SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
O=C(N[C@@H]1C[C@@H]2C[C@H]1CN(C(=O)COCC1CC1)C2)c1ccc(C(F)(F)F)cn1
|
O=CN[C@@H]C[C@@H]C[C@H]5CNC=O)COCCCC3)))))))C6)))))))))ccccCF)F)F))cn6
|
[O][=C][Branch2][Ring1][N][N][C@@H1][C][C@@H1][C][C@H1][Ring1][Branch1][C][N][Branch1][=N][C][=Branch1][C][=O][C][O][C][C][C][C][Ring1][Ring1][C][Ring1][=C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=N][Ring1][#Branch2]
|
[C@@H]17C[C@@H]2C[C@H]1CN4C2.c18ccc%10cn1.C4(=O)C5.C%10(F)(F)F.O=C38.C19CC1.N37.O56.C69
|
CCc1cc(C(=O)N2C[C@@H]3CCN(C(=O)c4ccn5ncccc45)C[C@@H]3C2)n[nH]1
|
CCcccC=O)NC[C@@H]CCNC=O)cccnncccc96))))))))))C[C@@H]6C9))))))))))n[nH]5
|
[C][C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][N][N][=C][C][=C][C][=Ring1][=Branch2][Ring1][=Branch1][C][C@@H1][Ring1][P][C][Ring2][Ring1][Ring2][=N][NH1][Ring2][Ring1][O]
|
N16C[C@@H]2CCN7C[C@@H]2C1.c19ccn2ncccc12.c1%10cc8n[nH]1.C68=O.C79=O.CC%10
|
CCOC[C@@H](NC(=O)c1cnc(O)c(F)c1)C(=O)N(C)CC(=O)OCC
|
CCOC[C@@H]NC=O)ccncO)cF)c6))))))))C=O)NC)CC=O)OCC
|
[C][C][O][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][C][Branch1][C][F][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][O][C][C]
|
c1%10cnc(O)c(F)c1.C6[C@@H]8C4=O.C9C2=O.C3%10=O.N49C.CC5.O56.N38.O27.C7C
|
Cc1nnn(CC(=O)NCC[C@@H]2CSCCN2C(=O)COC(=O)CO)n1
|
CcnnnCC=O)NCC[C@@H]CSCCN6C=O)COC=O)CO)))))))))))))))))n5
|
[C][C][N][=N][N][Branch2][Ring1][=N][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][S][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][O][C][=Branch1][C][=O][C][O][N][=Ring2][Ring1][=Branch2]
|
[C@@H]19CSCCN15.Cc1nnn8n1.C8C4=O.C5(=O)C6.C3(=O)CO.C7C9.N47.O36
|
CN(C)CC(=O)N[C@H]1CC=C(C(=O)N2CC3(CC[C@H]2CO)CC3)C1
|
CNC)CC=O)N[C@H]CC=CC=O)NCCCC[C@H]6CO)))))CC3))))))C5
|
[C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][C][C][C@H1][Ring1][=Branch1][C][O][C][C][Ring1][Branch2][C][Ring1][P]
|
N15CC2(CC[C@H]18)CC2.[C@H]17CC=C(C5=O)C1.C6C4=O.CN6C.N47.C8O
|
O=C(N[C@@H]1[C@@H]2C[C@H](O)[C@H]1N(C(=O)C1(Cl)CC1)C2)c1ncnc2ccsc12
|
O=CN[C@@H][C@@H]C[C@H]O)[C@H]5NC=O)CCl)CC3))))C6))))))))cncncccsc95
|
[O][=C][Branch2][Ring1][=C][N][C@@H1][C@@H1][C][C@H1][Branch1][C][O][C@H1][Ring1][=Branch1][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][Cl][C][C][Ring1][Ring2][C][Ring1][=N][C][=N][C][=N][C][C][=C][S][C][Ring1][=Branch2][=Ring1][Branch1]
|
[C@@H]15[C@@H]2C[C@H](O)[C@H]1N4C2.c16ncnc2ccsc12.C17(Cl)CC1.O=C36.C47=O.N35
|
C[C@H](Oc1cccc(N)c1)C(=O)N1CC[C@H](NC(=O)[C@]2(C)C[C@H]3CC[C@H]2C3)[C@H]1C
|
C[C@H]OcccccN)c6)))))))C=O)NCC[C@H]NC=O)[C@]C)C[C@H]CC[C@H]6C5)))))))))[C@H]5C
|
[C][C@H1][Branch1][=N][O][C][=C][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C@H1][C][C][C@H1][Ring1][#Branch1][C][Ring1][Branch1][C@H1][Ring1][S][C]
|
[C@@]19(C)C[C@H]2CC[C@H]1C2.c17cccc(N)c1.N14CC[C@H]8[C@H]1C.C[C@H]6C4=O.C59=O.O67.N58
|
COC1(CNC(=O)COC2CC2)CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1
|
COCCNC=O)COCCC3))))))))CCNC=O)[C@@H]C[C@H]3ccccCl)cc6))))))))))CC6
|
[C][O][C][Branch1][=C][C][N][C][=Branch1][C][=O][C][O][C][C][C][Ring1][Ring1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][O]
|
C15%10CCN4CC1.c1%11ccc(Cl)cc1.C3(=O)C6.[C@@H]19C[C@H]1%11.C17CC1.C49=O.CO5.C8%10.N38.O67
|
CO[C@H](C(=O)N1C[C@H](F)[C@H](NC(=O)CN2CCOCC2)C1)c1ccccc1O
|
CO[C@H]C=O)NC[C@H]F)[C@H]NC=O)CNCCOCC6)))))))))C5))))))cccccc6O
|
[C][O][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][F][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][O]
|
N13C[C@@H]7[C@@H](F)C1.c18ccccc1O.N16CCOCC1.[C@H]58C3=O.C4(=O)C6.CO5.N47
|
C=C[C@H]1CN(C(=O)c2sc(=N)[nH]c2CC)C[C@H]1NC(=O)c1ccc2cnsc2c1
|
C=C[C@H]CNC=O)csc=N)[nH]c5CC))))))))C[C@H]5NC=O)cccccnsc5c9
|
[C][=C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][S][C][=Branch1][C][=N][NH1][C][=Ring1][=Branch1][C][C][C][C@H1][Ring1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=N][S][C][Ring1][Branch1][=C][Ring1][=Branch2]
|
c17ccc2cnsc2c1.C=C[C@H]1CN3C[C@H]15.c16sc(=N)[nH]c18.C36=O.C47=O.C8C.N45
|
Cc1cccnc1C(=O)N[C@H]1CCN(C(=O)CC23COC(C)(C2)C3)[C@H]1C
|
Cccccnc6C=O)N[C@H]CCNC=O)CCCOCC)C5)C5)))))))[C@H]5C
|
[C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][O][C][Branch1][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][#Branch1][C@H1][Ring1][#C][C]
|
Cc1cccnc17.[C@H]16CCN5[C@H]1C.C128COC(C)(C1)C2.C5(=O)C8.C47=O.N46
|
CCC[C@H](CC(C)C)C(=O)N1[C@H](C(=O)N2CC3(CCN3C)C2)C[C@@H]2C[C@@H]21
|
CCC[C@H]CCC)C)))C=O)N[C@H]C=O)NCCCCN4C))))C4)))))C[C@@H]C[C@@H]36
|
[C][C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][#Branch1][C][C][N][Ring1][Ring2][C][C][Ring1][Branch2][C][C@@H1][C][C@@H1][Ring1][Ring1][Ring1][S]
