SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCN(CC)C(=O)C1(NC(=O)c2cnn3c2OC[C@@H](N)C3)CCCCC1
|
CCNCC))C=O)CNC=O)ccnnc5OC[C@@H]N)C6)))))))))))CCCCC6
|
[C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][O][C][C@@H1][Branch1][C][N][C][Ring1][#Branch1][C][C][C][C][C][Ring2][Ring1][Ring1]
|
c1%10cnn2c1OC[C@@H](N)C2.C189CCCCC1.N467.C49=O.C5%10=O.CC6.C7C.N58
|
COCCn1cc(C(=O)N2CC[C@@H]3CN(C(=O)[C@H]4CN(C)C(=O)N4)CC[C@@H]32)nn1
|
COCCnccC=O)NCC[C@@H]CNC=O)[C@H]CNC)C=O)N5))))))CC[C@@H]69))))))))))nn5
|
[C][O][C][C][N][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][N][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][C@@H1][Ring1][#C][Ring2][Ring1][C][N][=N][Ring2][Ring1][=Branch2]
|
N15CC[C@@H]2CN6CC[C@@H]21.[C@H]18CN(C)C(=O)N1.n1%10cc9nn1.C7C%10.C59=O.C68=O.CO7
|
C=CC[C@H](CNC(=O)CCn1cccnc1=O)NC(=O)CSc1cccc(C)c1
|
C=CC[C@H]CNC=O)CCncccnc6=O))))))))))))NC=O)CScccccC)c6
|
[C][=C][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][N][C][=C][C][=N][C][Ring1][=Branch1][=O][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1]
|
n17cccnc1=O.c18cccc(C)c1.C=CC[C@@H]4C5.C2(=O)CC7.C3(=O)C6.N25.N34.S68
|
COc1ccc2c(C(=O)N3CC(O)([C@H](C)NC(=O)[C@@H]4CC=CCO4)C3)cnn2c1
|
COcccccC=O)NCCO)[C@H]C)NC=O)[C@@H]CC=CCO6)))))))))C4)))))cnn5c9
|
[C][O][C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch2][Ring1][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][=C][C][O][Ring1][=Branch1][C][Ring1][S][C][=N][N][Ring2][Ring1][#Branch1][C][=Ring2][Ring1][O]
|
c17ccc2c%10cnn2c1.N15CC%11(O)C1.[C@@H]19CC=CCO1.C5%10=O.[C@@H]8%11C.C69=O.CO7.N68
|
CC(C)[C@H](NC(=O)[C@H]1C[C@H]1F)C1CCN(C(=O)Cn2ncnn2)CC1
|
CCC)[C@H]NC=O)[C@H]C[C@H]3F))))))CCCNC=O)Cnncnn5)))))))CC6
|
[C][C][Branch1][C][C][C@H1][Branch1][N][N][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][F][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][N][=C][N][=N][Ring1][Branch1][C][C][Ring1][=C]
|
C18CCN4CC1.CC(C)[C@H]58.n17ncnn1.[C@H]16C[C@H]1F.C4(=O)C7.C36=O.N35
|
CN(C)C[C@@H](NC(=O)C1CC2(CCCO2)C1)C(=O)NC1CCCCCC1
|
CNC)C[C@@H]NC=O)CCCCCCO5))))C4))))))C=O)NCCCCCCC7
|
[C][N][Branch1][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][Branch1][#Branch1][C][C][C][O][Ring1][Branch1][C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][Ring1][#Branch1]
|
C18CC2(CCCO2)C1.C17CCCCCC1.C5[C@@H]6C4=O.CN5C.C38=O.N36.N47
|
CC=C(CC)C(=O)N(C)[C@H](CC(F)F)C(=O)N1C[C@@H](O)CO1
|
CC=CCC))C=O)NC)[C@H]CCF)F)))C=O)NC[C@@H]O)CO5
|
[C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][O][Ring1][=Branch1]
|
[C@@H]3(CC(F)F)C(=O)N1C[C@@H](O)CO1.C=4(CC)C2=O.N23C.CC=4
|
CCN(CCNC(=O)c1cc(Cl)ncc1F)c1nc(C)cc(C(F)(F)F)n1
|
CCNCCNC=O)cccCl)ncc6F)))))))))))cncC)ccCF)F)F))n6
|
[C][C][N][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][F][C][=N][C][Branch1][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][O]
|
c17cc(Cl)ncc1F.c16nc8cc(C)n1.C8(F)(F)F.N346.C4C5.C27=O.CC3.N25
|
Cc1ocnc1C(=O)N1[C@H](C(=O)N[C@H](C)C2CC2)CCC12CC2
|
Ccocnc5C=O)N[C@H]C=O)N[C@H]C)CCC3))))))CCC5CC3
|
[C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][#C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][C][C][C][Ring1][=N][C][C][Ring1][Ring1]
|
N13[C@H]6CCC12CC2.Cc1ocnc17.C37=O.C46=O.[C@H]58C.C18CC1.N45
|
CCC(=CC(=O)N1CCN(C(=O)c2c[nH]nc2OC)CC1)c1ccc(OC)cc1
|
CCC=CC=O)NCCNC=O)cc[nH]nc5OC))))))))CC6))))))))ccccOC))cc6
|
[C][C][C][=Branch2][Ring1][=N][=C][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][O][C][C][C][Ring1][#C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2]
|
CCC=8c1ccc6cc1.N13CCN4CC1.c17c[nH]nc15.C=8C3=O.C47=O.O5C.O6C
|
Cc1ccc(F)cc1C(=O)N[C@]12C[C@H]1CN(C(=O)C[C@@H](C(F)F)C(C)(C)C)C2
|
CccccF)cc6C=O)N[C@]C[C@H]3CNC=O)C[C@@H]CF)F))CC)C)C)))))C6
|
[C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@][C][C@H1][Ring1][Ring1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C@@H1][Branch1][=Branch1][C][Branch1][C][F][F][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][P]
|
C4(=O)C[C@@H](C(F)F)C(C)(C)C.Cc1ccc(F)cc16.[C@]125C[C@H]1CN4C2.C36=O.N35
|
CN(C)C[C@@H](NC(=O)C#CC1CCOCC1)C(=O)N(C)CCCn1ccnc1
|
CNC)C[C@@H]NC=O)C#CCCCOCC6))))))))))C=O)NC)CCCnccnc5
|
[C][N][Branch1][C][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][#C][C][C][C][O][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1]
|
C2(=O)C#CC1CCOCC1.C4[C@@H]5C3=O.n17ccnc1.C6CC7.CN4C.N36C.N25
|
COC1(C(=O)NC/C=C\CNC(=O)c2ccc(CC3CC3)s2)CCOCC1
|
