SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1C=C[C@H](CC(=O)N[C@H](CO)CC(F)(F)F)C1
|
Ccn[nH]cC)c5CC=O)N[C@@H]C=C[C@H]CC=O)N[C@H]CO))CCF)F)F)))))))C5
|
[C][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][=C][C@H1][Branch2][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][P]
|
[C@@H]4(CO)CC(F)(F)F.Cc1n[nH]c(C)c17.[C@@H]15C=C[C@H]6C1.C7C2=O.C6C3=O.N25.N34
|
COc1nc(C(=O)N(CCNC(=O)[C@@H](c2cccc(Cl)c2)N(C)C)C2CC2)co1
|
COcncC=O)NCCNC=O)[C@@H]cccccCl)c6))))))NC)C)))))))CCC3)))))co5
|
[C][O][C][=N][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][Branch2][Ring1][O][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][Branch1][C][C][C][C][C][C][Ring1][Ring1][=C][O][Ring2][Ring1][O]
|
c1%11cccc(Cl)c1.c15nc%10co1.C4(=O)[C@H]8%11.C3%10=O.N369.C6C7.N8(C)C.C19CC1.CO5.N47
|
Cc1cocc1C(=O)N1[C@H]2CC[C@@H]1[C@H](C(=O)NCCN1C[C@H]3CC[C@H]1C3)C2
|
Cccocc5C=O)N[C@H]CC[C@@H]5[C@H]C=O)NCCNC[C@H]CC[C@H]6C5)))))))))))C6
|
[C][C][=C][O][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][C][C][N][C][C@H1][C][C][C@H1][Ring1][=Branch1][C][Ring1][Branch1][C][Ring2][Ring1][C]
|
N14[C@H]2CC[C@@H]1[C@H]8C2.N17C[C@H]2CC[C@H]1C2.Cc1cocc19.C49=O.C58=O.C6C7.N56
|
CCSc1cccc(C(=O)N[C@@H]2C[C@H]3[C@@H]2CCN3C(=O)c2cncc(O)c2)c1
|
CCScccccC=O)N[C@@H]C[C@H][C@@H]4CCN5C=O)ccnccO)c6))))))))))))))))c6
|
[C][C][S][C][=C][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C@@H1][Ring1][Ring2][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][O][=C][Ring1][#Branch1][=C][Ring2][Ring1][=Branch2]
|
[C@@H]17C[C@H]2[C@@H]1CCN25.c1%10cccc8c1.c19cncc(O)c1.C48=O.C59=O.CC6.S6%10.N47
|
CCC(F)(F)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1C[C@H]2NC(=O)[C@H]1CC[C@@]12CCCO2
|
CCCF)F)C=O)N[C@@H]C[C@H]CC[C@@H]6C[C@H]6NC=O)[C@H]CC[C@@]4CCCO5
|
[C][C][C][Branch1][C][F][Branch1][C][F][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][C][C][C@@][Ring1][Ring2][C][C][C][O][Ring1][Branch1]
|
[C@@H]15C[C@H]2CC[C@@H]1C[C@H]26.[C@H]17CC[C@@]12CCCO2.CCC(F)(F)C3=O.C47=O.N35.N46
|
CC(C)(C)OC(=O)NCC12CCC(CC1)N2Cc1cnc2c(c1)CCC(=O)N2
|
CCC)C)OC=O)NCCCCCCC6))N5Cccnccc6)CCC=O)N6
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][Ring1][#Branch1][C][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][Ring1][Branch2]
|
c19cnc2c(c1)CCC(=O)N2.C128CCC(CC1)N27.CC5(C)C.C34=O.O35.N46.C68.C79
|
CC1(NC(=O)C[C@@H]2CCCC2(F)F)CN(C(=O)c2ocnc2C2CC2)C1
|
CCNC=O)C[C@@H]CCCC5F)F)))))))))CNC=O)cocnc5CCC3)))))))))C4
|
[C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][C][Ring1][Branch1][Branch1][C][F][F][C][N][Branch1][P][C][=Branch1][C][=O][C][O][C][=N][C][=Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][=Branch2]
|
[C@@H]17CCCC1(F)F.CC15CN4C1.c16ocnc18.C3(=O)C7.C46=O.C18CC1.N35
|
CC1=C(C(=O)N2C[C@@H](CNC(=O)C3(C(N)=O)CC3)[C@H](c3ccccc3)C2)CCC1
|
CC=CC=O)NC[C@@H]CNC=O)CCN)=O))CC3))))))[C@H]cccccc6))))))C5))))))CCC5
|
[C][C][=C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch1][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Branch1][C][C][C][Ring2][Ring1][N]
|
CC1=C(C4=O)CCC1.N14C[C@@H]9[C@H]%10C1.c1%10ccccc1.C178CC1.C57=O.C8(N)=O.C69.N56
|
C#C[C@@H]1CN(C(=O)C2=C(CC)OCCC2)CCN1C(=O)[C@@H](C)c1cccs1
|
C#C[C@@H]CNC=O)C=CCC))OCCC6)))))))CCN6C=O)[C@@H]C)ccccs5
|
[C][#C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][Branch1][Ring1][C][C][O][C][C][C][Ring1][Branch2][C][C][N][Ring1][S][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][=C][S][Ring1][Branch1]
|
C3(=O)C1=C(CC)OCCC1.C#C[C@@H]1CN3CCN14.C4(=O)[C@H]5C.c15cccs1
|
C#Cc1cnn(CC(=O)N2CCC[C@@]2(C)C(=O)N2CCn3nccc3C2)c1
|
C#CccnnCC=O)NCCC[C@@]5C)C=O)NCCnnccc5C9)))))))))))))))))c5
|
[C][#C][C][C][=N][N][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][N][=C][C][=C][Ring1][Branch1][C][Ring1][=Branch2][C][=Ring2][Ring1][=Branch2]
|
N15CCn2nccc2C1.C#Cc1cnn7c1.N14CCC[C@]16C.C7C4=O.C56=O
|
CCC[C@H](NC(=O)[C@H](CNC(=O)[C@@H]1CCCN1CC)OC)c1ccco1
|
CCC[C@H]NC=O)[C@H]CNC=O)[C@@H]CCCN5CC))))))))))OC)))))cccco5
|
[C][C][C][C@H1][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][C][O][C][C][=C][C][=C][O][Ring1][Branch1]
|
C2(=O)[C@@H]4C6.[C@@H]18CCCN17.CCC[C@H]59.c19ccco1.C38=O.N25.N36.C7C.O4C
|
CS[C@H](C(=O)N[C@@H]1CCC[C@H](C(=O)NC[C@]2(O)CC[C@@H](C)C2)CC1)C1CC1
|
CS[C@H]C=O)N[C@@H]CCC[C@H]C=O)NC[C@]O)CC[C@@H]C)C5))))))))CC7)))))))))CCC3
|
[C][S][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@][Branch1][C][O][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch1][C][C][Ring2][Ring1][C][C][C][C][Ring1][Ring1]
