SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(C)(C)NS(=O)(=O)CC(=O)NCC1=CCN(Cc2cccc(Cl)c2)CC1
|
CCC)C)NS=O)=O)CC=O)NCC=CCNCcccccCl)c6)))))))CC6
|
[C][C][Branch1][C][C][Branch1][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][=C][C][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][Ring1][=C]
|
C5C1=CCN6CC1.S7(=O)(=O)CC3=O.c18cccc(Cl)c1.CC4(C)C.N47.N35.C68
|
O=C(CCc1cncs1)NC[C@@H]1CN2CCCC[C@H]2CN1C(=O)C1=CCCOC1
|
O=CCCccncs5)))))))NC[C@@H]CNCCCC[C@H]6CN%10C=O)C=CCCOC6
|
[O][=C][Branch1][#Branch2][C][C][C][=C][N][=C][S][Ring1][Branch1][N][C][C@@H1][C][N][C][C][C][C][C@H1][Ring1][=Branch1][C][N][Ring1][#Branch2][C][=Branch1][C][=O][C][=C][C][C][O][C][Ring1][=Branch1]
|
[C@@H]16CN2CCCC[C@H]2CN14.C4(=O)C1=CCCOC1.O=C3CC7.c17cncs1.N35.C56
|
CC(=O)NC1(C(=O)NCc2ccc(CCNC(=O)CCC(C)(C)F)cc2)CCC1
|
CC=O)NCC=O)NCccccCCNC=O)CCCC)C)F))))))))cc6)))))))))CCC4
|
[C][C][=Branch1][C][=O][N][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][F][C][=C][Ring1][P][C][C][C][Ring2][Ring1][=Branch2]
|
C5(=O)CCC(C)(C)F.c1%10ccc%11cc1.C169CCC1.CC3=O.C49=O.C%11C8.N36.N47.C7%10.N58
|
O=C1NC[C@@H](C(=O)N[C@@]23CC[C@@H](C2)N(C(=O)C(CC2CC2)CC2CC2)C3)N1
|
O=CNC[C@@H]C=O)N[C@@]CC[C@@H]C5)NC=O)CCCCC3))))CCCC3))))))C6))))))))N5
|
[O][=C][N][C][C@@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@@][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch1][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][C][C][Ring1][Ring1][C][Ring2][Ring1][C][N][Ring2][Ring1][#Branch2]
|
[C@@]126CC[C@@H](C1)N5C2.C5(=O)C(C8)C9.O=C1NC[C@@H]7N1.C47=O.C18CC1.C19CC1.N46
|
Cc1nnc(C)c(N2CC3(CCOCC3)C[C@@H]2C)c1Br
|
CcnncC)cNCCCCOCC6)))))C[C@@H]5C))))))c6Br
|
[C][C][=N][N][=C][Branch1][C][C][C][Branch2][Ring1][C][N][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][C@@H1][Ring1][#Branch2][C][=C][Ring2][Ring1][C][Br]
|
N14CC2(CCOCC2)C[C@@H]1C.Cc1nnc(C)c4c1Br
|
C[C@H](C(=O)N[C@H]1C=CCN(C(=O)[C@@]23CCC[C@@](C)(C2)OC3)C1)N(C)CC(F)(F)F
|
C[C@H]C=O)N[C@H]C=CCNC=O)[C@@]CCC[C@@]C)C6)OC7))))))))C6))))))))NC)CCF)F)F
|
[C][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@H1][C][=C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@@][C][C][C][C@@][Branch1][C][C][Branch1][Ring2][C][Ring1][#Branch1][O][C][Ring1][=Branch2][C][Ring1][P][N][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
[C@@]129CCC[C@@](C)(C1)OC2.[C@H]18C=CCN5C1.C[C@@H]6C4=O.C7C(F)(F)F.C59=O.N67C.N48