|
CCC[C@H](CC(C)C)C4=O.N15CC2(CCN2C)C1.N14[C@H]6C[C@@H]2C[C@@H]21.C56=O
|
CC(=O)OCCC(=O)NCC[C@H]1CCN(C(=O)c2cc(Cn3cccn3)on2)C1
|
CC=O)OCCC=O)NCC[C@H]CCNC=O)cccCncccn5))))))on5))))))C5
|
[C][C][=Branch1][C][=O][O][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][O][N][=Ring1][O][C][Ring2][Ring1][C]
|
[C@H]1%12CCN6C1.c19cc%11on1.C7CC5=O.n1%10cccn1.CC4=O.C8C%12.C69=O.O47.N58.C%10%11
|
Cc1ccc(NC(=O)N2CCC(C)(C(=O)Nc3cc(OC(C)C)n[nH]3)CC2)cc1
|
CccccNC=O)NCCCC)C=O)NcccOCC)C)))n[nH]5)))))))CC6))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][=Branch2][N][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][C][C][=N][NH1][Ring1][=Branch2][C][C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][N]
|
N15CCC%11(C)CC1.Cc1ccc%10cc1.c19cc8n[nH]1.C45=O.C6%11=O.C7(C)C.N4%10.N69.O78
|
CCc1ccc(C(=O)N2CCC3(C2)CN(C(=O)c2cnn(C(C)C)c2F)C3)o1
|
CCccccC=O)NCCCC5)CNC=O)ccnnCC)C))c5F)))))))C4))))))))o5
|
[C][C][C][=C][C][=C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][C][C][=Ring1][Branch2][F][C][Ring1][S][O][Ring2][Ring1][#Branch2]
|
N14CCC2(C1)CN5C2.c17cnn8c1F.c19ccc6o1.C46=O.C57=O.C8(C)C.CC9
|
C[C@H](CC(=O)NC[C@@](C)(CO)NC(=O)c1cccc2[nH]ccc12)N(C)C
|
C[C@H]CC=O)NC[C@@]C)CO))NC=O)ccccc[nH]ccc95))))))))))))))))NC)C
|
[C][C@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][C][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][N][Branch1][C][C][C]
|
c18cccc2[nH]ccc12.C[C@@H]5CC3=O.C6[C@@]7(C)CO.C48=O.N5(C)C.N36.N47
|
Cc1cnn([C@H](C)C(=O)NCCO[C@@H]2CCN(C(=O)c3cccc(Cl)c3N)C2)c1
|
Cccnn[C@H]C)C=O)NCCO[C@@H]CCNC=O)cccccCl)c6N))))))))C5)))))))))))c5
|
[C][C][C][=N][N][Branch2][Ring2][=Branch1][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][C][Ring1][#C][C][=Ring2][Ring1][N]
|
c19cccc(Cl)c1N.Cc1cnn%10c1.[C@@H]17CCN5C1.[C@@H]%10(C)C4=O.C8C6.C59=O.N48.O67
|
C[C@@H]1C[C@H](C(=O)N2CC3CC2(CNC(=O)[C@@H]2CCCCS2(=O)=O)C3)CCO1
|
C[C@@H]C[C@H]C=O)NCCCC5CNC=O)[C@@H]CCCCS6=O)=O))))))))))C4)))))))CCO6
|
[C][C@@H1][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][S][Ring1][=Branch1][=Branch1][C][=O][=O][C][Ring1][S][C][C][O][Ring2][Ring1][#Branch2]
|
[C@@H]17CCCCS1(=O)=O.C[C@@H]1C[C@H]8CCO1.N14CC2CC19C2.C48=O.C57=O.C69.N56
|
CCc1noc(CCNC(=O)CCC[C@@H](CC)NC(=O)CCn2cc(C)cn2)n1
|
CCcnocCCNC=O)CCC[C@@H]CC))NC=O)CCnccC)cn5)))))))))))))))))n5
|
[C][C][C][=N][O][C][Branch2][Ring1][P][C][C][N][C][=Branch1][C][=O][C][C][C][C@@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][C][C][C][=N][Ring1][=Branch1][=N][Ring2][Ring1][O]
|
C3(=O)CCC[C@H]6CC.c18noc9n1.n17cc(C)cn1.C4(=O)CC7.C9C5.CC8.N35.N46
|
CC[C@H](C)[C@H](C)N(C(=O)[C@H](CNC(=O)[C@H]1CNC(=O)C1)C(C)(C)C)C1CC1
|
CC[C@H]C)[C@H]C)NC=O)[C@H]CNC=O)[C@H]CNC=O)C5))))))))CC)C)C))))CCC3
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Ring1][Ring1]
|
C2(=O)[C@H](C5)C(C)(C)C.CC[C@H](C)[C@@H]4C.[C@H]17CNC(=O)C1.N246.C37=O.C16CC1.N35
|
C[C@@H]1[C@@H](NC(=O)c2ncn3c2CCCC3)CCCN1C(=O)CCc1nccn1C
|
C[C@@H][C@@H]NC=O)cncnc5CCCC6)))))))))))CCCN6C=O)CCcnccn5C
|
[C][C@@H1][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][N][=C][N][C][=Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C][C][C][=N][C][=C][N][Ring1][Branch1][C]
|
c17ncn2c1CCCC2.C[C@@H]1[C@@H]6CCCN15.c18nccn1C.C5(=O)CC8.C47=O.N46
|
CC[C@H](O)C(=O)N1C[C@@H](O)C[C@H]1C(=O)Nc1c(F)cc(C#N)cc1Cl
|
CC[C@H]O)C=O)NC[C@@H]O)C[C@H]5C=O)NccF)ccC#N))cc6Cl
|
[C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][Branch1][C][F][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][=Branch2][Cl]
|
c14c(F)cc(C#N)cc1Cl.N12C[C@@H](O)C[C@H]15.CC[C@H](O)C2=O.C35=O.N34
|
Cc1ccc(C(=O)N2[C@@H](C(=O)NCC3(C#N)CC3)C[C@@H]2C)nc1O
|
CccccC=O)N[C@@H]C=O)NCCC#N))CC3))))))C[C@@H]4C))))))nc6O
|
[C][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch1][C][C@@H1][Ring1][=N][C][N][=C][Ring2][Ring1][=Branch1][O]
|
Cc1ccc8nc1O.N14[C@@H]7C[C@@H]1C.C19(C#N)CC1.C48=O.C57=O.N56.C69
|
O=C(NC[C@H]1CCCN(C(=O)Cc2cnsc2)C1)[C@@H]1C[C@@H]2CCCCCC[C@@H]21
|
O=CNC[C@H]CCCNC=O)Cccnsc5)))))))C6))))))))[C@@H]C[C@@H]CCCCCC[C@@H]8%10
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C@H1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=N][S][C][=Ring1][Branch1][C][Ring1][=C][C@@H1][C][C@@H1][C][C][C][C][C][C][C@@H1][Ring1][Branch2][Ring1][#Branch2]
|
[C@@H]16C[C@@H]2CCCCCC[C@@H]21.[C@H]17CCCN4C1.c18cnsc1.C4(=O)C8.O=C36.N35.C57
|
CCCCNC(=O)CN1CCS(=O)(=O)[C@@H](CCNC(=O)[C@H](F)c2ccccc2)C1
|
CCCCNC=O)CNCCS=O)=O)[C@@H]CCNC=O)[C@H]F)cccccc6)))))))))))C6
|
