@H]CCCN5C=O)cccC#C))ccn6)))))))))))))))CCCOC6
|
[C][#C][C][C@@][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][#C][=C][C][=N][Ring1][Branch2][C][C][C][O][C][Ring2][Ring1][=Branch2]
|
c16cc(C#C)ccn1.[C@@]179CCCOC1.[C@H]18CCCN14.C#CC9.C37=O.C46=O.N35.C58
|
CCC[C@@](C)(CO)Sc1cnc2c(ccn2C)n1
|
CCC[C@@]C)CO))Sccnccccn5C))))n6
|
[C][C][C][C@@][Branch1][C][C][Branch1][Ring1][C][O][S][C][=C][N][=C][C][Branch1][#Branch1][C][=C][N][Ring1][Branch1][C][=N][Ring1][#Branch2]
|
c14cnc2c(ccn2C)n1.CCC[C@@]3(C)CO.S34
|
O=C(N[C@@H]1CCC[C@H]1CNC(=O)c1cnn2c1OCC2)c1cc(Cl)ns1
|
O=CN[C@@H]CCC[C@H]5CNC=O)ccnnc5OCC5)))))))))))))))))cccCl)ns5
|
[O][=C][Branch2][Ring1][O][N][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][O][C][C][Ring1][Branch1][C][=C][C][Branch1][C][Cl][=N][S][Ring1][=Branch1]
|
c18cnn2c1OCC2.[C@@H]16CCC[C@H]19.c17cc(Cl)ns1.O=C37.C48=O.N36.C59.N45
|
CCCN(C(=O)C1CC(C(F)F)C1)[C@H]1CCN(C(=O)c2n[nH]c(C)c2Br)C1
|
CCCNC=O)CCCCF)F))C4)))))[C@H]CCNC=O)cn[nH]cC)c5Br)))))))C5
|
[C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][Branch1][C][F][F][C][Ring1][#Branch1][C@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][Br][C][Ring1][=C]
|
c17n[nH]c(C)c1Br.[C@H]16CCN4C1.C18CC9C1.CCC5.N356.C38=O.C9(F)F.C47=O
|
CNC(=O)CCN=C(NC[C@@H](O)c1ccc(C)o1)NCC(C)(C)[C@@H]1CCCO1
|
CNC=O)CCN=CNC[C@@H]O)ccccC)o5))))))))NCCC)C)[C@@H]CCCO5
|
[C][N][C][=Branch1][C][=O][C][C][N][=C][Branch1][P][N][C][C@@H1][Branch1][C][O][C][=C][C][=C][Branch1][C][C][O][Ring1][=Branch1][N][C][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][C][O][Ring1][Branch1]
|
C2(=O)CCN=C(N3)N4.c16ccc(C)o1.C4C5(C)C.[C@@H]15CCCO1.C3[C@H]6O.CN2
|
COC1(CNC(=O)c2nccnc2N)CN(C(=O)[C@@H]2CCC[C@H](C#N)C2)C1
|
COCCNC=O)cnccnc6N))))))))))CNC=O)[C@@H]CCC[C@H]C#N))C6)))))))C4
|
[C][O][C][Branch1][S][C][N][C][=Branch1][C][=O][C][=N][C][=C][N][=C][Ring1][=Branch1][N][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][C][C@H1][Branch1][Ring1][C][#N][C][Ring1][Branch2][C][Ring2][Ring1][=Branch2]
|
[C@@H]18CCC[C@H](C#N)C1.c17nccnc1N.C159CN4C1.C37=O.C48=O.CO5.C69.N36
|
C=CC1(C(=O)N2CCC(/C=C/C(=O)N[C@H](C(C)C)C3CC3)CC2)CCCC1
|
C=CCC=O)NCCC/C=C/C=O)N[C@H]CC)C))CCC3))))))))CC6)))))))CCCC5
|
[C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][/C][=C][/C][=Branch1][C][=O][N][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][C][C][C][C][C][Ring2][Ring1][=Branch2]
|
N14CCC(C=8)CC1.C=CC17CCCC1.[C@H]69C(C)C.C=8C5=O.C47=O.C19CC1.N56
|
CCNC(=O)[C@@H]1CCCN1C(=O)CCCN(C)C(=O)c1ccc(N)cn1
|
CCNC=O)[C@@H]CCCN5C=O)CCCNC)C=O)ccccN)cn6
|
[C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=N][Ring1][#Branch1]
|
c18ccc(N)cn1.[C@@H]17CCCN13.C3(=O)CCC6.C27=O.N46C.C48=O.CC5.N25
|
CCO[C@H](C)C(=O)N(C)CC1(O)CN(C(=O)[C@H]2CC3(CCC(F)(F)CC3)CO2)C1