|
[C@@H]17CCC[C@H]8CC1.[C@@]1%10(O)CC[C@@H](C)C1.[C@H]69C3=O.C48=O.C19CC1.CS6.N37.N45.C5%10
|
Cc1nn2ncccc2c1C(=O)N[C@H]1C[C@@H]1CNC(=O)c1cc(Br)no1
|
Ccnnncccc6c9C=O)N[C@H]C[C@@H]3CNC=O)cccBr)no5
|
[C][C][=N][N][N][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=N][O][Ring1][=Branch1]
|
Cc1nn2ncccc2c18.c17cc(Br)no1.[C@H]16C[C@@H]19.C38=O.C47=O.N36.C59.N45
|
CN(C[C@H]1CC=CCC1)C(=O)c1cc(Br)nn1-c1ccc(F)cc1
|
CNC[C@H]CC=CCC6)))))))C=O)cccBr)nn5-ccccF)cc6
|
[C][N][Branch1][#Branch2][C][C@H1][C][C][=C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=N][N][Ring1][=Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
c14cc(Br)nn16.c16ccc(F)cc1.[C@H]15CC=CCC1.CN23.C24=O.C35
|
COCC[C@H]1CN(C(=O)/C=C/c2ccc(C)c(C)c2)CCN1C(=O)C1=NOCC1
|
COCC[C@H]CNC=O)/C=C/ccccC)cC)c6)))))))))CCN6C=O)C=NOCC5
|
[C][O][C][C][C@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C][=N][O][C][C][Ring1][Branch1]
|
C=6c1ccc(C)c(C)c1.[C@H]17CN3CCN14.C4(=O)C1=NOCC1.C3(=O)C=6.C5C7.CO5
|
C=CCC(=O)N[C@]1(CCC)CCCN(C(=O)COC[C@@H](C)c2ccccc2)C1
|
C=CCC=O)N[C@]CCC)))CCCNC=O)COC[C@@H]C)cccccc6)))))))))))C6
|
[C][=C][C][C][=Branch1][C][=O][N][C@][Branch1][Ring2][C][C][C][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][O][C][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
[C@@]178CCCN4C1.c19ccccc1.C=CCC3=O.C4(=O)C5.C6[C@H]9C.C8CC.N37.O56
|
CO[C@@H]1CCC[C@H](C(=O)N2CC3(NC(=O)c4csnc4C)CCC2CC3)C1
|
CO[C@@H]CCC[C@H]C=O)NCCNC=O)ccsnc5C))))))))CCC6CC6)))))))))C6
|
[C][O][C@@H1][C][C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][S][N][=C][Ring1][Branch1][C][C][C][C][Ring1][#C][C][C][Ring1][#C][C][Ring2][Ring1][=Branch2]
|
N15CC28CCC1CC2.[C@@H]17CCC[C@H]9C1.c1%10csnc1C.C59=O.C6%10=O.CO7.N68
|
Cc1ccc(C(=O)NCCNC(=O)[C@H]2CCC3(CC3)C2)c(Br)c1F
|
CccccC=O)NCCNC=O)[C@H]CCCCC3))C5)))))))))))cBr)c6F
|
[C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][#Branch1][C][Branch1][C][Br][=C][Ring2][Ring1][=Branch1][F]
|
Cc1ccc9c(Br)c1F.[C@H]18CCC2(CC2)C1.C49=O.C6C7.C58=O.N46.N57
|
CC[C@@H]1CN(C(=O)C(C)(C)CCSC)CC[C@@H]1NC(=O)c1cncc(COC)c1
|
CC[C@@H]CNC=O)CC)C)CCSC))))))CC[C@@H]6NC=O)ccnccCOC)))c6
|
[C][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][S][C][C][C][C@@H1][Ring1][#C][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][Ring2][C][O][C][=C][Ring1][=Branch2]
|
[C@@H]18CN2CC[C@@H]16.C2(=O)C(C)(C)CC5.c17cncc9c1.C37=O.CC8.S5C.N36.C49.O4C
|
C[C@@H]1CCN(C(=O)c2cnc(-c3ccco3)s2)[C@@H]1CNC(=O)[C@@H]1CCCN1C=O
|
C[C@@H]CCNC=O)ccnc-cccco5)))))s5))))))[C@@H]5CNC=O)[C@@H]CCCN5C=O
|
[C][C@@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][S][Ring1][#Branch2][C@@H1][Ring1][P][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=O]
|
C[C@@H]1CCN4[C@@H]19.[C@@H]17CCCN1C=O.c18cnc%10s1.c1%10ccco1.C48=O.C57=O.C69.N56
|
CC1(C)C[C@]1(O)C(=O)N[C@H]1CCCCCN(C(=O)CCC2CCC2)C1
|
CCC)C[C@]3O)C=O)N[C@H]CCCCCNC=O)CCCCCC4)))))))C8
|
[C][C][Branch1][C][C][C][C@][Ring1][Ring2][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][Ring2][C][Ring1][S]
|
[C@H]15CCCCCN4C1.CC1(C)C[C@@]16O.C4(=O)CC7.C17CCC1.C36=O.N35
|
CCO[C@H](C(=O)NC1(CNC(=O)c2cccnc2)CCOCC1)c1ccccc1
|
CCO[C@H]C=O)NCCNC=O)ccccnc6)))))))))CCOCC6))))))))cccccc6
|
[C][C][O][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][O][C][C][Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C17%10CCOCC1.c19cccnc1.c1%11ccccc1.[C@H]6%11C3=O.C49=O.CC5.O56.N37.C8%10.N48
|
O=C(C1=CCCS1)N(C[C@H]1CCCN1C(=O)[C@@H]1CCCC12CC2)C1CC1
|
O=CC=CCCS5)))))NC[C@H]CCCN5C=O)[C@@H]CCCC5CC3))))))))))))))CCC3
|
[O][=C][Branch1][Branch2][C][=C][C][C][S][Ring1][Branch1][N][Branch2][Ring1][Branch2][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][C][Ring1][Branch1][C][C][Ring1][Ring1][C][C][C][Ring1][Ring1]
|
O=C3C1=CCCS1.[C@@H]17CCCC12CC2.[C@H]18CCCN14.N356.C47=O.C16CC1.C58
|
Cc1cc(=NC[C@]2(C(C)(C)C)CCN(C(=O)CNS(=O)(=O)N(C)C)C2)[nH]c(Cl)n1
|
Cccc=NC[C@]CC)C)C))CCNC=O)CNS=O)=O)NC)C))))))C5)))))))[nH]cCl)n6
|
[C][C][=C][C][=Branch2][Ring2][#Branch2][=N][C][C@][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][N][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][C][Ring2][Ring1][Ring1][NH1][C][Branch1][C][Cl][=N][Ring2][Ring1][N]
|
Cc1cc(=NC5)[nH]c(Cl)n1.[C@@]156CCN3C1.N4S(=O)(=O)N(C)C.C6(C)(C)C.C3(=O)C4
|
CN(C[C@@H]1CCCN(C(=O)[C@@H]2C=CCS2)C1)C(=O)C12CCC(CC1)C2
|
CNC[C@@H]CCCNC=O)[C@@H]C=CCS5))))))C6)))))))C=O)CCCCCC6))C5
|