[C][C][C][C][N][C][=Branch1][C][=O][C][N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C@@H1][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Branch1]
|
N16CCS(=O)(=O)[C@@H]8C1.c19ccccc1.C4(=O)[C@@H]9F.CCCC5.C3(=O)C6.C8C7.N35.N47
|
Cc1ccc(C=CC(=O)N[C@@H](C)[C@H]2CCN(C(=O)C3(F)CC=CC3)C2)o1
|
CccccC=CC=O)N[C@@H]C)[C@H]CCNC=O)CF)CC=CC5))))))C5))))))))))o5
|
[C][C][=C][C][=C][Branch2][Ring2][Ring1][C][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][C][F][C][C][=C][C][Ring1][=Branch1][C][Ring1][=N][O][Ring2][Ring1][=Branch2]
|
Cc1ccc(C=8)o1.[C@H]19CCN5C1.C17(F)CC=CC1.C=8C4=O.[C@@H]69C.C57=O.N46
|
CCS[C@H](C)c1noc(CN[C@@H](CCC(N)=O)C(=O)OC(C)(C)C)n1
|
CCS[C@H]C)cnocCN[C@@H]CCCN)=O))))C=O)OCC)C)C)))))))n5
|
[C][C][S][C@H1][Branch1][C][C][C][=N][O][C][Branch2][Ring1][#Branch2][C][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=N][Ring2][Ring1][Ring2]
|
[C@H]5(CCC(N)=O)C2=O.c18noc9n1.C3(C)(C)C.[C@H]78C.CC6.S67.C49.N45.O23
|
CS(=O)(=O)Cc1cccc(C(=O)NCC(=O)c2ccccc2)c1
|
CS=O)=O)CcccccC=O)NCC=O)cccccc6))))))))))c6
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][C]
|
c17cccc5c1.c16ccccc1.CS(=O)(=O)C7.C4C6=O.C35=O.N34
|
COc1ccc(CC(=O)NC[C@H](NC(=O)[C@@]2(F)CCOC2)C2CCC2)c(C)c1
|
COccccCC=O)NC[C@H]NC=O)[C@@]F)CCOC5)))))))CCCC4)))))))))cC)c6
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][O][C][Ring1][=Branch1][C][C][C][C][Ring1][Ring2][C][Branch1][C][C][=C][Ring2][Ring1][#Branch2]
|
c15ccc%10c(C)c1.[C@]18(F)CCOC1.C%10C3=O.C6[C@H]79.C19CCC1.C48=O.CO5.N36.N47
|
CCCc1nsc(N2CCC[C@H]2CCCNC(=O)[C@]2(C)CNC(=O)C2)n1
|
CCCcnscNCCC[C@H]5CCCNC=O)[C@]C)CNC=O)C5)))))))))))))))n5
|
[C][C][C][C][=N][S][C][Branch2][Ring1][=N][N][C][C][C][C@H1][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][=N][Ring2][Ring1][#Branch1]
|
[C@@]16(C)CNC(=O)C1.c18nsc5n1.N15CCC[C@H]17.C7CC4.CCC8.C36=O.N34
|
CCOC(=O)c1[nH]nc(Cl)c1CN1CCC[C@@H]1CC1CCCC1
|
CCOC=O)c[nH]ncCl)c5CNCCC[C@@H]5CCCCCC5
|
[C][C][O][C][=Branch1][C][=O][C][NH1][N][=C][Branch1][C][Cl][C][=Ring1][=Branch1][C][N][C][C][C][C@@H1][Ring1][Branch1][C][C][C][C][C][C][Ring1][Branch1]
|
c15[nH]nc(Cl)c18.N14CCC[C@@H]16.C17CCCC1.C25=O.CC3.O23.C48.C67
|
Cc1noc(C(=O)NCCCOCCNC(=O)[C@@H]2CCc3n[nH]c(C)c3C2)c1C
|
CcnocC=O)NCCCOCCNC=O)[C@@H]CCcn[nH]cC)c5C9)))))))))))))))))))c5C
|
[C][C][=N][O][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=C][Ring2][Ring1][O][C]
|
[C@@H]1%11CCc2n[nH]c(C)c2C1.Cc1noc%10c1C.C8CC6.C4%10=O.C7C9.C5%11=O.N48.O67.N59
|
Cc1ccc(C(=O)N2CC[C@@]3(C[C@H](NC(=O)c4n[nH]c(C)c4F)CO3)C2)c(N)n1
|
CccccC=O)NCC[C@@]C[C@H]NC=O)cn[nH]cC)c5F))))))))CO5))))C5))))))cN)n6
|
[C][C][=C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][=Branch2][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][F][C][O][Ring1][#C][C][Ring2][Ring1][Ring1][C][Branch1][C][N][=N][Ring2][Ring1][N]
|
N15CC[C@@]2(C[C@H]7CO2)C1.Cc1ccc9c(N)n1.c18n[nH]c(C)c1F.C59=O.C68=O.N67
|
C=C=C[C@H](C)C(=O)N1CCC[C@H](N(C)C(=O)c2cc3c(nc2O)CCOC3)C1
|
C=C=C[C@H]C)C=O)NCCC[C@H]NC)C=O)ccccnc6O)))CCOC6))))))))))C6
|
[C][=C][=C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][#Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N][=C][Ring1][=Branch1][O][C][C][O][C][Ring1][=Branch2][C][Ring2][Ring1][Branch1]
|
c17cc2c(nc1O)CCOC2.C=C=C[C@H](C)C4=O.N14CCC[C@H]6C1.N56C.C57=O
|
CSCCC(=O)NCc1nc(C(=O)NCCCC2CCCCC2)co1
|
CSCCC=O)NCcncC=O)NCCCCCCCCC6)))))))))))co5
|
[C][S][C][C][C][=Branch1][C][=O][N][C][C][=N][C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][C][Ring1][=Branch1][=C][O][Ring1][P]
|
c19nc8co1.C1%10CCCCC1.C7CC3=O.C6CC%10.C48=O.CS7.N35.C59.N46
|
CCc1cnc(CC(=O)N(C)C[C@@H]2CN(C(=O)[C@H]3CNC(=O)C[C@H]3C)CCO2)[nH]1
|
CCccncCC=O)NC)C[C@@H]CNC=O)[C@H]CNC=O)C[C@H]6C))))))))CCO6))))))))))[nH]5
|
[C][C][C][=C][N][=C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][C][C@H1][Ring1][#Branch1][C][C][C][O][Ring1][S][NH1][Ring2][Ring1][O]
|
[C@H]17CNC(=O)C[C@H]1C.[C@@H]18CN5CCO1.c19cnc%10[nH]1.C%10C4=O.N46C.C57=O.CC9.C68
|
CCCC[C@H](CC(=O)NC[C@H](C)CC(=O)OC)NC(=O)C1CC=CC1
|
CCCC[C@H]CC=O)NC[C@H]C)CC=O)OC)))))))))NC=O)CCC=CC5
|
[C][C][C][C][C@H1][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][O][C][N][C][=Branch1][C][=O][C][C][C][=C][C][Ring1][Branch1]
|
CCCC[C@@H]5CC3=O.C6[C@H](C)CC2=O.C17CC=CC1.C47=O.N36.O2C.N45
|
C[C@@](O)(C(=O)NC[C@@H]1CN(C(=O)c2ncc(F)cn2)CC12CCC2)C1CC1
|
C[C@@]O)C=O)NC[C@@H]CNC=O)cnccF)cn6)))))))CC5CCC4)))))))))))CCC3
|
[C][C@@][Branch1][C][O][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][C][Ring1][=C][C][C][C][Ring1][Ring2][C][C][C][Ring1][Ring1]
|
[C@@H]18CN4CC12CCC2.c16ncc(F)cn1.C[C@@]7(O)C3=O.C46=O.C17CC1.N35.C58