|
CCO[C@H]C)C=O)NC)CCO)CNC=O)[C@H]CCCCCF)F)CC6)))))CO5))))))C4
|
[C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][O][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C@H1][C][C][Branch1][=C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][O][Ring1][N][C][Ring2][Ring1][Ring1]
|
[C@H]19CC2(CCC(F)(F)CC2)CO1.C1%10(O)CN5C1.[C@@H]7(C)C4=O.N48C.C59=O.CC6.O67.C8%10
|
CN(C(=O)CN1CCNC(=O)C1)[C@H]1CCCCN(C(=O)CC2CS(=O)(=O)C2)C1
|
CNC=O)CNCCNC=O)C6))))))))[C@H]CCCCNC=O)CCCS=O)=O)C4))))))C7
|
[C][N][Branch1][P][C][=Branch1][C][=O][C][N][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C@H1][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][=Branch1][C][Ring1][S]
|
[C@H]16CCCCN4C1.N15CCNC(=O)C1.C17CS(=O)(=O)C1.C3(=O)C5.C4(=O)C7.CN36
|
C[C@H]1[C@H](C)N(C(=O)C23CC(CO2)C3)CCN1C(=O)c1nc(Cl)c(Cl)s1
|
C[C@H][C@H]C)NC=O)CCCCO5))C4)))))CCN6C=O)cncCl)cCl)s5
|
[C][C@H1][C@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][Branch1][Branch1][C][O][Ring1][Branch1][C][Ring1][=Branch1][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][=N][C][Branch1][C][Cl][=C][Branch1][C][Cl][S][Ring1][#Branch1]
|
C[C@H]1[C@H](C)N4CCN15.c17nc(Cl)c(Cl)s1.C126CC(CO1)C2.C46=O.C57=O
|
CC(C)COc1ccccc1CNC(=O)N[C@@H](C(=O)O)[C@@H]1C[C@H]2C[C@H]2C1
|
CCC)COcccccc6CNC=O)N[C@@H]C=O)O))[C@@H]C[C@H]C[C@H]3C6
|
[C][C][Branch1][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@@H1][C][C@H1][C][C@H1][Ring1][Ring1][C][Ring1][=Branch1]
|
c16ccccc1%10.[C@H]19C[C@@H]2C[C@@H]2C1.[C@@H]89C(=O)O.CC(C)C5.C34=O.O56.C7%10.N37.N48
|
CCc1ccoc1C(=O)N[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)C(C)C
|
CCcccoc5C=O)N[C@@H]CNC=O)[C@@H]C[C@H]3cccccCl)c6Cl)))))))))))))CC)C
|
[C][C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][Branch1][C][C][C]
|
c19cccc(Cl)c1Cl.c18ccoc16.[C@H]4(C5)C(C)C.[C@@H]17C[C@H]19.C26=O.C37=O.CC8.N24.N35
|
C=C(C)C[C@@H](C)C(=O)NC[C@H]1CCCN1C(=O)CCCc1nnc(C)n1C
|
C=CC)C[C@@H]C)C=O)NC[C@H]CCCN5C=O)CCCcnncC)n5C
|
[C][=C][Branch1][C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][=N][N][=C][Branch1][C][C][N][Ring1][=Branch1][C]
|
C=C(C)C[C@@H](C)C2=O.c16nnc(C)n1C.[C@H]15CCCN13.C3(=O)CCC6.N24.C45
|
CC[C@H](CC(=O)N1CCO[C@H](CNC(=O)[C@@](C)(CC)CCC(C)C)C1)CN(C)C
|
CC[C@H]CC=O)NCCO[C@H]CNC=O)[C@@]C)CC))CCCC)C))))))))C6))))))))CNC)C
|
[C][C][C@H1][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch1][Ring1][C][C][C][C][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1][C][N][Branch1][C][C][C]
|
C3(=O)[C@@](C)(CC)CCC(C)C.CC[C@@H](C5)CC2=O.N12CCO[C@H]6C1.N5(C)C.C46.N34
|
CC[C@@H](CN(CC)C(=O)c1cccc(=O)o1)NC(=O)Cc1ncccc1C
|
CC[C@@H]CNCC))C=O)ccccc=O)o6)))))))))NC=O)Ccncccc6C
|
[C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][C][=O][O][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=N][C][=C][C][=C][Ring1][=Branch1][C]