COCC=O)NC/C=C\CNC=O)ccccCCCC3))))s5)))))))))))))CCOCC6
|
[C][O][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][/C][=C][\C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][S][Ring1][=Branch2][C][C][O][C][C][Ring2][Ring1][=Branch2]
|
C17%11CCOCC1.c1%10ccc%13s1.C4%11=O.C8C=%12.C=%12C9.C6%10=O.C15CC1.CO7.N48.N69.C%135
|
C#CCCN1CCC(C(=O)N[C@H]2C[C@H]2CNC(=O)c2cc(CO)c(C)o2)CC1
|
C#CCCNCCCC=O)N[C@H]C[C@H]3CNC=O)cccCO))cC)o5)))))))))))))CC6
|
[C][#C][C][C][N][C][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][O][=C][Branch1][C][C][O][Ring1][Branch2][C][C][Ring2][Ring1][Branch2]
|
N15CCC9CC1.c18cc%11c(C)o1.C#CCC5.[C@H]17C[C@H]1%10.C39=O.C48=O.N37.C6%10.N46.C%11O
|
CN(CCN1CCCCC1)C(=O)C1(C)CN(C(=O)[C@H]2C[C@@H]2C2CC2)C1
|
CNCCNCCCCC6))))))))C=O)CC)CNC=O)[C@H]C[C@@H]3CCC3)))))))C4
|
[C][N][Branch1][O][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][Ring1][Ring1][C][Ring1][=N]
|
N16CCCCC1.C17(C)CN4C1.[C@H]18C[C@@H]1C1CC1.CN35.C5C6.C37=O.C48=O
|
C=CC1(CC(=O)NC2(CNC(=O)Cc3cccnc3)CCOCC2)CCCCC1
|
C=CCCC=O)NCCNC=O)Cccccnc6))))))))))CCOCC6)))))))))CCCCC6
|
[C][=C][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][O][C][C][Ring1][P][C][C][C][C][C][Ring2][Ring1][O]
|
C=CC18CCCCC1.C169CCOCC1.c1%10cccnc1.C8C4=O.C5(=O)C%10.N46.C79.N57
|
CC[C@H](CNC(=O)[C@H]1C[C@@H](C#N)C1)NC(=O)c1c(C)noc1C(C)C
|
CC[C@H]CNC=O)[C@H]C[C@@H]C#N))C4)))))))NC=O)ccC)noc5CC)C
|
[C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][Ring1][C][#N][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][O][C][=Ring1][=Branch1][C][Branch1][C][C][C]
|
c17c(C)noc18.[C@H]16C[C@@H](C#N)C1.CC[C@@H]4C5.C26=O.C37=O.C8(C)C.N25.N34
|
C[C@H](CC1CN(C(=O)c2cncn2C)C1)NC(=O)C1([C@H]2CCCO2)CCOCC1
|
C[C@H]CCCNC=O)ccncn5C)))))))C4)))))NC=O)C[C@H]CCCO5)))))CCOCC6
|
[C][C@H1][Branch2][Ring1][=Branch1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][C][Ring1][N][N][C][=Branch1][C][=O][C][Branch1][Branch2][C@H1][C][C][C][O][Ring1][Branch1][C][C][O][C][C][Ring1][O]
|
C179CCOCC1.c16cncn1C.C18CN3C1.[C@H]19CCCO1.C[C@@H]5C8.C36=O.C47=O.N45
|
Cc1ccn(C)c(=O)c1NC(=O)/C=C/CNC(=O)[C@H]1CCCOCC1
|
CcccnC)c=O)c6NC=O)/C=C/CNC=O)[C@H]CCCOCC7
|
[C][C][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][C][=Ring1][Branch2][N][C][=Branch1][C][=O][/C][=C][/C][N][C][=Branch1][C][=O][C@H1][C][C][C][O][C][C][Ring1][#Branch1]
|
Cc1ccn(C)c(=O)c15.[C@H]16CCCOCC1.C2(=O)C=7.C=7C4.C36=O.N25.N34
|
C[C@@H]1C[C@@]1(C)C(=O)N1CCC[C@@H](C2CCN(C(=O)CCc3nc[nH]n3)CC2)C1
|
C[C@@H]C[C@@]3C)C=O)NCCC[C@@H]CCCNC=O)CCcnc[nH]n5))))))))CC6))))))C6
|
[C][C@@H1][C][C@@][Ring1][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Branch2][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][N][=C][NH1][N][=Ring1][Branch1][C][C][Ring1][#C][C][Ring2][Ring1][Branch1]
|
N14CCC[C@@H](C2CCN5CC2)C1.C[C@@H]1C[C@]16C.C5(=O)CC7.c17nc[nH]n1.C46=O
|
CCCN(CC)c1ccc(C(=O)NC[C@H](C)NC(=O)[C@@H](C#N)C2CC2)cn1
|
CCCNCC))ccccC=O)NC[C@H]C)NC=O)[C@@H]C#N))CCC3))))))))))cn6
|
[C][C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][#N][C][C][C][Ring1][Ring1][C][=N][Ring2][Ring1][Branch1]
|
c19ccc%10cn1.C4(=O)[C@H]%11C#N.C7[C@@H]8C.CCC5.N569.C3%10=O.C1%11CC1.C6C.N37.N48
|
C=C[C@H](CC)CC(=O)N[C@H]1C[C@H](NC(=O)c2cnn3c2NCCC3)C1
|
C=C[C@H]CC))CC=O)N[C@H]C[C@H]NC=O)ccnnc5NCCC6)))))))))))C4
|
[C][=C][C@H1][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][N][C][C][C][Ring1][=Branch1][C][Ring1][S]
|
c18cnn2c1NCCC2.C=C[C@H](CC)CC4=O.[C@H]16C[C@H]7C1.C58=O.N46.N57
|
CCOc1cc(F)cc(CN(C=O)[C@@H]2c3ccccc3C[C@@H]2O)c1
|
CCOcccF)ccCNC=O))[C@@H]cccccc6C[C@@H]9O))))))))))))c6
|
[C][C][O][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring1][Branch1][C][N][Branch1][Ring1][C][=O][C@@H1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@H1][Ring1][=Branch2][O][=C][Ring2][Ring1][Branch1]
|
N6(C=O)[C@@H]1c2ccccc2C[C@@H]1O.c15cc7cc(F)c1.CC4.O45.C67
|
C[C@H]1CCC(=CC(=O)N[C@H]2CCN(C(=O)c3cccc4nnn(C)c34)C2)C1
|
C[C@H]CCC=CC=O)N[C@H]CCNC=O)cccccnnnC)c95))))))))))C5))))))))C5
|
[C][C@H1][C][C][C][=Branch2][Ring2][Branch1][=C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][N][=N][N][Branch1][C][C][C][Ring1][#Branch2][=Ring1][=Branch1][C][Ring1][P][C][Ring2][Ring1][#Branch2]
|
c18cccc2nnn(C)c12.C[C@H]1CCC=9C1.[C@H]17CCN6C1.C=9C5=O.C68=O.N57
|
CC[C@H]1CC[C@H](C(=O)N[C@@H]2CCN(C(=O)CCCNC(N)=O)CC23CCC3)CC1
|
CC[C@H]CC[C@H]C=O)N[C@@H]CCNC=O)CCCNCN)=O)))))))CC6CCC4)))))))))))CC6
|