[C][N][Branch2][Ring1][#Branch1][C][C@@H1][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][=C][C][S][Ring1][Branch1][C][Ring1][=N][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1]
|
[C@@H]18CCCN3C1.C127CCC(CC1)C2.[C@@H]16C=CCS1.CN45.C36=O.C47=O.C58
|
CC[C@H](CCC(=O)N(C)CC(C)(C)CNC(=O)[C@@H]1CCCn2cc(C)nc21)OC
|
CC[C@H]CCC=O)NC)CCC)C)CNC=O)[C@@H]CCCnccC)nc59))))))))))))))))))OC
|
[C][C][C@H1][Branch2][Ring2][=Branch2][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][C][=C][Branch1][C][C][N][=C][Ring1][=Branch1][Ring1][#Branch2][O][C]
|
C4(=O)[C@@H]1CCCn2cc(C)nc21.CC[C@@H]5CCC3=O.C6C(C)(C)C7.N36C.N47.O5C
|
O=C(N[C@@H]1CC[C@@H]2CN(C(=O)C3(C(=O)C4CC4)CC3)C[C@H]2C1)[C@@H]1CCS1(=O)=O
|
O=CN[C@@H]CC[C@@H]CNC=O)CC=O)CCC3))))CC3))))C[C@H]5C9))))))))))[C@@H]CCS4=O)=O
|
[O][=C][Branch2][Ring2][#Branch1][N][C@@H1][C][C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][#Branch2][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][C][Ring1][Branch2][C][C@H1][Ring1][#C][C][Ring2][Ring1][Ring1][C@@H1][C][C][S][Ring1][Ring2][=Branch1][C][=O][=O]
|
[C@@H]17CC[C@@H]2CN6C[C@H]2C1.[C@@H]18CCS1(=O)=O.C19%10CC1.O=C58.C69=O.C%10%11=O.C1%11CC1.N57
|
CC(C)n1cnc(C(=O)N2CCCO[C@@H](CNC(=O)/C=C/[C@@H]3CCCN3C)C2)c1
|
CCC)ncncC=O)NCCCO[C@@H]CNC=O)/C=C/[C@@H]CCCN5C)))))))))))C7))))))))c5
|
[C][C][Branch1][C][C][N][C][=N][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][O][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][/C][=C][/C@@H1][C][C][C][N][Ring1][Branch1][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][#Branch2]
|
N14CCCO[C@@H]%10C1.C=8[C@@H]1CCCN1C.n19cnc7c1.C5(=O)C=8.CC9C.C47=O.C6%10.N56
|
C[C@]1(C(=O)NCC2(NC(=O)Cc3cnn4ccccc34)CCCC2)C[C@@]1(F)Cl
|
C[C@]C=O)NCCNC=O)Cccnnccccc96))))))))))))CCCC5))))))))C[C@@]3F)Cl
|
[C][C@][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][=N][N][C][=C][C][=C][C][=Ring1][=Branch2][Ring1][=Branch1][C][C][C][C][Ring2][Ring1][C][C][C@@][Ring2][Ring1][=Branch2][Branch1][C][F][Cl]
|
c1%11cnn2ccccc12.C[C@]19C[C@@]1(F)Cl.C18%10CCCC1.C6(=O)C%11.C59=O.N57.C7%10.N68
|
C=C1C[C@@H]1C(=O)NC(CC)(CC)CCNC(=O)CN1CC[C@@](C)(O)C1
|
C=CC[C@@H]3C=O)NCCC))CC))CCNC=O)CNCC[C@@]C)O)C5
|
[C][=C][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][N][C][C][C@@][Branch1][C][C][Branch1][C][O][C][Ring1][#Branch1]
|
C4(CC)(CC)CC5.N16CC[C@@](C)(O)C1.C=C1C[C@@H]17.C3(=O)C6.C27=O.N24.N35
|
CCCC[C@H](NC(=O)CCc1ccncn1)C(=O)N[C@@H](C)c1ccccc1O
|
CCCC[C@H]NC=O)CCcccncn6))))))))))C=O)N[C@@H]C)cccccc6O
|
[C][C][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][C][=C][C][=N][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O]
|
CCCC[C@H]4C3=O.c17ccccc1O.c16ccncn1.C2(=O)CC6.[C@@H]57C.N24.N35
|
CC(C)O[C@@H]1CCCN(C(=O)[C@H](C)NC(=O)CC2CC3(CCC3)C2)C1
|
CCC)O[C@@H]CCCNC=O)[C@H]C)NC=O)CCCCCCC4)))C4)))))))))C6
|
[C][C][Branch1][C][C][O][C@@H1][C][C][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch1][C][Ring2][Ring1][Branch1]
|
[C@@H]17CCCN4C1.C19CC2(CCC2)C1.C4(=O)[C@@H]8C.C5(=O)C9.CC6C.O67.N58
|
C[C@@H]1Oc2ccc([C@H](C(=O)NCC(F)F)N3CC[C@@H](c4ncc[nH]4)C3)cc2[C@H]1C
|
C[C@@H]Occcc[C@H]C=O)NCCF)F)))))NCC[C@@H]cncc[nH]5)))))C5))))))cc6[C@H]9C
|
[C][C@@H1][O][C][=C][C][=C][Branch2][Ring1][#C][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][F][N][C][C][C@@H1][Branch1][Branch2][C][=N][C][=C][NH1][Ring1][Branch1][C][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch2][C@H1][Ring2][Ring1][O][C]
|
C[C@@H]1Oc2ccc8cc2[C@H]1C.N16CC[C@@H]9C1.[C@@H]68C5=O.c19ncc[nH]1.C7C(F)F.N57
|
CC[C@H](COC)C(=O)NCCCC[C@H](C)NC(=O)c1ccc(F)cc1Br
|
CC[C@H]COC)))C=O)NCCCC[C@H]C)NC=O)ccccF)cc6Br
|
[C][C][C@H1][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Br]
|
c17ccc(F)cc1Br.CC[C@H](C4)C2=O.C5CCC[C@@H]6C.C37=O.O4C.N25.N36
|
Cc1cc(C)cc(NCCC(=O)N2C[C@@H](NC(=O)c3scnc3Cl)CC[C@H]2C)c1
|
CcccC)ccNCCC=O)NC[C@@H]NC=O)cscnc5Cl))))))))CC[C@H]6C)))))))))))c6
|
[C][C][=C][C][Branch1][C][C][=C][C][Branch2][Ring1][S][N][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][S][C][=N][C][=Ring1][Branch1][Cl][C][C][C@H1][Ring1][#C][C][=C][Ring2][Ring1][N]
|
Cc1cc7cc(C)c1.N14C[C@@H]8CC[C@H]1C.c19scnc1Cl.C6CC4=O.C59=O.N67.N58
|
CCn1ncc2c1C[C@H](C(=O)NCC[C@H]1CC[C@@H](NC(=O)CC(F)(F)F)C1)CC2
|
CCnnccc5C[C@H]C=O)NCC[C@H]CC[C@@H]NC=O)CCF)F)F)))))C5)))))))))CC6
|
[C][C][N][N][=C][C][=C][Ring1][Branch1][C][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=N][C][C][Ring2][Ring1][Branch2]
|
n18ncc2c1C[C@H]7CC2.C4(=O)CC(F)(F)F.[C@H]19CC[C@@H]6C1.C37=O.C5C9.CC8.N35.N46
|
C[C@@H]1C[C@@H](NC(=O)CN(C)CCc2ccccc2)CN1C(=O)C1(C2CCC2)CC1