|
O=C(c1coc(O)n1)N1CC[C@@H]2CN(C(=O)[C@@H]3C[C@@H]4CCCN4C(=O)N3)C[C@@H]2C1
|
O=CccocO)n5)))))NCC[C@@H]CNC=O)[C@@H]C[C@@H]CCCN5C=O)N9))))))))))C[C@@H]5C9
|
[O][=C][Branch1][O][C][=C][O][C][Branch1][C][O][=N][Ring1][=Branch1][N][C][C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C@@H1][Ring1][P][C][Ring2][Ring1][Branch1]
|
N15CC[C@@H]2CN6C[C@@H]2C1.[C@@H]17C[C@@H]2CCCN2C(=O)N1.c18coc(O)n1.O=C58.C67=O
|
CC[S@@+]([O-])CC(=O)N1CC(=C(F)CNC(=O)c2cccc(-c3cc[nH]n3)c2)C1
|
CC[S@@+][O-])CC=O)NCC=CF)CNC=O)ccccc-ccc[nH]n5)))))c6))))))))))C4
|
[C][C][S@@+1][Branch1][C][O-1][C][C][=Branch1][C][=O][N][C][C][=Branch2][Ring1][N][=C][Branch1][C][F][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][=C][Ring1][O][C][Ring2][Ring1][Branch1]
|
CC[S@@+]([O-])CC4=O.c17cccc9c1.N14CC=8C1.c19cc[nH]n1.C=8(F)C6.C57=O.N56
|
CSc1ccc(C(=O)NC[C@@]23C[C@H](CO2)[C@@H](NC(=O)[C@H](C)C(F)(F)F)C3)cc1
|
CSccccC=O)NC[C@@]C[C@H]CO5))[C@@H]NC=O)[C@H]C)CF)F)F)))))C5))))))))cc6
|
[C][S][C][=C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@@][C][C@H1][Branch1][Branch1][C][O][Ring1][Branch1][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][S][C][=C][Ring2][Ring1][#Branch2]
|
[C@@]129C[C@H](CO1)[C@@H]7C2.C5(=O)[C@H](C)C(F)(F)F.c1%10ccc8cc1.C48=O.CS%10.N46.C69.N57
|
Cc1cc(=NCCc2cccc(C#N)c2)[nH]cc1S(=O)(=O)N[C@@H](CO)C1(C)CC1
|
Cccc=NCCcccccC#N))c6)))))))))[nH]cc6S=O)=O)N[C@@H]CO))CC)CC3
|
[C][C][=C][C][=Branch1][S][=N][C][C][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][NH1][C][=C][Ring1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][Branch1][C][C][C][C][Ring1][Ring2]
|
Cc1cc(=NCC6)[nH]cc1S4(=O)=O.c16cccc(C#N)c1.[C@@H]35CO.C15(C)CC1.N34
|
C[C@H](CCCCO)NC(=O)C[C@@H]1CN(C(=O)[C@H]2CC[C@@H](C3CC3)C2)CC12CC2
|
C[C@H]CCCCO)))))NC=O)C[C@@H]CNC=O)[C@H]CC[C@@H]CCC3)))C5))))))CC5CC3
|
[C][C@H1][Branch1][=Branch1][C][C][C][C][O][N][C][=Branch1][C][=O][C][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][Branch2][C][C][Ring1][#C][C][C][Ring1][Ring1]
|
[C@@H]18CN5CC12CC2.[C@H]17CC[C@@H](C2CC2)C1.C[C@@H]6CCCCO.C4(=O)C8.C57=O.N46
|
O=C(N[C@@H]1CCc2cc(Br)ccc2C1)N[C@@H]1CS(=O)(=O)c2ccccc21
|
O=CN[C@@H]CCcccBr)ccc6C%10)))))))))))N[C@@H]CS=O)=O)cccccc69
|
[O][=C][Branch2][Ring1][Ring1][N][C@@H1][C][C][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][C][Ring1][O][N][C@@H1][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O]
|
N4[C@@H]1CS(=O)(=O)c2ccccc21.[C@@H]15CCc2cc(Br)ccc2C1.O=C34.N35
|
CCc1nc(CNC(=O)[C@]2(CNC(=O)Cc3ccns3)CC23CCC3)co1
|
CCcncCNC=O)[C@]CNC=O)Ccccns5)))))))))CC3CCC4)))))))))co5
|
[C][C][C][=N][C][Branch2][Ring1][P][C][N][C][=Branch1][C][=O][C@][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][=C][C][=N][S][Ring1][Branch1][C][C][Ring1][=N][C][C][C][Ring1][Ring2][=C][O][Ring2][Ring1][=Branch2]
|
[C@@]18%12CC12CCC2.c19nc%10co1.c1%11ccns1.C5(=O)C%11.C48=O.CC9.C6%10.N46.C7%12.N57
|
COCC1(COC)C[C@H]1C(=O)NC1(CNC(=O)c2cccc(N(C)C)c2)CCC1
|
COCCCOC)))C[C@H]3C=O)NCCNC=O)cccccNC)C))c6)))))))))CCC4
|
[C][O][C][C][Branch1][Ring2][C][O][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][N][Branch1][C][C][C][=C][Ring1][=Branch2][C][C][C][Ring1][P]
|
c1%14cccc%12c1.C145C[C@H]1%13.C1%106CCC1.C3%13=O.C7%14=O.N%12(C)C.CO8.C84.C95.O9C.N3%10.C%116.N7%11
|
COc1ccc(C[C@@H](C(=O)N2CCc3ccccc3[C@H]2CN)C(F)(F)F)cc1
|
COccccC[C@@H]C=O)NCCcccccc6[C@H]%10CN)))))))))))))CF)F)F))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring2][C][C][C@@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Ring1][#Branch2][C][N][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring2][Ring1][#Branch2]
|
N14CCc2ccccc2[C@H]1CN.C6[C@@H](C4=O)C(F)(F)F.c15ccc6cc1.CO5
|
C#Cc1ccc(C(=O)N2CC[C@@H](NC(=O)c3noc4c3CCCCC4)[C@@H](F)C2)o1
|
C#CccccC=O)NCC[C@@H]NC=O)cnocc5CCCCC7))))))))))))[C@@H]F)C6)))))))o5
|
[C][#C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=N][O][C][=C][Ring1][Branch1][C][C][C][C][C][Ring1][#Branch1][C@@H1][Branch1][C][F][C][Ring2][Ring1][Ring2][O][Ring2][Ring1][O]
|
c19noc2c1CCCCC2.N15CC[C@@H]7[C@@H](F)C1.C#Cc1ccc8o1.C58=O.C69=O.N67
|
O=C(NCCC(=O)N1CCCCC1)NC1([C@H](O)c2ccccc2)CCCCC1
|
O=CNCCC=O)NCCCCC6))))))))))NC[C@H]O)cccccc6)))))))CCCCC6
|
[O][=C][Branch1][S][N][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][N][C][Branch1][=N][C@H1][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][C][Ring1][=C]
|
C178CCCCC1.N15CCCCC1.c19ccccc1.C6CC5=O.O=C34.[C@H]89O.N36.N47
|
COC(=O)[C@@H](C)C(=O)N1CCC[C@](C)(NC(=O)c2cc3c(F)c(Cl)ccc3[nH]2)C1
|
COC=O)[C@@H]C)C=O)NCCC[C@]C)NC=O)ccccF)cCl)ccc6[nH]9)))))))))))C6