[C][C][C@H1][C][C][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][N][C][Branch1][C][N][=O][C][C][Ring1][#C][C][C][C][Ring1][Ring2][C][C][Ring2][Ring1][O]
|
[C@@H]18CCN5CC12CCC2.[C@H]1%10CC[C@H]9CC1.C5(=O)CCC7.C49=O.C6(N)=O.CC%10.N48.N67
|
CC=CC=CC(=O)N1CC[C@@]2(NC(=O)c3nc(C)n(-c4nc[nH]n4)n3)CCC[C@H]12
|
CC=CC=CC=O)NCC[C@@]NC=O)cncC)n-cnc[nH]n5)))))n5)))))))CCC[C@H]85
|
[C][C][=C][C][=C][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][N][=C][Branch1][C][C][N][Branch1][Branch2][C][N][=C][NH1][N][=Ring1][Branch1][N][=Ring1][O][C][C][C][C@H1][Ring2][Ring1][=Branch1][Ring2][Ring1][Ring1]
|
N15CC[C@@]27CCC[C@H]12.c18nc(C)n%11n1.c1%11nc[nH]n1.C=%10C5=O.C=9C=%10.C68=O.CC=9.N67
|
C=C[C@]1(O)CCN([C@H](C(=O)NCCC2CC2)c2cc(Cl)cc(C(F)(F)F)c2)C1
|
C=C[C@]O)CCN[C@H]C=O)NCCCCC3)))))))cccCl)ccCF)F)F))c6)))))))C5
|
[C][=C][C@][Branch1][C][O][C][C][N][Branch2][Ring2][Branch1][C@H1][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Ring1][C][=C][C][Branch1][C][Cl][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][C][Ring2][Ring1][#Branch2]
|
C=C[C@]1(O)CCN4C1.c17cc8cc(Cl)c1.[C@H]47C3=O.C8(F)(F)F.C5C6.C16CC1.N35
|
COC(=O)CC1(N(C)CC(=O)[C@H]2CCCc3sccc32)CCCCC1
|
COC=O)CCNC)CC=O)[C@H]CCCcsccc59))))))))))))CCCCC6
|
[C][O][C][=Branch1][C][=O][C][C][Branch2][Ring1][#Branch1][N][Branch1][C][C][C][C][=Branch1][C][=O][C@H1][C][C][C][C][S][C][=C][C][=Ring1][Branch1][Ring1][=Branch2][C][C][C][C][C][Ring2][Ring1][Ring2]
|
C6C(=O)[C@H]1CCCc2sccc21.C157CCCCC1.C4(=O)C7.N56C.CO4
|
C[C@@H]1CCN(C(=O)C2CC(=C3CC3)C2)C[C@H]1CC(=O)N1CCC[C@H]1CN(C)C
|
C[C@@H]CCNC=O)CCC=CCC3)))C4)))))C[C@H]6CC=O)NCCC[C@H]5CNC)C
|
[C][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][=Branch1][=Branch1][=C][C][C][Ring1][Ring1][C][Ring1][#Branch1][C][C@H1][Ring1][#C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][N][Branch1][C][C][C]
|
C[C@@H]1CCN4C[C@H]1%10.N15CCC[C@H]19.C17CC=8C1.C%10C5=O.C47=O.C1=8CC1.N6(C)C.C69
|
CCc1nc(C(=O)N2CC[C@@H](CNC(=O)[C@H]3CCCCN3CC)C23CC3)n[nH]1
|
CCcncC=O)NCC[C@@H]CNC=O)[C@H]CCCCN6CC)))))))))))C5CC3))))))))n[nH]5
|
[C][C][C][=N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][N][Ring1][=Branch1][C][C][C][Ring1][P][C][C][Ring1][Ring1][=N][NH1][Ring2][Ring1][#Branch2]
|
N14CC[C@@H]%11C12CC2.[C@H]18CCCCN17.c1%10nc9n[nH]1.C49=O.C58=O.CC%10.C6%11.N56.C7C
|
CCCN(CCNC(=O)[C@H](C)SC[C@H]1CCCO1)C(=O)CCC(F)(F)F
|
CCCNCCNC=O)[C@H]C)SC[C@H]CCCO5))))))))))))C=O)CCCF)F)F
|
[C][C][C][N][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][S][C][C@H1][C][C][C][O][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)CCC(F)(F)F.C2(=O)[C@@H]7C.[C@H]19CCCO1.CCC4.N345.C5C6.N26.S78.C89
|
CCNC(=O)CCN1CCC(C2CCCCC2)CC1
|
CCNC=O)CCNCCCCCCCCC6))))))CC6
|
[C][C][N][C][=Branch1][C][=O][C][C][N][C][C][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][N]
|
N15CCC(C2CCCCC2)CC1.C3(=O)CC5.CC4.N34
|
CC(=O)NCCNS(=O)(=O)CCC(=O)NC[C@H](C)NC(=O)C1CC(Cl)(Cl)C1
|
CC=O)NCCNS=O)=O)CCC=O)NC[C@H]C)NC=O)CCCCl)Cl)C4
|
[C][C][=Branch1][C][=O][N][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][Cl][Branch1][C][Cl][C][Ring1][=Branch1]
|
S9(=O)(=O)CCC3=O.C1%10CC(Cl)(Cl)C1.C7[C@@H]8C.CC2=O.C5C6.C4%10=O.N25.N69.N37.N48
|
COc1cc(C(=O)N2CCCC[C@@H]2CN(C)C(=O)[C@@H]2CCCC[C@H]2C)[nH]n1
|
COcccC=O)NCCCC[C@@H]6CNC)C=O)[C@@H]CCCC[C@H]6C)))))))))))))))))[nH]n5
|
[C][O][C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][NH1][N][=Ring2][Ring1][=Branch2]
|
N13CCCC[C@@H]19.[C@@H]18CCCC[C@H]1C.c15cc7[nH]n1.C37=O.N46C.C48=O.CO5.C69
|
C=C(C)[C@@H](CC(=O)N[C@@H]1CCN(C(=O)c2c(Br)cccc2OC)C1)OCC
|
C=CC)[C@@H]CC=O)N[C@@H]CCNC=O)ccBr)cccc6OC)))))))))C5))))))))OCC
|
[C][=C][Branch1][C][C][C@@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Branch1][C][Br][C][=C][C][=C][Ring1][#Branch1][O][C][C][Ring1][S][O][C][C]
|
C=C(C)[C@H]5CC3=O.c19c7cccc1Br.[C@@H]18CCN4C1.C49=O.N38.O7C.O56.C6C
|
Cc1nc(C(=O)N2CCCC[C@@H]2CCC(C)C)cn(C)c1=O
|
CcncC=O)NCCCC[C@@H]6CCCC)C)))))))))))cnC)c6=O
|
[C][C][=N][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][C][C][Branch1][C][C][C][=C][N][Branch1][C][C][C][Ring2][Ring1][Ring2][=O]
|
Cc1nc4cn(C)c1=O.N13CCCC[C@@H]15.C5CC(C)C.C34=O
|
CCc1nc(C)cc(=N[C@@H]2CCCC23CN(C(=O)C[C@@H]2C[C@@H]2C)C3)[nH]1
|
CCcncC)cc=N[C@@H]CCCC5CNC=O)C[C@@H]C[C@@H]3C))))))C4)))))))))[nH]6
|
[C][C][C][=N][C][Branch1][C][C][=C][C][=Branch2][Ring1][O][=N][C@@H1][C][C][C][C][Ring1][Branch1][C][N][Branch1][N][C][=Branch1][C][=O][C][C@@H1][C][C@@H1][Ring1][Ring1][C][C][Ring1][O][NH1][Ring2][Ring1][#Branch1]