|
C[C@@H]C[C@@H]NC=O)CNC)CCcccccc6))))))))))))CN5C=O)CCCCC4))))CC3
|
[C][C@@H1][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][C][Ring1][#Branch1]
|
C[C@@H]1C[C@@H]7CN14.C18(C2CCC2)CC1.c19ccccc1.C3(=O)C5.N56C.C6C9.C48=O.N37
|
COCc1ccc(C(=O)N2CCN(C(=O)c3cc4nc[nH]c4cn3)[C@H](CO)C2)o1
|
COCccccC=O)NCCNC=O)cccnc[nH]c5cn9))))))))))[C@H]CO))C6)))))))o5
|
[C][O][C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][N][=C][NH1][C][=Ring1][Branch1][C][=N][Ring1][=Branch2][C@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][Ring1][O][Ring2][Ring1][#Branch2]
|
c19cc2nc[nH]c2cn1.N15CCN6[C@H]%10C1.c1%11ccc8o1.C58=O.C69=O.CO7.C7%11.C%10O
|
CN(CC1(CNC(=O)Cc2cccnc2Cl)CC1)C(=O)[C@@H]1OC[C@@H]2COCC[C@@H]21
|
CNCCCNC=O)Cccccnc6Cl)))))))))))CC3))))C=O)[C@@H]OC[C@@H]COCC[C@@H]69
|
[C][N][Branch2][Ring1][=Branch2][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Cl][C][C][Ring1][#C][C][=Branch1][C][=O][C@@H1][O][C][C@@H1][C][O][C][C][C@@H1][Ring1][=Branch1][Ring1][=Branch2]
|
[C@@H]17OC[C@@H]2COCC[C@@H]21.c1%10cccnc1Cl.C189CC1.C3(=O)C%10.CN45.C47=O.C58.C69.N36
|
CCN(CCN(CC)C(=O)[C@H]1C[C@@H](C)N(C)C1)C(=O)CO[C@H]1CCCOC1
|
CCNCCNCC))C=O)[C@H]C[C@@H]C)NC)C5)))))))))C=O)CO[C@H]CCCOC6
|
[C][C][N][Branch2][Ring1][=Branch2][C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C][O][C@H1][C][C][C][O][C][Ring1][=Branch1]
|
[C@H]1%10C[C@@H](C)N(C)C1.[C@H]15CCCOC1.C3(=O)C4.N367.C7C8.N289.C2%10=O.CC6.C9C.O45
|
O=C(NCCn1nnc2ccccc21)N1CC[C@@H](CO)C12CCOCC2
|
O=CNCCnnncccccc69))))))))))))NCC[C@@H]CO))C5CCOCC6
|
[O][=C][Branch1][P][N][C][C][N][N][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][N][C][C][C@@H1][Branch1][Ring1][C][O][C][Ring1][#Branch1][C][C][O][C][C][Ring1][=Branch1]
|
N14CC[C@@H]7C12CCOCC2.n16nnc2ccccc21.O=C34.C5C6.N35.C7O
|
C[C@H](C1CC1)N(C(=O)CN1CC[C@@]2(CCN(C(=O)Cn3nccn3)C2)C1)C1CC1
|
C[C@H]CCC3)))NC=O)CNCC[C@@]CCNC=O)Cnnccn5)))))))C5))))C5)))))))CCC3
|
[C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch2][Ring2][Ring2][C][=Branch1][C][=O][C][N][C][C][C@@][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][N][=C][C][=N][Ring1][Branch1][C][Ring1][=N][C][Ring1][P][C][C][C][Ring1][Ring1]
|
N17CC[C@@]2(CCN5C2)C1.n19nccn1.C4(=O)C7.C5(=O)C9.C[C@@H]6%10.C1%10CC1.N468.C18CC1
|
CNC(=O)N[C@@H](C)C(=O)N1C[C@@H](NC(=O)C(=O)CCc2ccccc2)C[C@H]1C
|
CNC=O)N[C@@H]C)C=O)NC[C@@H]NC=O)C=O)CCcccccc6)))))))))))C[C@H]5C
|
[C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Ring2][Ring1][C][C]
|
N15C[C@@H]8C[C@H]1C.C6(=O)C(=O)CC9.c19ccccc1.[C@H]7(C)C5=O.C34=O.CN3.N47.N68
|
CNC1CCN(C(=O)C(=O)N2CCC[C@H]2c2ccc(Br)c(C)c2)CC1
|
CNCCCNC=O)C=O)NCCC[C@H]5ccccBr)cC)c6)))))))))))))CC6
|
[C][N][C][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][C][=C][Ring1][Branch2][C][C][Ring2][Ring1][#Branch1]
|
c16ccc(Br)c(C)c1.C15CCN3CC1.N14CCC[C@H]16.C3(=O)C4=O.CN5
|
C[C@@H](CN(C)C(=O)c1ncsc1C1CC1)N(C)C(=O)[C@H]1CC(C(C)(C)C)=NO1
|
C[C@@H]CNC)C=O)cncsc5CCC3)))))))))))NC)C=O)[C@H]CCCC)C)C))=NO5
|
[C][C@@H1][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][=C][S][C][=Ring1][Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][O][Ring1][=Branch2]
|
[C@H]16CC(C(C)(C)C)=NO1.c17ncsc18.C[C@H]4C5.N25C.C27=O.C18CC1.N34C.C36=O
|
CC(C)(C)CC(=O)NC[C@@]1(F)CCN(C(=O)[C@@H]2CC2(F)F)C1
|
CCC)C)CC=O)NC[C@@]F)CCNC=O)[C@@H]CC3F)F)))))C5
|
[C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][F][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F][C][Ring1][=N]
|
CC(C)(C)CC3=O.[C@]17(F)CCN4C1.[C@@H]16CC1(F)F.C46=O.N35.C57
|
CCCC(C)(C)CC(=O)NC[C@H]1CCCC[C@H]1NC(=O)c1cc(C)c(F)c(C)c1
|
CCCCC)C)CC=O)NC[C@H]CCCC[C@H]6NC=O)cccC)cF)cC)c6
|
[C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][F][C][Branch1][C][C][=C][Ring1][=Branch2]
|
CCCC(C)(C)CC2=O.c16cc(C)c(F)c(C)c1.[C@H]17CCCC[C@H]15.C36=O.N24.C47.N35
|
CC1(C)CC[C@H](CNC(=O)C2CC3(CCC3)C2)N(C(=O)c2ccsc2)C1
|
CCC)CC[C@H]CNC=O)CCCCCC4)))C4)))))))NC=O)cccsc5))))))C6
|
[C][C][Branch1][C][C][C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch1][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
CC1(C)CC[C@H]9N5C1.C17CC2(CCC2)C1.c18ccsc1.C47=O.C58=O.C69.N46
|
Cc1cc(=N[C@@H]2CN(C(=O)[C@@H]3CCCS3)C[C@@H]2C)[nH]cc1C#N
|
Cccc=N[C@@H]CNC=O)[C@@H]CCCS5))))))C[C@@H]5C)))))))[nH]cc6C#N
|
[C][C][=C][C][=Branch2][Ring1][#Branch1][=N][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][S][Ring1][Branch1][C][C@@H1][Ring1][N][C][NH1][C][=C][Ring2][Ring1][Ring2][C][#N]
|
Cc1cc(=N[C@@H]2CN4C[C@@H]2C)[nH]cc1C#N.[C@@H]15CCCS1.C45=O