|
[C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][C][=C][Ring1][Branch2][NH1][Ring1][O][C][Ring2][Ring1][Branch1]
|
c18cc2c(F)c(Cl)ccc2[nH]1.N15CCC[C@@]7(C)C1.C4(=O)[C@@H](C)C5=O.C68=O.CO4.N67
|
CCc1cnoc1C(=O)NC[C@@H]1CC(C(=O)N[C@H]2CC[C@@H](OC)C2)=NO1
|
CCccnoc5C=O)NC[C@@H]CCC=O)N[C@H]CC[C@@H]OC))C5)))))))=NO5
|
[C][C][C][C][=N][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch1][P][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch1][Ring1][O][C][C][Ring1][#Branch1][=N][O][Ring1][#C]
|
[C@@H]19CC(C4=O)=NO1.c1%10cnoc18.[C@H]17CC[C@@H]5C1.C38=O.CC%10.N36.C69.N47.O5C
|
CN1CCO[C@@H](C(=O)NC2CN(C(=O)C[C@@H]3CCOC3)C2)C1
|
CNCCO[C@@H]C=O)NCCNC=O)C[C@@H]CCOC5)))))))C4))))))C6
|
[C][N][C][C][O][C@@H1][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring1][N][C][Ring2][Ring1][Branch1]
|
CN1CCO[C@@H]7C1.C16CN5C1.[C@@H]18CCOC1.C5(=O)C8.C47=O.N46
|
CCCC[C@H](O)C(=O)NC[C@H]1COC(C)(C)CN1C(=O)c1cc2scc(Cl)c2[nH]1
|
CCCC[C@H]O)C=O)NC[C@H]COCC)C)CN6C=O)cccsccCl)c5[nH]8
|
[C][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@H1][C][O][C][Branch1][C][C][Branch1][C][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][S][C][=C][Branch1][C][Cl][C][=Ring1][=Branch1][NH1][Ring1][=Branch2]
|
[C@H]17COC(C)(C)CN14.c16cc2scc(Cl)c2[nH]1.CCCC[C@H](O)C3=O.C46=O.N35.C57
|
COCC1(C(=O)NCCNC(=O)c2ccc3c(O)nc(=O)n(C)c3n2)CC=CC1
|
COCCC=O)NCCNC=O)cccccO)nc=O)nC)c6n%10))))))))))))))))CC=CC5
|
[C][O][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=N][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][=Branch2][=N][Ring1][=N][C][C][=C][C][Ring2][Ring1][#Branch2]
|
c19ccc2c(O)nc(=O)n(C)c2n1.C1%10%11CC=CC1.C4%10=O.C7C8.C59=O.CO6.C6%11.N47.N58
|
CC(C)C1(CNC(=O)C[C@@H](NC(=O)c2cc[nH]c(=N)n2)C(C)(C)C)CCCC1
|
CCC)CCNC=O)C[C@@H]NC=O)ccc[nH]c=N)n6))))))))CC)C)C)))))))CCCC5
|
[C][C][Branch1][C][C][C][Branch2][Ring2][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=Branch1][C][=N][N][=Ring1][#Branch1][C][Branch1][C][C][Branch1][C][C][C][C][C][C][C][Ring2][Ring1][=Branch2]
|
C3(=O)C[C@@H]6C(C)(C)C.c17cc[nH]c(=N)n1.C189CCCC1.CC8C.C47=O.C59.N35.N46
|
CCN(CCCNC(=O)CC(F)(F)CC)C(=O)c1ccccc1N(C)C(C)C
|
CCNCCCNC=O)CCF)F)CC)))))))))C=O)cccccc6NC)CC)C
|
[C][C][N][Branch2][Ring1][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][Branch1][C][C][C]
|
C2(=O)CC(F)(F)CC.c19ccccc18.C5CC6.N345.C39=O.N78C.C7(C)C.CC4.N26
|
CC[C@@H]1C[C@H](C(=O)N(C)C[C@H]2CCCN2C(=O)C2(CO)CC2)CCO1
|
CC[C@@H]C[C@H]C=O)NC)C[C@H]CCCN5C=O)CCO))CC3))))))))))))CCO6
|
[C][C][C@@H1][C][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][Ring1][Branch1][C][C][O][Ring2][Ring1][#Branch1]
|
[C@@H]18C[C@H]6CCO1.[C@H]19CCCN14.C17%10CC1.C36=O.N35C.C47=O.CC8.C59.C%10O
|
COc1cc([C@@H](Nc2cnc(N(C)C)nc2)c2nnnn2C)c(F)cn1
|
COccc[C@@H]NccncNC)C))nc6)))))))cnnnn5C)))))))cF)cn6
|
[C][O][C][=C][C][Branch2][Ring1][N][C@@H1][Branch1][P][N][C][=C][N][=C][Branch1][=Branch1][N][Branch1][C][C][C][N][=C][Ring1][=Branch2][C][=N][N][=N][N][Ring1][Branch1][C][=C][Branch1][C][F][C][=N][Ring2][Ring1][Branch2]
|
c13cc8c(F)cn1.c16cnc5nc1.c17nnnn1C.[C@H]478.N5(C)C.CO3.N46
|
C=CCC[C@@H](NC(=O)c1cccc(CNC(=O)c2ccc(F)c(F)c2)n1)C1CC1
|
C=CCC[C@@H]NC=O)cccccCNC=O)ccccF)cF)c6)))))))))n6))))))))CCC3
|
[C][=C][C][C][C@@H1][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][=N][Ring2][Ring1][C][C][C][C][Ring1][Ring1]
|
c18ccc(F)c(F)c1.c17cccc9n1.C=CCC[C@@H]5%10.C37=O.C48=O.C1%10CC1.N35.C69.N46
|
CCC[C@@]1(NC(=O)C2=CS(=O)(=O)CCC2)CCCN(C(=O)C2=CCCC2)C1
|
CCC[C@@]NC=O)C=CS=O)=O)CCC6))))))))CCCNC=O)C=CCCC5))))))C6
|
[C][C][C][C@@][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Branch2][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][Branch2]
|
C3(=O)C1=CS(=O)(=O)CCC1.[C@@]156CCCN4C1.C4(=O)C1=CCCC1.CCC6.N35
|
CC=CC(=O)N[C@H]1CCCC[C@@H]1CNC(=O)c1c(Cl)ccc(O)c1N
|
CC=CC=O)N[C@H]CCCC[C@@H]6CNC=O)ccCl)cccO)c6N
|
[C][C][=C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][N]
|
c16c(Cl)ccc(O)c1N.[C@H]15CCCC[C@@H]18.C=7C2=O.C36=O.CC=7.N25.C48.N34
|
C#C[C@@H]1CCCCCN1C(=O)NCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1
|
C#C[C@@H]CCCCCN7C=O)NCCCNC=O)[C@@H][C@@H]C5=O))[C@H]C=C[C@H]6C5
|
[C][#C][C@@H1][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C@@H1][C@@H1][Branch1][Branch1][C][Ring1][=Branch1][=O][C@H1][C][=C][C@H1][Ring1][Branch2][C][Ring1][Branch1]
|
N16C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1.C#C[C@@H]1CCCCCN13.C5CC6.C34=O.N45
|
CC(=O)N[C@H](C)C(=O)N1CC([C@@H]2CN(C(=O)C3=C(C)CC3)CCO2)C1
|
CC=O)N[C@H]C)C=O)NCC[C@@H]CNC=O)C=CC)CC4)))))CCO6))))))C4
|