|
c17cccc(=O)o1.c18ncccc1C.CC[C@H]4C5.C3(=O)C8.N256.C27=O.C6C.N34
|
C=Cc1cccc(NC(=O)Cn2ccc(=Nc3ncnc(OC)c3C)nc2O)c1
|
C=CcccccNC=O)Cnccc=NcncncOC))c6C))))))))nc6O))))))))))c6
|
[C][=C][C][=C][C][=C][C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][N][C][=C][C][=Branch1][#C][=N][C][=N][C][=N][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][N][=C][Ring1][S][O][=C][Ring2][Ring1][O]
|
n17ccc(=Nc2ncnc5c2C)nc1O.C=Cc1cccc6c1.C4(=O)C7.N46.O5C
|
CCCn1cc(C(=O)NCC2CC(NC(=O)CCN(C)C[C@@H](C)C(C)C)C2)cn1
|
CCCnccC=O)NCCCCNC=O)CCNC)C[C@@H]C)CC)C)))))))))C4)))))))cn5
|
[C][C][C][N][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][N][Branch1][C][C][C][C@@H1][Branch1][C][C][C][Branch1][C][C][C][C][Ring1][P][C][=N][Ring2][Ring1][#Branch2]
|
n1%10cc9cn1.C7[C@@H](C)C(C)C.C1%11CC8C1.C4(=O)CC6.CCC%10.C39=O.N67C.N35.C5%11.N48
|
CCn1cc(Cl)cc1C(=O)N[C@@H]1CCC[C@H]1CNC(=O)c1ccc(O)c(OC)c1
|
CCnccCl)cc5C=O)N[C@@H]CCC[C@H]5CNC=O)ccccO)cOC))c6
|
[C][C][N][C][=C][Branch1][C][Cl][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2]
|
c18ccc(O)c4c1.n19cc(Cl)cc17.[C@@H]16CCC[C@H]1%10.C27=O.C38=O.CC9.N26.C5%10.N35.O4C
|
Cc1nc(C(=O)NCCC2(NC(=O)[C@@H](OC(C)(C)C)C(C)(C)C)CC2)c(C)s1
|
CcncC=O)NCCCNC=O)[C@@H]OCC)C)C)))CC)C)C)))))CC3)))))))cC)s5
|
[C][C][=N][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][S][=C][Branch1][C][C][S][Ring2][Ring1][O]
|
C4(=O)[C@@H]5C(C)(C)C.Cc1nc9c(C)s1.C18%10CC1.C6(C)(C)C.C39=O.C7C%10.N37.N48.O56
|
CO[C@H](C(=O)N1CC[C@@H](C2(NC(=O)CSc3cccc[n+]3[O-])CC2)C1)C(C)C
|
CO[C@H]C=O)NCC[C@@H]CNC=O)CSccccc[n+]6[O-])))))))))))CC3)))C5))))))CC)C
|
[C][O][C@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch2][C][Branch1][P][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][=N+1][Ring1][=Branch1][O-1][C][C][Ring1][#C][C][Ring2][Ring1][Ring2][C][Branch1][C][C][C]
|
N14CC[C@@H](C27CC2)C1.[C@@H]6(C4=O)C(C)C.c19cccc[n+]1[O-].C5(=O)C8.CO6.N57.S89
|
Cc1sc(N)c(C(=O)NCCCOC2CCN(C(=O)[C@H]3C[C@]3(C)Br)CC2)c1C
|
CcscN)cC=O)NCCCOCCCNC=O)[C@H]C[C@]3C)Br)))))CC6))))))))))))c5C
|
[C][C][S][C][Branch1][C][N][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][O][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C][C@][Ring1][Ring1][Branch1][C][C][Br][C][C][Ring1][=N][C][=Ring2][Ring1][#Branch2][C]
|
Cc1sc(N)c%10c1C.C17CCN5CC1.[C@H]19C[C@]1(C)Br.C8CC6.C4%10=O.C59=O.N48.O67
|
CC[C@H](C#N)C(=O)N(C)[C@H]1CCCN(C(=O)c2cc3ccc(F)cc3[nH]2)C1
|
CC[C@H]C#N))C=O)NC)[C@H]CCCNC=O)ccccccF)cc6[nH]9))))))))))C6
|
[C][C][C@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2][C][Ring2][Ring1][C]
|
c17cc2ccc(F)cc2[nH]1.CC[C@H](C#N)C4=O.[C@H]16CCCN5C1.N46C.C57=O
|
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