|
CO[C@H]1C[C@@H](C(=O)N(C)C2CC(NC(=O)C34CCC(O)(CC3)CC4)C2)C[C@H]1OC
|
CO[C@H]C[C@@H]C=O)NC)CCCNC=O)CCCCO)CC6))CC6))))))))C4))))))C[C@H]5OC
|
[C][O][C@H1][C][C@@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][O][Branch1][Branch1][C][C][Ring1][#Branch1][C][C][Ring1][=Branch2][C][Ring1][S][C][C@H1][Ring2][Ring1][=Branch2][O][C]
|
C12%12CCC(O)(CC1)CC2.[C@H]17C[C@@H]%11C[C@H]18.C19CC%10C1.C5%11=O.N59C.C6%12=O.CO7.N6%10.O8C
|
COC(=O)c1nc(C(=O)N[C@H](C)C2CCN(C(=O)c3coc(O)n3)CC2)co1
|
COC=O)cncC=O)N[C@H]C)CCCNC=O)ccocO)n5))))))CC6)))))))))co5
|
[C][O][C][=Branch1][C][=O][C][=N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][O][=N][Ring1][=Branch1][C][C][Ring1][=C][=C][O][Ring2][Ring1][Branch2]
|
C1%11CCN6CC1.c18nc9co1.c1%10coc(O)n1.C48=O.C59=O.[C@H]7%11C.C6%10=O.CO4.N57
|
C[C@@H]1[C@H](NC(=O)c2ccnn2C(C)(C)C)CCCN1C(=O)C1C[C@@H]2C[C@H]2C1
|
C[C@@H][C@H]NC=O)cccnn5CC)C)C)))))))))CCCN6C=O)CC[C@@H]C[C@H]3C6
|
[C][C@@H1][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][C][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][Ring1][=Branch1]
|
C[C@@H]1[C@H]5CCCN14.c16ccnn18.C17C[C@@H]2C[C@H]2C1.C8(C)(C)C.C36=O.C47=O.N35
|
O=C(COCCc1ccccc1)NCC1(CNC(=O)c2cc(Br)co2)CCC1
|
O=CCOCCcccccc6))))))))))NCCCNC=O)cccBr)co5))))))))CCC4
|
[O][=C][Branch1][=N][C][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][O][Ring1][=Branch1][C][C][C][Ring1][=C]
|
c14ccccc1.c1%10cc(Br)co1.C1%11%12CCC1.O=C3C6.C7C4.C5%10=O.O67.N38.C8%11.C9%12.N59
|
CCN(C(=O)[C@H](C)c1cccc(Br)c1)[C@H](C)CNC(=O)CCCSC
|
CCNC=O)[C@H]C)cccccBr)c6))))))))[C@H]C)CNC=O)CCCSC
|
[C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][S][C]
|
c18cccc(Br)c1.C3(=O)CCC7.C2(=O)[C@@H]8C.[C@@H]5(C)C6.N245.CC4.N36.S7C
|
CC(C)[C@H]1COCCN(C(=O)[C@@H](C)CNC(=O)c2cn(C)cn2)C1
|
CCC)[C@H]COCCNC=O)[C@@H]C)CNC=O)ccnC)cn5))))))))))C7
|
[C][C][Branch1][C][C][C@H1][C][O][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][C][=N][Ring1][=Branch1][C][Ring2][Ring1][Branch1]
|
[C@H]17COCCN3C1.C3(=O)[C@@H](C)C5.c16cn(C)cn1.CC7C.C46=O.N45
|
Cc1ncc(C(=O)Nc2ccc(NC(=O)c3cccc(C(F)(F)F)n3)c(C)c2)[nH]1
|
CcnccC=O)NccccNC=O)cccccCF)F)F))n6))))))))cC)c6))))))))[nH]5
|
[C][C][=N][C][=C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][C][Branch1][C][C][=C][Ring2][Ring1][Ring2][NH1][Ring2][Ring1][N]
|
c16ccc7c(C)c1.c19cccc%10n1.Cc1ncc8[nH]1.C%10(F)(F)F.C48=O.C59=O.N46.N57
|
O=C(NC[C@@H]1CCCN1c1ccccc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1n1cccn1
|
O=CNC[C@@H]CCCN5cccccc6[N+]=O)[O-])))))))))))))))[C@H]CCCC[C@@H]6ncccn5
|
[O][=C][Branch2][Ring1][#Branch1][N][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=C][C][=N][Ring1][Branch1]
|
c14ccccc1[N+](=O)[O-].[C@H]15CCCC[C@@H]17.[C@@H]16CCCN14.n17cccn1.O=C25.N23.C36
|
Cc1c(C(=O)NC2([C@@H]3CCN(C(=O)c4cnc(Cl)s4)C3)CC2)ccc2c1CCC2
|
CccC=O)NC[C@@H]CCNC=O)ccncCl)s5))))))C5)))))CC3)))))cccc6CCC5
|
[C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch2][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Cl][S][Ring1][=Branch1][C][Ring1][=N][C][C][Ring1][S][C][=C][C][=C][Ring2][Ring1][=Branch2][C][C][C][Ring1][Branch1]
|
Cc1c9ccc2c1CCC2.C17([C@@H]2CCN6C2)CC1.c18cnc(Cl)s1.C59=O.C68=O.N57
|
CN1CC(C(=O)N(C)[C@@H]2CCCC[C@H]2N(C)C(=O)Cc2ccc3[nH]ccc3c2)C1
|
CNCCC=O)NC)[C@@H]CCCC[C@H]6NC)C=O)Ccccc[nH]ccc5c9))))))))))))))))))))C4
|
[C][N][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][C][=C][NH1][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring2][Ring1][N]
|
c19ccc2[nH]ccc2c1.[C@@H]16CCCC[C@H]17.CN1CC8C1.C5(=O)C9.C48=O.N46C.N57C
|
O=C(N[C@H]1CCN(C(=O)C[C@@H]2CCCCCO2)C[C@@H]1O)c1ccc2nc[nH]c2c1
|
O=CN[C@H]CCNC=O)C[C@@H]CCCCCO7)))))))))C[C@@H]6O))))))))ccccnc[nH]c5c9
|
[O][=C][Branch2][Ring1][O][N][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@@H1][C][C][C][C][C][O][Ring1][#Branch1][C][C@@H1][Ring1][S][O][C][=C][C][=C][N][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2]
|
c16ccc2nc[nH]c2c1.[C@H]15CCN4C[C@@H]1O.[C@@H]17CCCCCO1.C4(=O)C7.O=C36.N35
|
O=C(N[C@H]1C[C@@H](NC(=O)[C@H]2CCC[C@H]2O)C1)c1ccsc1C(F)F
|
O=CN[C@H]C[C@@H]NC=O)[C@H]CCC[C@H]5O))))))))C4)))))cccsc5CF)F
|
[O][=C][Branch2][Ring1][#Branch1][N][C@H1][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C@H1][C][C][C][C@H1][Ring1][Branch1][O][C][Ring1][=N][C][C][=C][S][C][=Ring1][Branch1][C][Branch1][C][F][F]
|
[C@H]17CCC[C@H]1O.c18ccsc19.[C@H]15C[C@@H]6C1.O=C38.C47=O.C9(F)F.N35.N46
|
CC=C[C@@H](O)C(=O)N1CC(CCNC(=O)c2coc(S(=O)(=O)NC)c2)(OC)C1
|