[C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][C][Ring1][Branch1][C][C][O][Ring1][=N][C][Ring1][P]
|
[C@@H]18CN6CCO1.C6(=O)C1=C(C)CC1.[C@@H]7(C)C5=O.N15CC8C1.CC4=O.N47
|
C[C@H](NC(=O)[C@@H](C)CN(C)C)[C@@H](C)NC(=O)c1cc(O)c2ccoc2c1
|
C[C@H]NC=O)[C@@H]C)CNC)C))))))[C@@H]C)NC=O)cccO)cccoc5c9
|
[C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=C][O][C][Ring1][Branch1][=C][Ring1][#Branch2]
|
c18cc(O)c2ccoc2c1.C3(=O)[C@@H](C)C6.C[C@H]5[C@H]7C.N6(C)C.C48=O.N35.N47
|
Cc1ccc(C(=O)N(C)C[C@@H]2[C@H]3CN(C(=O)/C=C/[C@H]4CCCO4)C[C@@H]23)c(Br)c1
|
CccccC=O)NC)C[C@@H][C@H]CNC=O)/C=C/[C@H]CCCO5))))))))C[C@@H]65)))))))))cBr)c6
|
[C][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][/C][=C][/C@H1][C][C][C][O][Ring1][Branch1][C][C@@H1][Ring1][#C][Ring1][=C][C][Branch1][C][Br][=C][Ring2][Ring1][O]
|
Cc1ccc8c(Br)c1.[C@@H]1%10[C@H]2CN6C[C@@H]12.C=9[C@H]1CCCO1.C6(=O)C=9.C58=O.N57C.C7%10
|
Cc1ccnn1CC(=O)NC[C@](C)(CO)NC(=O)c1cccc(N2CC=CC2)c1
|
Ccccnn5CC=O)NC[C@]C)CO))NC=O)cccccNCC=CC5)))))c6
|
[C][C][=C][C][=N][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][N][C][C][=C][C][Ring1][Branch1][=C][Ring1][O]
|
c18cccc7c1.Cc1ccnn19.C5[C@]6(C)CO.N17CC=CC1.C9C3=O.C48=O.N35.N46
|
CC[C@@H](SC)C(=O)N(C)CCOCCNC(=O)c1ccc2nc(O)[nH]c2c1F
|
CC[C@@H]SC))C=O)NC)CCOCCNC=O)ccccncO)[nH]c5c9F
|
[C][C][C@@H1][Branch1][Ring1][S][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][O][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Branch1][C][O][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2][F]
|
c1%10ccc2nc(O)[nH]c2c1F.CC[C@@H]9C3=O.N37C.C7C5.C6C8.C4%10=O.S9C.O56.N48
|
COCCCCCC(=O)N1CCC(C[C@H](C)NC(=O)[C@H](F)c2ccccc2)CC1
|
COCCCCCC=O)NCCCC[C@H]C)NC=O)[C@H]F)cccccc6)))))))))))CC6
|
[C][O][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring2]
|
C5CCCCC3=O.N13CCC7CC1.c18ccccc1.C4(=O)[C@@H]8F.C7[C@@H]6C.CO5.N46
|
CC(C)(C(=O)N1C[C@@H]2[C@H](C1)C2(C)C)[C@@H]1CCCN1C(=O)C[C@@H]1CCCNC1=O
|
CCC)C=O)NC[C@@H][C@H]C5)C3C)C)))))))[C@@H]CCCN5C=O)C[C@@H]CCCNC6=O
|
[C][C][Branch1][C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][Ring2][Branch1][C][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@@H1][C][C][C][N][C][Ring1][=Branch1][=O]
|
N13C[C@@H]2[C@H](C1)C2(C)C.[C@@H]16CCCNC1=O.CC5(C)C3=O.[C@@H]15CCCN14.C4(=O)C6
|
CN(C[C@H]1CCN(C(=O)[C@H]2CCC(C)(C)C2)C1)C(=O)C12CCN(CC1)S(=O)(=O)C2
|
CNC[C@H]CCNC=O)[C@H]CCCC)C)C5))))))C5))))))C=O)CCCNCC6))S=O)=O)C6
|
[C][N][Branch2][Ring1][=N][C][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][C][Ring1][=C][C][=Branch1][C][=O][C][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch2]
|
C127CCN(CC1)S(=O)(=O)C2.[C@H]16CCC(C)(C)C1.[C@H]18CCN3C1.CN45.C36=O.C47=O.C58
|
Cc1ccn([C@H](C)CC(=O)N[C@H]2CCC[C@H]2NC(=O)C=Cc2cnc(C)s2)n1
|
Ccccn[C@H]C)CC=O)N[C@H]CCC[C@H]5NC=O)C=CccncC)s5))))))))))))))))))n5
|
[C][C][C][=C][N][Branch2][Ring2][Ring1][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Branch1][C][C][S][Ring1][=Branch1][N][=Ring2][Ring1][O]
|
C=7c1cnc(C)s1.Cc1ccn8n1.[C@@H]8(C)CC3=O.[C@H]15CCC[C@H]16.C4(=O)C=7.N35.N46
|
CCC(CC)[C@H](C)C(=O)NC12CC(C(=O)NCCOCCCO)(C1)C2
|
CCCCC))[C@H]C)C=O)NCCCC=O)NCCOCCCO)))))))))C4)C4
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][O][C][C][C][O][Branch1][Ring2][C][Ring1][=C][C][Ring1][#C]
|
CCC(CC)[C@H](C)C3=O.C128CC9(C1)C2.C6CCO.C49=O.C7C5.N38.N47.O56
|
O=C(CCN1C(=O)CCC1=O)NC1CC2(CCN(C(=O)[C@@H]3CCCO3)C2)C1
|
O=CCCNC=O)CCC5=O))))))))NCCCCCNC=O)[C@@H]CCCO5))))))C5))))C4
|
[O][=C][Branch1][=C][C][C][N][C][=Branch1][C][=O][C][C][C][Ring1][=Branch1][=O][N][C][C][C][Branch2][Ring1][Ring2][C][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][O][Ring1][Branch1][C][Ring1][N][C][Ring1][#C]
|
C16CC2(CCN5C2)C1.N18C(=O)CCC1=O.O=C4CC8.[C@@H]17CCCO1.C57=O.N46
|
CC[C@H](SC)C(=O)N1CC2(C1)CN(C(=O)[C@@H](COCc1ccccc1)OC)C2
|
CC[C@H]SC))C=O)NCCC4)CNC=O)[C@@H]COCcccccc6)))))))))OC))))C4
|
[C][C][C@H1][Branch1][Ring1][S][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][N][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][Ring1]
|
N13CC2(C1)CN4C2.CC[C@H]8C3=O.C4(=O)[C@H]7C5.c19ccccc1.S8C.O56.C69.O7C
|
C[C@H](C[C@H](C)NC(=O)c1cc(O)cnc1N)NC(=O)C1(C)C(C)(C)C1(C)C
|
C[C@H]C[C@H]C)NC=O)cccO)cnc6N)))))))))))NC=O)CC)CC)C)C3C)C
|
[C][C@H1][Branch2][Ring1][#Branch1][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][N][=C][Ring1][#Branch1][N][N][C][=Branch1][C][=O][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][Branch1][C][C][C]
|
c17cc(O)cnc1N.C16(C)C(C)(C)C1(C)C.C[C@@H]4C[C@@H]5C.C27=O.C36=O.N25.N34
|
C=C/C=C(\C)C(=O)N[C@@]1(CNC(=O)c2ccc([C@H](C)CC)nc2O)CCOC1