|
CC(C)[C@H](C(=O)N1CCOCC(F)(F)C1)[C@@H](C)NC(=O)Cc1ccc(O)cc1
|
CCC)[C@H]C=O)NCCOCCF)F)C7))))))))[C@@H]C)NC=O)CccccO)cc6
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][O][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]
|
CC(C)[C@H](C2=O)[C@H]4C.N12CCOCC(F)(F)C1.c15ccc(O)cc1.C3(=O)C5.N34
|
O=C(NC[C@H]1[C@H](O)[C@H](O)CN1C(=O)c1cc(O)c2ccsc2c1)[C@H]1CC12CC2
|
O=CNC[C@H][C@H]O)[C@H]O)CN5C=O)cccO)cccsc5c9)))))))))))))))))[C@H]CC3CC3
|
[O][=C][Branch2][Ring2][Ring2][N][C][C@H1][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=C][S][C][Ring1][Branch1][=C][Ring1][#Branch2][C@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1]
|
c17cc(O)c2ccsc2c1.[C@H]18[C@H](O)[C@H](O)CN14.[C@H]16CC12CC2.O=C36.C47=O.N35.C58
|
COc1cc(C)c2cc(C(=O)Oc3cccc4[nH]ccc34)oc2c1
|
COcccC)cccC=O)Occccc[nH]ccc95)))))))))))oc5c9
|
[C][O][C][=C][C][Branch1][C][C][=C][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][O][C][=C][C][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][O][C][Ring1][P][=C][Ring2][Ring1][=Branch1]
|
c16cc(C)c2cc8oc2c1.c17cccc2[nH]ccc12.C58=O.CO6.O57
|
CSCCCC(=O)N1CC(C)(C)C[C@H]1CNC(=O)[C@@H]1CCCO[C@H]1C
|
CSCCCC=O)NCCC)C)C[C@H]5CNC=O)[C@@H]CCCO[C@H]6C
|
[C][S][C][C][C][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][O][C@H1][Ring1][=Branch1][C]
|
N12CC(C)(C)C[C@H]17.[C@@H]16CCCO[C@H]1C.C5CCC2=O.C36=O.CS5.C47.N34
|
C=CC[C@H](CNC(=O)CN1CCCC1)NC(=O)C[C@@H]1C[C@H]1C(F)(F)F
|
C=CC[C@H]CNC=O)CNCCCC5)))))))))NC=O)C[C@@H]C[C@H]3CF)F)F
|
[C][=C][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][N][C][C][C][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][C@@H1][C][C@H1][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
|
C=CC[C@@H]4C5.N16CCCC1.C2(=O)C6.C3(=O)C7.[C@@H]17C[C@H]18.C8(F)(F)F.N25.N34
|
C=C(Cl)CCC(=O)N[C@@H]1C[C@H]1NC(=O)c1ccc(CC)cn1
|
C=CCl)CCC=O)N[C@@H]C[C@H]3NC=O)ccccCC))cn6
|
[C][=C][Branch1][C][Cl][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][C][C][=N][Ring1][Branch2]
|
C=C(Cl)CCC2=O.c16ccc7cn1.[C@@H]14C[C@H]15.C36=O.N24.N35.C7C
|
CC(C)=C[C@@H]1[C@@H](C(=O)N2CCC[C@@H]2C2(NC(=O)Cc3nncs3)CC2)C1(C)C
|
CCC)=C[C@@H][C@@H]C=O)NCCC[C@@H]5CNC=O)Ccnncs5))))))))CC3)))))))))C3C)C
|
[C][C][Branch1][C][C][=C][C@@H1][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][Branch1][=C][N][C][=Branch1][C][=O][C][C][=N][N][=C][S][Ring1][Branch1][C][C][Ring1][N][C][Ring2][Ring1][=Branch1][Branch1][C][C][C]