CC=C[C@@H]O)C=O)NCCCCNC=O)ccocS=O)=O)NC)))c5)))))))))OC))C4
|
[C][C][=C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch2][C][C][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][Ring1][#Branch2][Branch1][Ring1][O][C][C][Ring2][Ring1][Branch1]
|
c18coc(S7(=O)=O)c1.C=9[C@@H](O)C3=O.N13CC5%10C1.C%10C6.C48=O.CC=9.N46.N7C.O5C
|
C#CCC1(C(=O)N2CC[C@@H](C(=O)N[C@@H]3CCCOC34CCC4)O2)CCCC1
|
C#CCCC=O)NCC[C@@H]C=O)N[C@@H]CCCOC6CCC4)))))))))))O5))))))CCCC5
|
[C][#C][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][C][C][Ring1][Ring2][O][Ring1][P][C][C][C][C][Ring2][Ring1][Branch2]
|
[C@@H]16CCCOC12CCC2.C8(=O)N1CC[C@@H]7O1.C189CCCC1.C#CC9.C57=O.N56
|
C[C@@H]1NC(=O)NC(CN2CCCC[C@H]2c2cnn(C)c2)=C1C(=O)O
|
C[C@@H]NC=O)NCCNCCCC[C@H]6ccnnC)c5))))))))))))=C6C=O)O
|
[C][C@@H1][N][C][=Branch1][C][=O][N][C][Branch2][Ring1][Ring2][C][N][C][C][C][C][C@H1][Ring1][=Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][=C][Ring2][Ring1][Ring2][C][=Branch1][C][=O][O]
|
C[C@@H]1NC(=O)NC(C3)=C1C(=O)O.N13CCCC[C@H]14.c14cnn(C)c1
|
O=S(=O)(c1ccccc1Cn1cc(CNC2CCC2)nn1)N1CCOCC1
|
O=S=O)cccccc6CnccCNCCCC4))))))nn5))))))))))))NCCOCC6
|
[O][=S][=Branch1][C][=O][Branch2][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=C][Branch1][=Branch2][C][N][C][C][C][C][Ring1][Ring2][N][=N][Ring1][O][N][C][C][O][C][C][Ring1][=Branch1]
|
O=S4(=O)c1ccccc18.n16cc7nn1.N14CCOCC1.C15CCC1.C68.C37.N35
|
CC[C@@H](O)CC(=O)NCc1cccc(NC(=O)c2ccn(CC)c2C)c1
|
CC[C@@H]O)CC=O)NCcccccNC=O)cccnCC))c5C))))))))c6
|
[C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring1][C][C][C][=Ring1][#Branch1][C][=C][Ring1][P]
|
CC[C@@H](O)CC3=O.c19cccc6c1.c17ccn8c1C.C47=O.N35.C59.N46.C8C
|
O=C(C/C=C/CNC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)NCC(F)F
|
O=CC/C=C/CNC=O)[C@@H]C[C@H]CC[C@H]6C5)))))))))))))NCCF)F
|
[O][=C][Branch2][Ring1][Branch1][C][/C][=C][/C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][C][C][C@H1][Ring1][=Branch1][C][Ring1][Branch1][N][C][C][Branch1][C][F][F]
|
[C@@H]17C[C@H]2CC[C@H]1C2.O=C3CC=8.C6C(F)F.C=8C5.C47=O.N45.N36
|
COCC[C@H](C)NC(=O)[C@H]1CC2(CCC2)CN1C(=O)c1coc(SC)c1
|
COCC[C@H]C)NC=O)[C@H]CCCCC4)))CN5C=O)ccocSC))c5
|
[C][O][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][O][C][Branch1][Ring1][S][C][=C][Ring1][#Branch1]
|
[C@H]17CC2(CCC2)CN14.c18coc9c1.C5C[C@@H]6C.C37=O.C48=O.CO5.N36.S9C
|
CS(=O)(=O)C1(c2cccc(C(=O)OC3CCN(c4ccc(Cl)cn4)CC3)c2)CC1
|
CS=O)=O)CcccccC=O)OCCCNccccCl)cn6))))))CC6))))))))c6))))))CC3
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch2][Ring2][#Branch1][C][=C][C][=C][C][Branch2][Ring1][O][C][=Branch1][C][=O][O][C][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1][C][C][Ring1][=N][=C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2]
|
CS(=O)(=O)C19CC1.c19cccc8c1.C16CCN7CC1.c17ccc(Cl)cn1.C58=O.O56
|
COc1ncc(C(=O)N[C@H](C)CNC(=O)c2csc3cc(C)ccc23)cc1Cl
|
COcnccC=O)N[C@H]C)CNC=O)ccscccC)ccc96)))))))))))))))cc6Cl
|
[C][O][C][=N][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][S][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=C][Ring2][Ring1][=Branch2][Cl]
|
c1%10csc2cc(C)ccc12.c16ncc9cc1Cl.[C@@H]7(C)C8.C49=O.C5%10=O.CO6.N47.N58
|
COCCCOCC(=O)N[C@@H](C(=O)N[C@H]1C[C@H](C)C1)C(C)C
|
COCCCOCC=O)N[C@@H]C=O)N[C@H]C[C@H]C)C4))))))CC)C
|
[C][O][C][C][C][O][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][C][C][C][Ring1][Branch1][C][Branch1][C][C][C]
|
[C@H]7(C3=O)C(C)C.[C@H]18C[C@H](C)C1.C4CC5.C6C2=O.CO4.O56.N27.N38
|
C=C1C[C@H]1C(=O)N[C@@H](C)c1nc(C(=O)NCC2(C3(O)CCC3)CC2)co1
|
C=CC[C@H]3C=O)N[C@@H]C)cncC=O)NCCCO)CCC4))))CC3))))))co5
|
[C][=C][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=N][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][#Branch2][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][C][Ring1][Branch2][=C][O][Ring1][P]
|
C1%11(C2(O)CCC2)CC1.c1%10nc8co1.C=C1C[C@H]19.C49=O.[C@@H]6%10C.C58=O.N46.N57.C7%11
|
CC(C)(C(=O)N[C@@H]1CN(C(=O)c2csc(C(N)=O)n2)CC2(CCC2)C1)C1CCC1
|
CCC)C=O)N[C@@H]CNC=O)ccscCN)=O))n5))))))CCCCC4)))C6))))))))CCCC4
|
[C][C][Branch1][C][C][Branch2][Ring2][O][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][S][C][Branch1][=Branch1][C][Branch1][C][N][=O][=N][Ring1][Branch2][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Ring1][C][C][C][C][Ring1][Ring2]
|
[C@@H]15CN4CC2(CCC2)C1.CC8(C)C3=O.c16csc7n1.C18CCC1.C46=O.C7(N)=O.N35
|
COCC(C)(C)C(=O)N(C)C[C@H](C)CNC(=O)C=C1C[C@H]2CC[C@@H](C1)N2C
|
COCCC)C)C=O)NC)C[C@H]C)CNC=O)C=CC[C@H]CC[C@@H]C7)N5C
|