|
c15nc(C)cc(=N[C@@H]2CCCC23CN4C3)[nH]1.C4(=O)C6.[C@@H]16C[C@@H]1C.CC5
|
C=CCNC(=O)[C@@H]1CN(C(=O)C[C@@H](O)CCCC)C2(CCC2)C1
|
C=CCNC=O)[C@@H]CNC=O)C[C@@H]O)CCCC)))))))CCCC4)))C5
|
[C][=C][C][N][C][=Branch1][C][=O][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][C][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][P]
|
[C@@H]16CN4C2(CCC2)C1.C4(=O)C[C@@H](O)CCCC.C=CC5.C36=O.N35
|
CC(C)NC(=O)C(=O)NCc1ccccc1CNC(=O)C1=C2CCN=C2NC=C1
|
CCC)NC=O)C=O)NCcccccc6CNC=O)C=CCCN=C5NC=C9
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][C][N][=C][Ring1][Branch1][N][C][=C][Ring1][=Branch2]
|
C5(=O)C1=C2CCN=C2NC=C1.c19ccccc1%10.C3(=O)C4=O.CC6C.N36.N47.C79.C8%10.N58
|
O=C(Nc1cc(C(F)(F)F)ncc1I)[C@H]1[C@@H]2CN(Cc3ccc(Br)c(Br)c3)C[C@@H]21
|
O=CNcccCF)F)F))ncc6I))))))))[C@H][C@@H]CNCccccBr)cBr)c6)))))))C[C@@H]56
|
[O][=C][Branch2][Ring1][Branch1][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][=C][Ring1][#Branch2][I][C@H1][C@@H1][C][N][Branch1][S][C][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][Br][=C][Ring1][Branch2][C][C@@H1][Ring1][=C][Ring1][#C]
|
c16cc8ncc1I.c19ccc(Br)c(Br)c1.[C@@H]17[C@H]2CN5C[C@@H]12.C8(F)(F)F.O=C47.N46.C59
|
CC(C)NC(=O)C(=O)NC[C@H](C)C(=O)NCC(C)(C)C(F)(F)F
|
CCC)NC=O)C=O)NC[C@H]C)C=O)NCCC)C)CF)F)F
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C6C(C)(C)C(F)(F)F.C5[C@H](C)C3=O.C1(=O)C2=O.CC4C.N14.N25.N36
|
C[C@H](C(=O)Nc1ccccc1)N1C[C@@H]2C[C@H]1CN2C(=O)C[C@H]1CCNC1=O
|
C[C@H]C=O)Ncccccc6))))))))NC[C@@H]C[C@H]5CN5C=O)C[C@H]CCNC5=O
|
[C][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C@@H1][C][C@H1][Ring1][Branch1][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@H1][C][C][N][C][Ring1][Branch1][=O]
|
N15C[C@@H]2C[C@H]1CN24.c16ccccc1.[C@H]17CCNC1=O.C[C@@H]5C3=O.C4(=O)C7.N36
|
CCCCN1CCc2ccc(N[C@@H](C)C(C)(C)c3ccccc3)cc21
|
CCCCNCCccccN[C@@H]C)CC)C)cccccc6)))))))))cc69
|
[C][C][C][C][N][C][C][C][=C][C][=C][Branch2][Ring1][Branch1][N][C@@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][C][Ring2][Ring1][Branch1]
|
N14CCc2ccc6cc21.[C@H]5(C)C7(C)C.c17ccccc1.CCCC4.N56
|
Cc1cc(C)n(CC(=O)N2CC[C@H](C(=O)N[C@H](C)CCCCCO)O2)n1
|
CcccC)nCC=O)NCC[C@H]C=O)N[C@H]C)CCCCCO)))))))))O5)))))))n5
|
[C][C][C][=C][Branch1][C][C][N][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][S][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][C][C][O][O][Ring1][S][N][=Ring2][Ring1][=Branch2]
|
C6C(=O)N1CC[C@H]5O1.[C@@H]4(C)CCCCCO.Cc1cc(C)n6n1.C35=O.N34
|
C=C[C@H](C)CC(=O)NCC=C1CCN(C(=O)c2cn(CCC)nc2C)CC1
|
C=C[C@H]C)CC=O)NCC=CCCNC=O)ccnCCC)))nc5C)))))))CC6
|
[C][=C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][N][Branch1][Ring2][C][C][C][N][=C][Ring1][Branch2][C][C][C][Ring1][P]
|
C=C[C@H](C)CC3=O.C1=7CCN4CC1.c16cn8nc1C.C5C=7.C46=O.C8CC.N35
|
C[C@H]1C[C@H]1C(=O)N1CCC(N(C)C(=O)[C@@H]2CC(C(C)(C)C)=NO2)CC1
|
C[C@H]C[C@H]3C=O)NCCCNC)C=O)[C@@H]CCCC)C)C))=NO5)))))))CC6
|
[C][C@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch2][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][C][Ring2][Ring1][Ring1]
|
[C@@H]16CC(C(C)(C)C)=NO1.N13CCC5CC1.C[C@H]1C[C@H]17.C37=O.N45C.C46=O
|
C=CCSCC(=O)N1CCCCC[C@@H]1C(=O)Nc1ccn2nccc2c1
|
C=CCSCC=O)NCCCCC[C@@H]7C=O)Ncccnnccc5c9
|
[C][=C][C][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][=C][N][N][=C][C][=C][Ring1][Branch1][C][=Ring1][=Branch2]
|
c17ccn2nccc2c1.N13CCCCC[C@@H]18.C6C3=O.C=CC5.C48=O.S56.N47
|
C[C@H](C1CCCC1)N(C)C(=O)[C@H](NC(=O)CCC1CCC1)c1cccnc1
|
C[C@H]CCCCC5)))))NC)C=O)[C@H]NC=O)CCCCCC4))))))))ccccnc6
|
[C][C@H1][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][Ring2][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
c18cccnc1.C16CCCC1.C2(=O)[C@H]58.C3(=O)CC7.C17CCC1.C[C@@H]46.N24C.N35
|
CC[C@]1(C)C[C@@H]1C(=O)NC[C@@H](Nc1nccc(-n2ccnc2)n1)C(C)C
|
CC[C@]C)C[C@@H]3C=O)NC[C@@H]Ncnccc-nccnc5)))))n6)))))))CC)C
|
[C][C][C@][Branch1][C][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring1][N][C][=N][C][=C][C][Branch1][Branch2][N][C][=C][N][=C][Ring1][Branch1][=N][Ring1][O][C][Branch1][C][C][C]
|
c16nccc9n1.C4[C@@H]5C(C)C.[C@@]18(C)C[C@@H]17.n19ccnc1.C37=O.CC8.N34.N56
|
Cc1nnc2ccc(C(=O)NCCCNC(=O)C[C@H](C)[C@H](C)C(C)C)cn12
|
CcnnccccC=O)NCCCNC=O)C[C@H]C)[C@H]C)CC)C))))))))))))cn96
|
[C][C][=N][N][=C][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C@H1][Branch1][C][C][C][Branch1][C][C][C][=C][N][Ring2][Ring1][#Branch2][Ring2][Ring1][#Branch1]
|