|
C=8[C@@H]1[C@@H]7C1(C)C.N14CCC[C@@H]1%10.c19nncs1.C16%10CC1.C5(=O)C9.CC=8C.C47=O.N56
|
Cc1ccnc(Cl)c1C(=O)N1C[C@H](NS(=O)(=O)c2ccn(C)n2)[C@@H](C)C1
|
CcccncCl)c6C=O)NC[C@H]NS=O)=O)cccnC)n5)))))))[C@@H]C)C5
|
[C][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C@@H1][Branch1][C][C][C][Ring1][S]
|
S4(=O)(=O)c1ccn(C)n1.Cc1ccnc(Cl)c16.N13C[C@H]5[C@@H](C)C1.C36=O.N45
|
CCC(CC)C(=O)N(C)[C@@H]1CN(C(=O)[C@H]2CC(=O)Nc3ncn(C)c32)CC1(C)C
|
CCCCC))C=O)NC)[C@@H]CNC=O)[C@H]CC=O)NcncnC)c59))))))))))CC5C)C
|
[C][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C@H1][C][C][=Branch1][C][=O][N][C][N][=C][N][Branch1][C][C][C][=Ring1][=Branch1][Ring1][O][C][C][Ring2][Ring1][C][Branch1][C][C][C]
|
C5(=O)[C@H]1CC(=O)Nc2ncn(C)c21.[C@@H]16CN5CC1(C)C.CCC(CC)C4=O.N46C
|
O=C(NCC1[C@@H]2COC[C@@H]12)NC[C@@H]1CC2(CCO1)CC2
|
O=CNCC[C@@H]COC[C@@H]65))))))))NC[C@@H]CCCCO6)))CC3
|
[O][=C][Branch1][=N][N][C][C][C@@H1][C][O][C][C@@H1][Ring1][=Branch1][Ring1][Branch1][N][C][C@@H1][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch1]
|
[C@@H]17CC2(CCO1)CC2.C18[C@@H]2COC[C@@H]12.O=C34.N35.C58.N46.C67
|
CCCn1cc(C(=O)NC2(C)CN(C(=O)[C@]34C[C@@H](O)[C@H]3C4)C2)cn1
|
CCCnccC=O)NCC)CNC=O)[C@]C[C@@H]O)[C@H]4C5))))))C4))))))cn5
|
[C][C][C][N][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@][C][C@@H1][Branch1][C][O][C@H1][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][=N][C][=N][Ring2][Ring1][Branch1]
|
n1%10cc9cn1.C17(C)CN6C1.[C@]128C[C@@H](O)[C@H]1C2.CCC%10.C59=O.C68=O.N57
|
C[C@H](C(=O)N[C@H]1CC[C@H]1CNC(=O)c1c[nH]c2nc(Cl)ccc12)c1ccnn1C
|
C[C@H]C=O)N[C@H]CC[C@H]4CNC=O)cc[nH]cncCl)ccc96))))))))))))))))))cccnn5C
|
[C][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][NH1][C][=N][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=C][C][=N][N][Ring1][Branch1][C]
|
c17c[nH]c2nc(Cl)ccc12.c18ccnn1C.C[C@@H]8C3=O.[C@H]16CC[C@H]19.C47=O.N36.C59.N45
|
Cc1c(I)ccn(CC(=O)N2CCC(c3n[nH]c(CN)n3)CC2)c1=O
|
CccI)ccnCC=O)NCCCcn[nH]cCN))n5)))))CC6))))))))c6=O
|
[C][C][=C][Branch1][C][I][C][=C][N][Branch2][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][Branch1][N][C][=N][NH1][C][Branch1][Ring1][C][N][=N][Ring1][#Branch1][C][C][Ring1][=N][C][Ring2][Ring1][#Branch1][=O]
|
Cc1c(I)ccn5c1=O.N14CCC7CC1.c17n[nH]c6n1.C5C4=O.C6N
|
Nc1ccc(C(=O)N2C[C@H]3OCCN(C(=O)CCC4CCC4)[C@H]3C2)nc1
|