[C][O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C]
|
C1=8C[C@H]2CC[C@@H](C1)N2C.C5C(C)(C)C3=O.C6[C@H](C)C7.C4(=O)C=8.N36C.CO5.N47
|
CC(C)C[C@@H](F)C(=O)NCCC1CCN(C(=O)COC(C)C)CC1
|
CCC)C[C@@H]F)C=O)NCCCCCNC=O)COCC)C)))))CC6
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][Ring1][=N]
|
CC(C)C[C@@H](F)C2=O.C17CCN3CC1.C3(=O)C4.C6C7.C5(C)C.N26.O45
|
COc1ccccc1C(=O)N[C@@H]1C[C@H]1C(=O)NC1CC(C)C1
|
COcccccc6C=O)N[C@@H]C[C@H]3C=O)NCCCC)C4
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][C][Ring1][Branch1]
|
c14ccccc18.C16CC(C)C1.[C@@H]15C[C@H]17.C28=O.C37=O.CO4.N25.N36
|
C[C@H]1CN(C(=O)c2cc[nH]c(=N)c2)CCCN1C(=O)c1cc(=O)n(C)cn1
|
C[C@H]CNC=O)ccc[nH]c=N)c6)))))))CCCN7C=O)ccc=O)nC)cn6
|
[C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][NH1][C][=Branch1][C][=N][C][=Ring1][#Branch1][C][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][=N][Ring1][Branch2]
|
C[C@H]1CN3CCCN14.c15cc(=O)n(C)cn1.c16cc[nH]c(=N)c1.C36=O.C45=O
|
CCN(Cc1cccnc1)C(=O)[C@H]1C[C@H]1NC(=O)c1ccc(F)c(F)c1Cl
|
CCNCccccnc6)))))))C=O)[C@H]C[C@H]3NC=O)ccccF)cF)c6Cl
|
[C][C][N][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][Cl]
|
c18ccc(F)c(F)c1Cl.c19cccnc1.[C@H]17C[C@H]16.N245.C27=O.C38=O.CC4.C59.N36
|
C=CCSCC(=O)N[C@@H]1C[C@H](C)N(C(=O)CC(C)C)C1
|
C=CCSCC=O)N[C@@H]C[C@H]C)NC=O)CCC)C))))C5
|
[C][=C][C][S][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Ring1][N]
|
[C@@H]16C[C@H](C)N3C1.C3(=O)CC(C)C.C5C2=O.C=CC4.S45.N26
|
Cc1ncc(C(=O)N2CC[C@H](C(=O)N(C)[C@H]3CC[C@@H]3C)C23CCC3)cn1
|
CcnccC=O)NCC[C@H]C=O)NC)[C@H]CC[C@@H]4C)))))))C5CCC4)))))))))cn6
|
[C][C][=N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][S][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][C@@H1][Ring1][Ring2][C][C][Ring1][=C][C][C][C][Ring1][Ring2][C][=N][Ring2][Ring1][=Branch2]
|
N14CC[C@H]7C12CCC2.Cc1ncc8cn1.[C@H]16CC[C@@H]1C.C48=O.C57=O.N56C
|
C[C@H](O)C(=O)N1[C@@H]2CC[C@H]1CN(C(=O)CSc1ccc(Cl)cc1Cl)C2
|
C[C@H]O)C=O)N[C@@H]CC[C@H]5CNC=O)CSccccCl)cc6Cl))))))))))C7
|
[C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][Ring2][Ring1][Ring1]
|
N13[C@@H]2CC[C@H]1CN4C2.c16ccc(Cl)cc1Cl.C[C@H](O)C3=O.C4(=O)C5.S56
|
CCn1cc([C@H](NCCn2ncnn2)c2nnnn2CCCF)cn1
|
CCncc[C@H]NCCnncnn5))))))))cnnnn5CCCF))))))))))cn5
|
[C][C][N][C][=C][Branch2][Ring1][=Branch2][C@H1][Branch1][O][N][C][C][N][N][=C][N][=N][Ring1][Branch1][C][=N][N][=N][N][Ring1][Branch1][C][C][C][F][C][=N][Ring2][Ring1][#Branch1]
|
n15cc9cn1.c18nnnn17.n16ncnn1.C7CCF.[C@@H]389.C4C6.CC5.N34
|
Cc1cc(C(=O)N2CC3(CC[C@H](CNC(=O)Cc4sccc4Cl)O3)C2)no1
|
CcccC=O)NCCCC[C@H]CNC=O)Ccsccc5Cl))))))))))O5))))C4)))))no5
|
[C][C][=C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][C][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][S][C][=C][C][=Ring1][Branch1][Cl][O][Ring1][S][C][Ring2][Ring1][Ring1][=N][O][Ring2][Ring1][#Branch2]
|
N15CC2(CC[C@H]9O2)C1.Cc1cc8no1.c1%10sccc1Cl.C6(=O)C%10.C58=O.C79.N67
|
Cn1nccc1C=CC(=O)N[C@H]1COCCN(C(=O)C[C@H]2CSCCO2)C1
|
Cnnccc5C=CC=O)N[C@H]COCCNC=O)C[C@H]CSCCO6))))))))C7
|
[C][N][N][=C][C][=C][Ring1][Branch1][C][=C][C][=Branch1][C][=O][N][C@H1][C][O][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@H1][C][S][C][C][O][Ring1][=Branch1][C][Ring1][S]
|
[C@H]15COCCN4C1.Cn1nccc1C=6.[C@H]17CSCCO1.C=6C3=O.C4(=O)C7.N35
|
CCC1(CC)CCCN(c2ccnc(NCC3CC=CC3)n2)C1
|
CCCCC))CCCNcccncNCCCC=CC5)))))))n6))))))C6
|
[C][C][C][Branch1][Ring1][C][C][C][C][C][N][Branch2][Ring1][Ring2][C][=C][C][=N][C][Branch1][#Branch2][N][C][C][C][C][=C][C][Ring1][Branch1][=N][Ring1][=N][C][Ring2][Ring1][Branch1]
|
C178CCCN5C1.c15ccnc6n1.C19CC=CC1.CC7.C8C.N46.C49
|
COC(=O)c1cc(CCCN[C@](C)(C(N)=O)c2cccc(Cl)c2)on1
|
COC=O)cccCCCN[C@]C)CN)=O))cccccCl)c6)))))))))))on5
|
[C][O][C][=Branch1][C][=O][C][C][=C][Branch2][Ring1][O][C][C][C][N][C@][Branch1][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][O][N][=Ring2][Ring1][Branch1]
|
c18cccc(Cl)c1.c16cc7on1.[C@]58(C)C(N)=O.C7CC4.C36=O.CO3.N45
|
CNC1(C(N)=O)CCN(C(=O)c2ccc(CCC(F)(F)F)cc2)CC1
|
CNCCN)=O))CCNC=O)ccccCCCF)F)F))))cc6)))))))CC6
|
[C][N][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][C][C][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][N][C][C][Ring2][Ring1][#Branch1]
|
C145CCN3CC1.c16ccc7cc1.C7CC(F)(F)F.C5(N)=O.C36=O.CN4
|
CCC[C@H](CCCNC(=O)c1ccc(F)c(C)c1)NC(=O)c1cc2[nH]ccc2s1
|
CCC[C@H]CCCNC=O)ccccF)cC)c6)))))))))))NC=O)ccc[nH]ccc5s8
|
[C][C][C][C@H1][Branch2][Ring1][#Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][C][=C][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][NH1][C][=C][C][=Ring1][Branch1][S][Ring1][Branch2]