Cc1nnc2ccc7cn12.C4(=O)C[C@H](C)[C@H](C)C(C)C.C5CC6.C37=O.N35.N46
|
CCCCNC(=O)[C@H](CCC(CC)CC)N1CCO[C@H](C2(C)CC2)C1
|
CCCCNC=O)[C@H]CCCCC))CC)))))NCCO[C@H]CC)CC3)))C6
|
[C][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][Branch1][Ring1][C][C][C][C][N][C][C][O][C@H1][Branch1][=Branch2][C][Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][#Branch2]
|
C3(=O)[C@@H]5CCC(CC)CC.N15CCO[C@H]6C1.CCCC4.C16(C)CC1.N34
|
CSCC1(C(=O)N[C@H]2C[C@H]3C[C@@H]2CN(C(=O)c2ccon2)C3)CC1
|
CSCCC=O)N[C@H]C[C@H]C[C@@H]5CNC=O)cccon5))))))C6))))))))))CC3
|
[C][S][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C@H1][C][C@@H1][Ring1][Branch1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][O][N][=Ring1][Branch1][C][Ring1][=N][C][C][Ring2][Ring1][Branch1]
|
[C@H]17C[C@H]2C[C@@H]1CN5C2.c18ccon1.C19%10CC1.C49=O.C58=O.CS6.C6%10.N47
|
COCC[C@H](C)C(=O)NCC=C1CCN(c2ccc([N+](=O)[O-])cc2)CC1
|
COCC[C@H]C)C=O)NCC=CCCNcccc[N+]=O)[O-]))cc6))))))CC6
|
[C][O][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=C][C][C][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C][Ring1][#C]
|
c16ccc([N+](=O)[O-])cc1.C4C[C@H](C)C3=O.C1=7CCN6CC1.C5C=7.CO4.N35
|
C[C@@H](CC(=O)N[C@@H]1CCCCC[C@H]1NC(=O)CC(C)(F)F)c1ccco1
|
C[C@@H]CC=O)N[C@@H]CCCCC[C@H]7NC=O)CCC)F)F)))))))))))))))cccco5
|
[C][C@@H1][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C][C@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][F][F][C][=C][C][=C][O][Ring1][Branch1]
|
[C@@H]14CCCCC[C@H]15.C3(=O)CC(C)(F)F.C[C@H]6CC2=O.c16ccco1.N24.N35
|
Cc1ccn(C[C@@H](C)C(=O)N(C)CC2CN(C(=O)[C@H](O)CCn3cncn3)C2)n1
|
CcccnC[C@@H]C)C=O)NC)CCCNC=O)[C@H]O)CCncncn5)))))))))C4)))))))))n5
|
[C][C][C][=C][N][Branch2][Ring2][=Branch2][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][N][C][=N][C][=N][Ring1][Branch1][C][Ring1][#C][N][=Ring2][Ring1][N]
|
C5(=O)[C@H](O)CC8.Cc1ccn7n1.C7[C@@H](C)C4=O.C19CN5C1.n18cncn1.N46C.C69
|
CC1(C(=O)NC[C@H]2CC3(CCC3)CN2C(=O)[C@H]2CCCC(=O)O2)CCC1
|
CCC=O)NC[C@H]CCCCC4)))CN5C=O)[C@H]CCCC=O)O6)))))))))))))))CCC4
|
[C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@H1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][N][Ring1][Branch2][C][=Branch1][C][=O][C@H1][C][C][C][C][=Branch1][C][=O][O][Ring1][#Branch1][C][C][C][Ring2][Ring1][=Branch2]
|
[C@H]19CC2(CCC2)CN15.[C@H]17CCCC(=O)O1.CC18CCC1.C48=O.C57=O.N46.C69
|
O=C(c1sccc1Cl)N1CCC([C@H]2C[C@@H](NC(=O)C34CC(F)(C3)C4)CCO2)CC1
|
O=Ccsccc5Cl))))))NCCC[C@H]C[C@@H]NC=O)CCCF)C4)C4))))))CCO6))))))CC6
|
[O][=C][Branch1][=Branch2][C][S][C][=C][C][=Ring1][Branch1][Cl][N][C][C][C][Branch2][Ring1][#C][C@H1][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][=Branch1][C][C][O][Ring1][#C][C][C][Ring2][Ring1][Branch1]
|
N15CCC%10CC1.[C@H]1%10C[C@@H]7CCO1.c18sccc1Cl.C129CC(F)(C1)C2.O=C58.C69=O.N67
|
CC[C@]1(C)NC(=O)N(CC(=O)N[C@@H]2[C@H]3C[C@@H]2N(C(=O)c2cc(OC)cs2)C3)C1=O
|
CC[C@]C)NC=O)NCC=O)N[C@@H][C@H]C[C@@H]4NC=O)cccOC))cs5))))))C5)))))))))C5=O
|
[C][C][C@][Branch1][C][C][N][C][=Branch1][C][=O][N][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][S][Ring1][#Branch1][C][Ring1][=C][C][Ring2][Ring1][#Branch2][=O]
|
[C@@]1%10(C)NC(=O)N9C1=O.[C@@H]17[C@H]2C[C@@H]1N5C2.c18cc6cs1.C9C4=O.C58=O.CC%10.N47.O6C
|
CCOc1ccc(NC(=O)C[C@H]2CN(C(=O)COC3(C)CCC3)C(C)(C)C2)cc1
|
CCOccccNC=O)C[C@H]CNC=O)COCC)CCC4)))))))CC)C)C5))))))))cc6
|
[C][C][O][C][=C][C][=C][Branch2][Ring2][Branch1][N][C][=Branch1][C][=O][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][Ring1][S][C][=C][Ring2][Ring1][#Branch2]
|
[C@H]1%11CN5C(C)(C)C1.c19ccc%10cc1.C18(C)CCC1.C4(=O)C%11.C5(=O)C7.CC6.O69.N4%10.O78
|
CCc1occ(C)c1C(=O)N(C)C[C@@H](O)CNC(=O)c1cnc(N)cn1
|
CCcoccC)c5C=O)NC)C[C@@H]O)CNC=O)ccncN)cn6
|
[C][C][C][O][C][=C][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][N][C][=N][Ring1][#Branch1]
|
c18occ(C)c17.c16cnc(N)cn1.C4[C@@H](O)C5.C27=O.N24C.C36=O.CC8.N35
|
C[C@H]1CCN(C(=O)CCN(CCO)C(=O)[C@@H](C)[C@@H]2CCOC2)C[C@@H](C)C1
|
C[C@H]CCNC=O)CCNCCO)))C=O)[C@@H]C)[C@@H]CCOC5)))))))))))C[C@@H]C)C7
|
[C][C@H1][C][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C][C][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C@@H1][C][C][O][C][Ring1][Branch1][C][C@@H1][Branch1][C][C][C][Ring2][Ring1][=Branch2]
|
C[C@H]1CCN3C[C@@H](C)C1.C3(=O)CC5.C4(=O)[C@H]7C.[C@@H]17CCOC1.N456.C6CO
|
CCc1ccc(CC(=O)N2CCC(NC(=O)C[C@H]3CCC[C@H](O)C3)CC2)cc1
|
CCccccCC=O)NCCCNC=O)C[C@H]CCC[C@H]O)C6)))))))))CC6))))))))cc6
|