|
C=C/C=C\C)C=O)N[C@@]CNC=O)cccc[C@H]C)CC)))nc6O))))))))))CCOC5
|
[C][=C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C@@][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][C@H1][Branch1][C][C][C][C][N][=C][Ring1][#Branch2][O][C][C][O][C][Ring2][Ring1][Ring2]
|
c17ccc9nc1O.[C@]15%10CCOC1.C=8(C)C3=O.[C@@H]9(C)CC.C=CC=8.C47=O.N35.C6%10.N46
|
Cc1sc([C@H](NCCCC(C)C)c2nnnn2C2COC2)c(Br)c1C
|
Ccsc[C@H]NCCCCC)C))))))cnnnn5CCOC4))))))))))cBr)c5C
|
[C][C][S][C][Branch2][Ring1][#Branch2][C@H1][Branch1][#Branch2][N][C][C][C][C][Branch1][C][C][C][C][=N][N][=N][N][Ring1][Branch1][C][C][O][C][Ring1][Ring2][=C][Branch1][C][Br][C][=Ring2][Ring1][#Branch1][C]
|
Cc1sc5c(Br)c1C.C4CCC(C)C.c16nnnn17.C17COC1.[C@H]356.N34
|
C[C@H](C(=O)NCC12CC(CN1C(=O)Cc1ccc(Br)cc1F)C2)[C@@H](C)O
|
C[C@H]C=O)NCCCCCN5C=O)CccccBr)cc6F)))))))))))C4)))))))[C@@H]C)O
|
[C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][=Branch1][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][F][C][Ring1][P][C@@H1][Branch1][C][C][O]
|
c17ccc(Br)cc1F.C[C@H](C3=O)[C@@H](C)O.C126CC(CN14)C2.C4(=O)C7.N35.C56
|
O=C(Cc1cn[nH]c1)N1CC2(CCN(C(=O)[C@@H]3CCCCC(F)(F)C3)CC2)C1
|
O=CCccn[nH]c5))))))NCCCCNC=O)[C@@H]CCCCCF)F)C7))))))))CC6)))))C4
|
[O][=C][Branch1][=Branch2][C][C][C][=N][NH1][C][=Ring1][Branch1][N][C][C][Branch2][Ring1][=C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@@H1][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch2][C][C][Ring1][P][C][Ring2][Ring1][Ring2]
|
N14CC2(CCN5CC2)C1.[C@@H]16CCCCC(F)(F)C1.c17cn[nH]c1.O=C4C7.C56=O
|
COc1cc(C(=O)N2C[C@@]3(C(=O)N4C[C@@H]5CC[C@]5(C)C4)C[C@H]2CO3)sn1
|
COcccC=O)NC[C@@]C=O)NC[C@@H]CC[C@]4C)C7))))))))C[C@H]5CO5))))))))sn5
|
[C][O][C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][C][C][C][Ring1][Branch2][C][C@H1][Ring1][#C][C][O][Ring1][#C][S][N][=Ring2][Ring1][Branch2]
|
N16C[C@@]29C[C@H]1CO2.N17C[C@@H]2CC[C@]2(C)C1.c18cc%10sn1.C6%10=O.C79=O.CO8
|
O=C1CN(c2nnc(CC3CCCC3)n2CCC2CC2)[C@@H]2CCCC[C@H]2N1
|
O=CCNcnncCCCCCC5))))))n5CCCCC3))))))))))[C@@H]CCCC[C@H]6N%10
|
[O][=C][C][N][Branch2][Ring1][=Branch2][C][=N][N][=C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Branch1][N][Ring1][O][C][C][C][C][C][Ring1][Ring1][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][Ring2][Ring1][#Branch2]
|
O=C1CN4[C@@H]2CCCC[C@H]2N1.c14nnc6n15.C17CCCC1.C5C8.C18CC1.C67
|
CCCCCC1CN(C(=O)CN(C(=O)c2cc(C(C)=O)[nH]n2)C2CC2)C1
|
CCCCCCCNC=O)CNC=O)cccCC)=O))[nH]n5))))))CCC3))))))C4
|
[C][C][C][C][C][C][C][N][Branch2][Ring1][P][C][=Branch1][C][=O][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][NH1][N][=Ring1][Branch2][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Branch1]
|
c17cc8[nH]n1.CCCCC9.C19CN3C1.C3(=O)C5.N456.C47=O.C8(C)=O.C16CC1
|
Cc1cc2ccccc2nc1NNC(=O)c1c(Cl)cc(-c2nn[nH]n2)cc1Cl
|
Ccccccccc6nc%10NNC=O)ccCl)cc-cnn[nH]n5)))))cc6Cl
|
[C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][#Branch2][N][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=C][Branch1][Branch2][C][N][=N][NH1][N][=Ring1][Branch1][C][=C][Ring1][N][Cl]
|
Cc1cc2ccccc2nc1NNC3=O.c13c(Cl)cc4cc1Cl.c14nn[nH]n1
|
CC[C@@H](C)C[C@H](NC(=O)C#CC1CCCCC1)C(=O)NC1(C)CC(O)C1
|
CC[C@@H]C)C[C@H]NC=O)C#CCCCCCC6))))))))))C=O)NCC)CCO)C4
|
[C][C][C@@H1][Branch1][C][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][#C][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Branch1][C][O][C][Ring1][=Branch1]
|
C2(=O)C#CC1CCCCC1.CC[C@@H](C)C[C@H]4C3=O.C15(C)CC(O)C1.N24.N35
|
CC[C@]1(C)C[C@H](NC(=O)CSC)CN1C(=O)C=CCn1cncn1
|
CC[C@]C)C[C@H]NC=O)CSC)))))CN5C=O)C=CCncncn5
|
[C][C][C@][Branch1][C][C][C][C@H1][Branch1][=Branch2][N][C][=Branch1][C][=O][C][S][C][C][N][Ring1][N][C][=Branch1][C][=O][C][=C][C][N][C][=N][C][=N][Ring1][Branch1]
|
[C@@]18(C)C[C@H]5CN13.n17cncn1.C2(=O)C4.C3(=O)C=6.C=6C7.CC8.N25.S4C
|
Cc1occ(C(F)(F)F)c1COC(=O)C1(C(F)(F)F)CCCCCC1
|
CcoccCF)F)F))c5COC=O)CCF)F)F))CCCCCC7
|
[C][C][O][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=Ring1][=Branch2][C][O][C][=Branch1][C][=O][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][C][C][C][C][Ring1][O]
|
C145CCCCCC1.Cc1occ6c17.C6(F)(F)F.C5(F)(F)F.C24=O.C37.O23
|
Cc1ccc(C(=O)N2CC=C[C@H]2CNC(=O)[C@@H](CN(C)C)N(C)C)c(Cl)c1
|
CccccC=O)NCC=C[C@H]5CNC=O)[C@@H]CNC)C)))NC)C))))))))))))cCl)c6
|
[C][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][=C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][N][Branch1][C][C][C][N][Branch1][C][C][C][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch2]
|
Cc1ccc8c(Cl)c1.N13CC=C[C@H]19.C4(=O)[C@H]6C7.C38=O.N7(C)C.N6(C)C.C59.N45