|
CCC[C@@H]5CCC6.c18ccc(F)c(C)c1.c17cc2[nH]ccc2s1.C38=O.C47=O.N36.N45
|
COC[C@@H](C)C(=O)N1CCN(C(=O)[C@H]2CCCCN2C2CCCC2)C[C@@H]1C(C)C
|
COC[C@@H]C)C=O)NCCNC=O)[C@H]CCCCN6CCCCC5))))))))))))C[C@@H]6CC)C
|
[C][O][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@H1][C][C][C][C][N][Ring1][=Branch1][C][C][C][C][C][Ring1][Branch1][C][C@@H1][Ring2][Ring1][Ring1][C][Branch1][C][C][C]
|
N13CCN4C[C@@H]18.[C@H]17CCCCN16.C5[C@@H](C)C3=O.C16CCCC1.C47=O.C8(C)C.CO5
|
CN(C[C@@H](O)CN(C)C(=O)[C@H]1CCNc2cc(F)ccc21)C(=O)CCS(N)(=O)=O
|
CNC[C@@H]O)CNC)C=O)[C@H]CCNcccF)ccc6%10)))))))))))))))C=O)CCSN)=O)=O
|
[C][N][Branch2][Ring1][S][C][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][O][C][=Branch1][C][=O][C][C][S][Branch1][C][N][=Branch1][C][=O][=O]
|
C3(=O)[C@H]1CCNc2cc(F)ccc21.C4(=O)CCS(N)(=O)=O.C5[C@@H](O)C6.CN45.N36C
|
CCN(CC)[C@H]1CCN(c2nc(N3CCC(F)CC3)nc3c2COCC3)C1
|
CCNCC))[C@H]CCNcncNCCCF)CC6))))))ncc6COCC6))))))))))C5
|
[C][C][N][Branch1][Ring1][C][C][C@H1][C][C][N][Branch2][Ring1][N][C][=N][C][Branch1][N][N][C][C][C][Branch1][C][F][C][C][Ring1][#Branch1][=N][C][=C][Ring1][=N][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
c16nc7nc2c1COCC2.N17CCC(F)CC1.[C@H]18CCN6C1.N458.CC4.C5C
|
CC[C@@H](C(=O)N[C@H](C)/C=C/C(=O)NCC(CC)(CC)CO)C(=O)OC
|
CC[C@@H]C=O)N[C@H]C)/C=C/C=O)NCCCC))CC))CO)))))))))))C=O)OC
|
[C][C][C@@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][/C][=C][/C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][O][C][=Branch1][C][=O][O][C]
|
CC[C@H](C1=O)C2=O.C5C(CC)(CC)CO.[C@@H]4(C)C=6.C=6C3=O.N24.N35.O1C
|
Cc1nnc(C(=O)NCC2([C@@H](C)NC(=O)CCc3nccn3C)CC2)s1
|
CcnncC=O)NCC[C@@H]C)NC=O)CCcnccn5C)))))))))))CC3))))))s5
|
[C][C][=N][N][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][=N][C][=C][N][Ring1][Branch1][C][C][C][Ring1][S][S][Ring2][Ring1][=Branch2]
|
Cc1nnc8s1.c19nccn1C.C5(=O)CC9.C1%10%11CC1.C48=O.[C@H]7%11C.N46.C6%10.N57
|
O=C(CCCn1ccnn1)NCCCOCCNC(=O)[C@@H]1CC[C@@H]1c1nc[nH]n1
|
O=CCCCnccnn5))))))))NCCCOCCNC=O)[C@@H]CC[C@@H]4cnc[nH]n5
|
[O][=C][Branch1][O][C][C][C][N][C][=C][N][=N][Ring1][Branch1][N][C][C][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Ring1][Ring2][C][N][=C][NH1][N][=Ring1][Branch1]
|
O=C2CCC9.n19ccnn1.[C@@H]18CC[C@@H]1%10.c1%10nc[nH]n1.C6CC4.C5C7.C38=O.N26.O45.N37
|
C[C@@H](C#N)C1CCN(C(=O)C2(C)CCN(C(=O)[C@H](F)c3ccccc3)CC2)CC1
|
C[C@@H]C#N))CCCNC=O)CC)CCNC=O)[C@H]F)cccccc6))))))))CC6)))))))CC6
|
[C][C@@H1][Branch1][Ring1][C][#N][C][C][C][N][Branch2][Ring2][C][C][=Branch1][C][=O][C][Branch1][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][P][C][C][Ring2][Ring1][=Branch2]
|
C16(C)CCN5CC1.C17CCN4CC1.c18ccccc1.C5(=O)[C@@H]8F.C[C@H]7C#N.C46=O
|
C[C@]1(C(=O)N2CC[C@@H](NC(=O)C3CCC4(CC3)OCCO4)C2)C=CCCC1
|
C[C@]C=O)NCC[C@@H]NC=O)CCCCCC6))OCCO5))))))))))C5))))))C=CCCC6
|
[C][C@][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][C][C][=C][C][C][C][Ring2][Ring1][#Branch2]
|
C19CCC2(CC1)OCCO2.C[C@]18C=CCCC1.N15CC[C@@H]7C1.C58=O.C69=O.N67
|
Cc1ncoc1C(=O)N1CC(CNC(=O)C[C@@H]2COC(=O)C2)(C(N)=O)C1
|
Ccncoc5C=O)NCCCNC=O)C[C@@H]COC=O)C5)))))))))CN)=O))C4
|
[C][C][N][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C@@H1][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring2][Ring1][C]
|
Cc1ncoc16.N13CC78C1.[C@@H]19COC(=O)C1.C4(=O)C9.C36=O.C7(N)=O.C58.N45
|
C=C[C@@H](C)C(=O)N1CCC(C)(NC(=O)c2cc(C)c(=O)n(C)c2)CC1
|
C=C[C@@H]C)C=O)NCCCC)NC=O)cccC)c=O)nC)c6))))))))CC6
|
[C][=C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=Ring1][=Branch2][C][C][Ring2][Ring1][Ring1]
|
c16cc(C)c(=O)n(C)c1.N13CCC5(C)CC1.C=C[C@@H](C)C3=O.C46=O.N45
|
CC(C)C(=O)N1CC[C@@H]2C[C@H](NC(=O)C(F)(F)c3cncs3)CC[C@@H]2C1
|
CCC)C=O)NCC[C@@H]C[C@H]NC=O)CF)F)ccncs5))))))))CC[C@@H]6C%10
|
[C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][N][=C][S][Ring1][Branch1][C][C][C@@H1][Ring1][P][C][Ring2][Ring1][Branch1]
|
N14CC[C@@H]2C[C@H]6CC[C@@H]2C1.C5(=O)C7(F)F.CC(C)C4=O.c17cncs1.N56
|
CCOC1CCN(C(=O)CCC[C@@H](CC)NC(=O)c2noc(CC)c2C)CC1
|
CCOCCCNC=O)CCC[C@@H]CC))NC=O)cnocCC))c5C)))))))))))))CC6
|
[C][C][O][C][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C][C][C][C@@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C][=N][O][C][Branch1][Ring1][C][C][=C][Ring1][#Branch1][C][C][C][Ring2][Ring1][=Branch2]
|
C3(=O)CCC[C@H]7CC.C16CCN3CC1.c18noc9c1C.C48=O.CC5.O56.N47.C9C
|
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