[C][C][C][=C][C][=C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][C@H1][Branch1][C][O][C][Ring1][#Branch1][C][C][Ring1][P][C][=C][Ring2][Ring1][#Branch2]
|
c18ccc9cc1.N14CCC6CC1.[C@H]17CCC[C@H](O)C1.C9C4=O.C5(=O)C7.CC8.N56
|
Cc1cnc(C(=O)N2CC3(CCN(C(=O)Nc4ccc(C#N)cc4)C3)C2)cn1
|
CccncC=O)NCCCCNC=O)NccccC#N))cc6))))))))C5))))C4)))))cn6
|
[C][C][=C][N][=C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][Ring1][S][C][Ring2][Ring1][Ring1][C][=N][Ring2][Ring1][O]
|
N15CC2(CCN6C2)C1.c18ccc(C#N)cc1.Cc1cnc9cn1.C59=O.C67=O.N78
|
CSc1cc(C(=O)NCC(C)(C)OCC(=O)N(C)Cc2cccc(O)c2)co1
|
CScccC=O)NCCC)C)OCC=O)NC)CcccccO)c6)))))))))))))))co5
|
[C][S][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][=C][O][Ring2][Ring1][#Branch2]
|
c1%10cccc(O)c1.c1%11cc9co1.C7C5(C)C.C6C4=O.C39=O.N48C.CS%11.N37.O56.C8%10
|
CC[C@]1(C)C[C@H]1C(=O)NC[C@]1(F)C[C@@H](CNC(=O)C2(NC(N)=O)CC2)C1
|
CC[C@]C)C[C@H]3C=O)NC[C@]F)C[C@@H]CNC=O)CNCN)=O)))CC3))))))C4
|
[C][C][C@][Branch1][C][C][C][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][C][Ring1][#Branch1][C][Ring1][S]
|
[C@]14(F)C[C@H]5C1.[C@@]1%13(C)C[C@H]1%11.C1%10%12CC1.C3%11=O.C6%12=O.C7(N)=O.CC%13.N38.C84.C95.N69.N7%10
|
CC(C)[C@@](C)(CNC(=O)[C@H](C)c1ncco1)NC(=O)c1ccnn1CC1CCC1
|
CCC)[C@@]C)CNC=O)[C@H]C)cncco5)))))))))NC=O)cccnn5CCCCC4
|
[C][C][Branch1][C][C][C@@][Branch1][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=N][C][=C][O][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][C][C][Ring1][Ring2]
|
CC(C)[C@@]4(C)C5.c16ccnn17.C2(=O)[C@@H]8C.c18ncco1.C19CCC1.C36=O.N25.N34.C79
|
CN(C(=O)c1cc(N)ccc1F)[C@@H]1CCN(C(=O)c2cncc3c2CCCC3)C1
|
CNC=O)cccN)ccc6F))))))))[C@@H]CCNC=O)ccnccc6CCCC6)))))))))))C5
|
[C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][F][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][=Branch1][C][Ring1][P]
|
c18cncc2c1CCCC2.c17cc(N)ccc1F.[C@@H]16CCN5C1.CN46.C47=O.C58=O
|
CC(=O)N(C)[C@H](C)C(=O)N[C@@H](CO)CNC(=O)Cc1coc(C)n1
|
CC=O)NC)[C@H]C)C=O)N[C@@H]CO))CNC=O)CccocC)n5
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][C][=C][O][C][Branch1][C][C][=N][Ring1][=Branch1]
|
c18coc(C)n1.[C@@H]5(C)C3=O.[C@@H]6(C7)CO.C4(=O)C8.CC2=O.N25C.N36.N47
|
C=CCO[C@H](C)C(=O)N1CC2CC1(CNC(=O)c1cccc(C(F)F)c1)C2
|
C=CCO[C@H]C)C=O)NCCCC5CNC=O)cccccCF)F))c6)))))))))C4
|
[C][=C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=C][Ring1][=Branch2][C][Ring1][P]
|
N13CC2CC19C2.c18cccc%10c1.[C@@H]6(C)C3=O.C=CC5.C48=O.C%10(F)F.O56.C79.N47
|
CN(Cc1nccn1C)C(=O)[C@@H]1C=CCCN1C(=O)C[C@@H]1C=CCC1
|
CNCcnccn5C)))))))C=O)[C@@H]C=CCCN6C=O)C[C@@H]C=CCC5
|
[C][N][Branch1][#Branch2][C][C][=N][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][C@@H1][C][=C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C@@H1][C][=C][C][C][Ring1][Branch1]
|
[C@@H]15C=CCCN13.c16nccn1C.[C@@H]17C=CCC1.C3(=O)C7.CN24.C25=O.C46
|
O=C(NC[C@@H]1[C@H]2CN(C(=O)CC3CCCCCCC3)C[C@@H]12)c1ccnn1CCF
|
O=CNC[C@@H][C@H]CNC=O)CCCCCCCCC8))))))))))C[C@@H]65))))))))cccnn5CCF
|
[O][=C][Branch2][Ring1][=C][N][C][C@@H1][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C][Ring1][Branch2][C][C@@H1][Ring1][P][Ring1][S][C][=C][C][=N][N][Ring1][Branch1][C][C][F]
|
C1%10CCCCCCC1.[C@@H]19[C@H]2CN5C[C@@H]12.c17ccnn18.C5(=O)C%10.O=C47.C8CF.N46.C69
|
CCOCCCC(=O)N1C[C@@H](NC(=O)Cc2sc(O)nc2O)CC[C@@H]1C
|
CCOCCCC=O)NC[C@@H]NC=O)CcscO)nc5O)))))))))CC[C@@H]6C
|
[C][C][O][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][S][C][Branch1][C][O][=N][C][=Ring1][=Branch1][O][C][C][C@@H1][Ring1][P][C]
|
N13C[C@@H]7CC[C@@H]1C.c18sc(O)nc1O.C6CCC3=O.C4(=O)C8.CC5.O56.N47
|
CCCC1(C(=O)N[C@H]2CN(C(=O)c3cnc(O)n3C)C3(CCOCC3)C2)CCC1
|
CCCCC=O)N[C@H]CNC=O)ccncO)n5C)))))))CCCOCC6)))))C5)))))))CCC4
|
[C][C][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][N][Ring1][=Branch1][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C][C][C][Ring2][Ring1][#Branch2]
|
[C@H]16CN5C2(CCOCC2)C1.c17cnc(O)n1C.C189CCC1.CCC9.C48=O.C57=O.N46
|
CNC(=O)CCCC(=O)N1CC[C@@H](NC(=O)CN2CCCCCC2=O)C(C)(C)C1
|
CNC=O)CCCC=O)NCC[C@@H]NC=O)CNCCCCCC7=O)))))))))))CC)C)C6
|
[C][N][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][N][C][C][C][C][C][C][Ring1][#Branch1][=O][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][Ring2]
|
N14CC[C@@H]6C(C)(C)C1.C3(=O)CCCC4=O.N17CCCCCC1=O.C5(=O)C7.CN3.N56
|
CC[C@@H](CNC(=O)Cc1ccc2nn[nH]c2c1)NC(=O)[C@@H](CC)C(C)(F)F
|
CC[C@@H]CNC=O)Cccccnn[nH]c5c9)))))))))))))NC=O)[C@@H]CC))CC)F)F
|