|
CCN(c1ccsc1)[C@H](C(=O)NC(C)C)c1c2ccccc2nn1C
|
CCNcccsc5)))))[C@H]C=O)NCC)C))))ccccccc6nn9C
|
[C][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C@H1][Branch1][O][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][N][Ring1][=Branch2][C]
|
c18c2ccccc2nn1C.c17ccsc1.[C@H]58C3=O.N457.C6(C)C.CC4.N36
|
C[C@H](Cc1ccc(Cl)cc1)C(=O)NC[C@]1(F)C[C@@H](NC(=O)[C@@H]2C[C@H]3C=C[C@@H]2C3)C1
|
C[C@H]CccccCl)cc6)))))))C=O)NC[C@]F)C[C@@H]NC=O)[C@@H]C[C@H]C=C[C@@H]6C5)))))))))C4
|
[C][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C@H1][C][=C][C@@H1][Ring1][=Branch1][C][Ring1][Branch1][C][Ring1][#C]
|
c1%10ccc(Cl)cc1.[C@@H]18C[C@H]2C=C[C@@H]1C2.C[C@H](C%10)C4=O.[C@]19(F)C[C@H]7C1.C58=O.N46.C69.N57
|
CN(C)CCCC(=O)N1CC[C@@](O)(CCNC(=O)CCC[C@H]2CCCO2)C1
|
CNC)CCCC=O)NCC[C@@]O)CCNC=O)CCC[C@H]CCCO5))))))))))))C5
|
[C][N][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][O][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][C][C@H1][C][C][C][O][Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
N13CC[C@]8(O)C1.C5CCC3=O.C4(=O)CCC7.[C@H]17CCCO1.CN5C.C8C6.N46
|
CC(C)(C)OC(=O)N1CC2(CCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)C1
|
CCC)C)OC=O)NCCCCNCccCl)cccc6[N+]=O)[O-])))))))))CC6)))))C4
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][N][C][C][N][Branch2][Ring1][C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][N+1][=Branch1][C][=O][O-1][C][C][Ring1][P][C][Ring2][Ring1][Ring2]
|
N15CC2(CCN7CC2)C1.c18c(Cl)cccc1[N+](=O)[O-].CC6(C)C.C45=O.O46.C78
|
C[C@H]1CN(C(=O)c2cnn3c2CC(F)(F)C3)C[C@@H]1NC(=O)C1(S(C)(=O)=O)CC1
|
C[C@H]CNC=O)ccnnc5CCF)F)C5)))))))))C[C@@H]5NC=O)CSC)=O)=O))CC3
|
[C][C@H1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][C@@H1][Ring1][P][N][C][=Branch1][C][=O][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][#Branch1]
|
c18cnn2c1CC(F)(F)C2.C[C@H]1CN4C[C@@H]16.C17(S(C)(=O)=O)CC1.C48=O.C57=O.N56
|
CCCOCCC(=O)N1C[C@H](CNC(=O)c2cnc(O)n2C)[C@H](O)C1
|
CCCOCCC=O)NC[C@H]CNC=O)ccncO)n5C)))))))))[C@H]O)C5
|
[C][C][C][O][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][N][Ring1][=Branch1][C][C@H1][Branch1][C][O][C][Ring1][P]
|
N13C[C@@H](O)[C@@H]9C1.c18cnc(O)n1C.C6CC3=O.CCC5.C48=O.O56.C79.N47
|
C=CC[C@H](CNC(=O)C1(C)CCC(C)(C)CC1)NC(=O)c1ccc(C)c(C)n1
|
C=CC[C@H]CNC=O)CC)CCCC)C)CC6)))))))))NC=O)ccccC)cC)n6
|
[C][=C][C][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=N][Ring1][Branch2]
|
C17(C)CCC(C)(C)CC1.c16ccc(C)c(C)n1.C=CC[C@@H]4C5.C27=O.C36=O.N25.N34
|
CCOC(=O)NCC(=O)N[C@H](CC)CN(C)C(=O)CC[C@@H]1CCCCN1C
|
CCOC=O)NCC=O)N[C@H]CC))CNC)C=O)CC[C@@H]CCCCN6C
|
[C][C][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][C][N][Ring1][=Branch1][C]
|
[C@@H]1%10CCCCN1C.[C@H]8(C9)CC.C5(=O)CC%10.C7C4=O.C23=O.N59C.CC6.O26.N37.N48
|
CN(CC(=O)N[C@H](c1ccccc1)c1nccs1)Cc1cccnc1Cl
|
CNCC=O)N[C@H]cccccc6))))))cnccs5)))))))))Cccccnc6Cl
|
[C][N][Branch2][Ring1][=Branch2][C][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][C][=C][S][Ring1][Branch1][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Cl]
|
c18cccnc1Cl.c17ccccc1.c16nccs1.C3C2=O.CN35.[C@H]467.N24.C58
|
O=C(C[C@]12CC[C@H]1CN(C(=O)C1CC3(CSC3)C1)C2)N1CCO[C@@H](C2CCC2)C1
|
O=CC[C@]CC[C@H]4CNC=O)CCCCSC4)))C4)))))C7))))))))NCCO[C@@H]CCCC4))))C6
|
[O][=C][Branch2][Ring1][P][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][S][C][Ring1][Ring2][C][Ring1][#Branch1][C][Ring1][S][N][C][C][O][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][#Branch2]
|
[C@]127CC[C@H]1CN5C2.C16CC2(CSC2)C1.N14CCO[C@@H]8C1.O=C4C7.C18CCC1.C56=O
|
O=[N+]([O-])c1cc2c(cc1OCc1cccc3c1CCC3)OCCO2
|
O=[N+][O-])cccccc6OCcccccc6CCC5)))))))))))))OCCO6
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][Ring1][=Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Branch1][O][C][C][O][Ring2][Ring1][Ring1]
|
O=[N+]([O-])c1cc2c(cc15)OCCO2.c16cccc2c1CCC2.O45.C46
|
COCc1nc(CC(=O)NC[C@H](C)CNC(=O)CCN(C)CCC(C)(C)C)cs1
|
COCcncCC=O)NC[C@H]C)CNC=O)CCNC)CCCC)C)C)))))))))))))))cs5
|
[C][O][C][C][=N][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][N][Branch1][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][S][Ring2][Ring1][#Branch2]
|
c19nc%10cs1.C8CC(C)(C)C.C5[C@H](C)C6.C3(=O)CC7.C%10C2=O.N78C.CO4.C49.N25.N36
|
COCCOc1ccnc(CNC(=O)c2cncn2-c2ccc(Br)cc2)c1
|
COCCOcccncCNC=O)ccncn5-ccccBr)cc6))))))))))))))c6
|
[C][O][C][C][O][C][=C][C][=N][C][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][=Branch1]
|
c16ccnc9c1.c1%10ccc(Br)cc1.c18cncn1%10.C4C5.C38=O.CO4.O56.C79.N37
|
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