[C][C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=N][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][C][C][Branch1][C][C][Branch1][C][F][F]
|
c17ccc2nn[nH]c2c1.C4(=O)[C@@H](CC)C(C)(F)F.CC[C@H]5C6.C3(=O)C7.N36.N45
|
COc1ccccc1OCC(=O)N1CC[C@@H]2CC[C@@]21CNC(=O)c1cccn1C
|
COcccccc6OCC=O)NCC[C@@H]CC[C@@]47CNC=O)ccccn5C
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C@@][Ring1][Ring2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C]
|
N13CC[C@@H]2CC[C@@]21%10.c16ccccc17.c19cccn1C.C5C3=O.C49=O.CO6.O57.C8%10.N48
|
C#Cc1cc(N)cc(C(=O)N2CC(CC=C)(NC(=O)c3ccon3)C2)c1
|
C#CcccN)ccC=O)NCCCC=C)))NC=O)cccon5)))))))C4)))))c6
|
[C][#C][C][=C][C][Branch1][C][N][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][C][=C][Branch1][=N][N][C][=Branch1][C][=O][C][C][=C][O][N][=Ring1][Branch1][C][Ring1][#C][=C][Ring2][Ring1][Branch2]
|
C#Cc1cc8cc(N)c1.N14CC69C1.c17ccon1.C48=O.C9C=C.C57=O.N56
|
Cn1cc([C@H](C(=O)NC2CCC2)N2CCO[C@@H]([C@H]3CCCOC3)C2)c(Br)n1
|
Cncc[C@H]C=O)NCCCC4))))))NCCO[C@@H][C@H]CCCOC6))))))C6)))))))cBr)n5
|
[C][N][C][=C][Branch2][Ring1][P][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring2][N][C][C][O][C@@H1][Branch1][=Branch2][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][N][C][Branch1][C][Br][=N][Ring2][Ring1][#Branch2]
|
Cn1cc7c(Br)n1.N15CCO[C@@H]8C1.[C@H]18CCCOC1.[C@@H]57C4=O.C16CCC1.N46
|
Cc1cncc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc4c(c3)CNC(=O)N4)C2)c1
|
CccnccC=O)NC[C@@H]O)[C@H]NC=O)cccccc6)CNC=O)N6)))))))))))C5))))))c6
|
[C][C][=C][N][=C][C][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][N][Ring1][Branch2][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][N]
|
c19ccc2c(c1)CNC(=O)N2.Cc1cncc8c1.N15C[C@@H]7[C@H](O)C1.C58=O.C69=O.N67
|
C[C@@H]1C(C(=O)N[C@@H]2CN(C(=O)Cc3cnnn3C)C[C@@H]2O)=Cc2ccccc21
|
C[C@@H]CC=O)N[C@@H]CNC=O)Cccnnn5C))))))))C[C@@H]5O))))))))=Ccccccc69
|
[C][C@@H1][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][=C][N][=N][N][Ring1][Branch1][C][C][C@@H1][Ring1][=C][O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][O]
|
C[C@@H]1C(C4=O)=Cc2ccccc21.[C@@H]16CN5C[C@@H]1O.c17cnnn1C.C5(=O)C7.N46
|
C=C1CCN(C(=O)C=Cc2ccccc2C)[C@H](C(=O)N[C@@H](C)CCCO)C1
|
C=CCCNC=O)C=Ccccccc6C))))))))))[C@H]C=O)N[C@@H]C)CCCO)))))))C6
|
[C][=C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][O][C][Ring2][Ring1][#Branch2]
|
C=C1CCN3[C@H]6C1.C=7c1ccccc1C.[C@H]5(C)CCCO.C3(=O)C=7.C46=O.N45
|
CN(C)C[C@H]1COCCN1C(=O)[C@@H](NC(=O)c1nc[nH]n1)C1CC1
|
CNC)C[C@H]COCCN6C=O)[C@@H]NC=O)cnc[nH]n5)))))))CCC3
|
[C][N][Branch1][C][C][C][C@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][N][=C][NH1][N][=Ring1][Branch1][C][C][C][Ring1][Ring1]
|
[C@H]17COCCN12.C2(=O)[C@@H]58.c16nc[nH]n1.CN4C.C36=O.C18CC1.C47.N35
|
CCN(CC)CC(=O)N(C)CC(C)(C)CNC(=O)c1cnc(Br)c(N)n1
|
CCNCC))CC=O)NC)CCC)C)CNC=O)ccncBr)cN)n6
|
[C][C][N][Branch1][Ring1][C][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][=C][N][=C][Branch1][C][Br][C][Branch1][C][N][=N][Ring1][Branch2]
|
c19cnc(Br)c(N)n1.C7C(C)(C)C8.C6C2=O.N456.N27C.C39=O.CC4.C5C.N38
|
Cc1ccc(C(=O)N2CC(C)(C)C[C@@H]2CNC(=O)[C@@H]2CCCc3nc[nH]c32)cn1
|
CccccC=O)NCCC)C)C[C@@H]5CNC=O)[C@@H]CCCcnc[nH]c59))))))))))))))))))cn6
|
[C][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][N][=C][NH1][C][=Ring1][Branch1][Ring1][=Branch2][C][=N][Ring2][Ring1][N]
|
C5(=O)[C@@H]1CCCc2nc[nH]c21.N14CC(C)(C)C[C@@H]18.Cc1ccc7cn1.C47=O.C68.N56
|
C[C@@H](NC(=O)[C@H]1C[C@H]1CNC(=O)[C@@H](O)C1=CCCCC1)c1cn[nH]c1
|
C[C@@H]NC=O)[C@H]C[C@H]3CNC=O)[C@@H]O)C=CCCCC6)))))))))))))))ccn[nH]c5
|
[C][C@@H1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][C][C][C][Ring1][=Branch1][C][C][=N][NH1][C][=Ring1][Branch1]
|
C3(=O)[C@@H](O)C1=CCCCC1.c18cn[nH]c1.[C@H]16C[C@H]17.C[C@@H]48.C26=O.N24.C57.N35
|
Cc1cccc(C)c1CC(=O)N1C[C@@H](C)CN(C(=O)Cc2ccsn2)C[C@@H]1C
|
CcccccC)c6CC=O)NC[C@@H]C)CNC=O)Ccccsn5)))))))C[C@@H]7C
|
[C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][S][N][=Ring1][Branch1][C][C@@H1][Ring1][S][C]
|
N13C[C@@H](C)CN4C[C@@H]1C.Cc1cccc(C)c16.c15ccsn1.C6C3=O.C4(=O)C5
|
CCS[C@@H](C)C(=O)NC[C@@H]1C[C@@H](O)[C@H](NC(=O)c2cnc(-c3ccccn3)s2)C1
|
CCS[C@@H]C)C=O)NC[C@@H]C[C@@H]O)[C@H]NC=O)ccnc-cccccn6))))))s5)))))))C5
|
[C][C][S][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][C][O][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][S][Ring1][O][C][Ring2][Ring1][Ring2]
|
[C@H]1%11C[C@@H]9[C@H](O)C1.c1%10cnc%12s1.c1%12ccccn1.[C@H]8(C)C4=O.C5%10=O.CC7.S78.N46.C6%11.N59
|
CN(C)C[C@@H]1C=CCN1C(=O)[C@@H](F)C1CC(NC(=O)C(C)(C)CF)C1
|
CNC)C[C@@H]C=CCN5C=O)[C@@H]F)CCCNC=O)CC)C)CF)))))C4
|
[C][N][Branch1][C][C][C][C@@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][F][C][Ring1][N]
|
C3(=O)C(C)(C)CF.[C@@H]16C=CCN12.C2(=O)[C@H]7F.C17CC5C1.CN4C.C46.N35
|
Cc1[nH]c(Cl)nc(=NC[C@](C)(NC(=O)[C@@H](CO)c2ccccc2)C(C)C)c1C#N
|
Cc[nH]cCl)nc=NC[C@]C)NC=O)[C@@H]CO))cccccc6)))))))))CC)C)))))c6C#N
|
[C][C][NH1][C][Branch1][C][Cl][=N][C][=Branch2][Ring1][P][=N][C][C@][Branch1][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][C][=Ring2][Ring1][#Branch2][C][#N]
|
Cc1[nH]c(Cl)nc(=NC[C@@]4(C)C(C)C)c1C#N.C3(=O)[C@H]5CO.c15ccccc1.N34
|
C=CC(C)(C)C(=O)N1CC[C@@](NC(=O)C2CCSCC2)(C2CC2)C1
|
C=CCC)C)C=O)NCC[C@@]NC=O)CCCSCC6))))))))CCC3)))C5
|
[C][=C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][S][C][C][Ring1][=Branch1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][P]
|
N13CC[C@@]5(C2CC2)C1.C=CC(C)(C)C3=O.C16CCSCC1.C46=O.N45
|
CS[C@@H](C)CN(C)C(=O)[C@@H](NC(=O)c1ccc(C2CC2)cc1)c1ccco1
|
CS[C@@H]C)CNC)C=O)[C@@H]NC=O)ccccCCC3)))cc6))))))))cccco5
|
[C][S][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring1][=Branch2][C][=C][C][=C][O][Ring1][Branch1]
|
c18ccc%10cc1.C3(=O)[C@@H]69.c19ccco1.[C@H]7(C)C5.N35C.C48=O.C1%10CC1.CS7.N46
|
O=C(NCCN1CC(=O)N(C[C@@H]2C[C@@H]2C2CCCC2)C1=O)c1ccc(F)cc1
|
O=CNCCNCC=O)NC[C@@H]C[C@@H]3CCCCC5)))))))))C5=O)))))))))ccccF)cc6
|
[O][=C][Branch2][Ring1][=C][N][C][C][N][C][C][=Branch1][C][=O][N][Branch1][=C][C][C@@H1][C][C@@H1][Ring1][Ring1][C][C][C][C][C][Ring1][Branch1][C][Ring1][#C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
N16CC(=O)N7C1=O.[C@@H]18C[C@@H]1C1CCCC1.c15ccc(F)cc1.O=C35.C4C6.N34.C78
|
C[C@H](CCNC(=O)c1cccc(F)c1)N(C)C(=O)CSC(F)F
|
C[C@H]CCNC=O)cccccF)c6))))))))))NC)C=O)CSCF)F
|
[C][C@H1][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][S][C][Branch1][C][F][F]
|
c17cccc(F)c1.C[C@@H]4CC5.C3(=O)C6.S6C(F)F.C27=O.N34C.N25
|
Cc1c(C=CC(=O)NC[C@@H]2C[C@@H](O)CN2C(=O)C=Cc2cn[nH]c2)cnn1C
|
CccC=CC=O)NC[C@@H]C[C@@H]O)CN5C=O)C=Cccn[nH]c5))))))))))))))))))cnn5C
|
[C][C][=C][Branch2][Ring1][S][C][=C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][C][=N][NH1][C][=Ring1][Branch1][C][=N][N][Ring2][Ring1][#Branch2][C]
|
Cc1c(C=6)cnn1C.[C@@H]18C[C@@H](O)CN14.C=7c1cn[nH]c1.C=6C3=O.C4(=O)C=7.N35.C58
|
CO[C@H](C(C)C)[C@H](O)C(=O)NCC1(C(=O)NC[C@H](O)C2(Cl)CC2)CC1
|
CO[C@H]CC)C))[C@H]O)C=O)NCCC=O)NC[C@H]O)CCl)CC3)))))))CC3
|
[C][O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][Branch1][C][Cl][C][C][Ring1][Ring2][C][C][Ring1][=N]
|
[C@@H]5(C(C)C)[C@H](O)C3=O.C189CC1.C7[C@@H]%10O.C1%10(Cl)CC1.C48=O.CO5.N36.C69.N47
|
C#CC[C@H](O)C(=O)N1C[C@H](C(=O)N[C@@H](C)C(=O)NC(C)C)[C@@H](C(C)C)C1
|
C#CC[C@H]O)C=O)NC[C@H]C=O)N[C@@H]C)C=O)NCC)C)))))))[C@@H]CC)C))C5
|
[C][#C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C@@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1]
|
C#CC[C@H](O)C2=O.N12C[C@H]7[C@@H]8C1.[C@H]5(C)C4=O.C37=O.C6(C)C.C8(C)C.N35.N46
|
C#CC[C@H](CC(F)F)C(=O)N1CC=C(C(C)(C)C(=O)N(C)CC(F)(F)CC=C)C1
|
C#CC[C@H]CCF)F)))C=O)NCC=CCC)C)C=O)NC)CCF)F)CC=C))))))))C5
|
[C][#C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][=C][C][Ring2][Ring1][Ring1]
|
N12CC=C(C(C)(C)C3=O)C1.C#CC[C@H](CC(F)F)C2=O.C4C(F)(F)CC=C.N34C
|
CC(C)N1CC(C(=O)NC[C@@H](C2CC2)N(C)C(=O)CCOCCOCCCO)C1
|
CCC)NCCC=O)NC[C@@H]CCC3)))NC)C=O)CCOCCOCCCO))))))))))))))))C4
|
[C][C][Branch1][C][C][N][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][O][C][C][O][C][C][C][O][C][Ring2][Ring1][#Branch2]
|
N1%11CC4C1.C6(=O)CC7.C%12[C@H]%135.C%10CCO.CC%11C.C34=O.C15CC1.N6%13C.C8C9.N3%12.O78.O9%10
|
COC1(COC(=O)c2ccc(-n3cncn3)cc2)CCOC1
|
COCCOC=O)cccc-ncncn5)))))cc6)))))))))CCOC5
|
[C][O][C][Branch2][Ring1][Branch2][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][=N][C][=N][Ring1][Branch1][C][=C][Ring1][O][C][C][O][C][Ring2][Ring1][Ring2]
|
c17ccc9cc1.C158CCOC1.n19cncn1.C47=O.CO5.C68.O46
|
Cc1cc(C)c(C(=O)N[C@@H](C)CNC(=O)C2CCN(CP(C)(C)=O)CC2)c(=O)o1
|
CcccC)cC=O)N[C@@H]C)CNC=O)CCCNCPC)C)=O)))CC6))))))))))))c=O)o6
|
[C][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][N][Branch1][#Branch2][C][P][Branch1][C][C][Branch1][C][C][=O][C][C][Ring1][O][C][=Branch1][C][=O][O][Ring2][Ring1][N]
|
C17CCN(CP(C)(C)=O)CC1.Cc1cc(C)c8c(=O)o1.[C@H]5(C)C6.C38=O.C47=O.N35.N46
|
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