NccccC=O)NC[C@H]OCCNC=O)CCCCCC4)))))))[C@H]6C9))))))))))nc6
|
[N][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][O][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][Ring2][C@H1][Ring1][=C][C][Ring1][P][N][=C][Ring2][Ring1][=Branch2]
|
N15C[C@H]2OCCN6[C@H]2C1.Nc1ccc7nc1.C6(=O)CC8.C18CCC1.C57=O
|
C[C@@H]1C[C@@H]2C[C@H]2C[C@@H]1C(=O)N1CC(CNC(=O)C2=CS(=O)(=O)CCC2)C1
|
C[C@@H]C[C@@H]C[C@H]3C[C@@H]7C=O)NCCCNC=O)C=CS=O)=O)CCC6)))))))))C4
|
[C][C@@H1][C][C@@H1][C][C@H1][Ring1][Ring1][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Branch2][C][Ring1][S]
|
C4(=O)C1=CS(=O)(=O)CCC1.C[C@@H]1C[C@@H]2C[C@H]2C[C@@H]16.N13CC7C1.C36=O.C57.N45
|
C#C[C@H](C)CC1CN(C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCO[C@@H]2C(C)C)C1
|
C#C[C@H]C)CCCNC=O)[C@H]CCC)C)))NC)C=O)[C@@H]CCO[C@@H]5CC)C)))))))))))C4
|
[C][#C][C@H1][Branch1][C][C][C][C][C][N][Branch2][Ring2][C][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][O][C@@H1][Ring1][Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch1]
|
C3(=O)[C@@H]5CC(C)C.[C@@H]16CCO[C@@H]17.C#C[C@H](C)C8.C18CN3C1.N45C.C46=O.C7(C)C
|
Cc1nc2cc(C(=O)NC[C@H]3C[C@@H]3CNC(=O)CCC3CCOCC3)cnc2s1
|
CcncccC=O)NC[C@H]C[C@@H]3CNC=O)CCCCCOCC6)))))))))))))))))cnc6s9
|
[C][C][=N][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][C][O][C][C][Ring1][=Branch1][=C][N][=C][Ring2][Ring1][=Branch2][S][Ring2][Ring1][N]
|
Cc1nc2cc8cnc2s1.C1%11CCOCC1.C5(=O)CC%11.[C@H]19C[C@@H]1%10.C48=O.N46.C69.C7%10.N57
|
C=C(Cl)CCC(=O)N[C@H](CO)CNC(=O)c1ccc(C#N)cc1C
|
C=CCl)CCC=O)N[C@H]CO))CNC=O)ccccC#N))cc6C
|
[C][=C][Branch1][C][Cl][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C]
|
c16ccc(C#N)cc1C.C=C(Cl)CCC2=O.[C@H]4(C5)CO.C36=O.N24.N35
|
CC(=O)N1CC[C@@H](NC(=O)[C@@]2(c3ccccc3)CC2(C)C)[C@H](O)C1
|
CC=O)NCC[C@@H]NC=O)[C@@]cccccc6))))))CC3C)C))))))[C@H]O)C6
|
[C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C@@][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=Branch2][Branch1][C][C][C][C@H1][Branch1][C][O][C][Ring2][Ring1][Branch1]
|
N14CC[C@@H]6[C@H](O)C1.[C@]178CC1(C)C.c18ccccc1.CC4=O.C57=O.N56
|
CC(C)Cn1ccc(C(=O)N(C)[C@H](C)CN(C)C(=O)[C@H]2C[C@H]3C=CC[C@H](C3)C2)n1
|
CCC)CncccC=O)NC)[C@H]C)CNC)C=O)[C@H]C[C@H]C=CC[C@H]C6)C8))))))))))))))n5
|
[C][C][Branch1][C][C][C][N][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C@H1][C][=C][C][C@H1][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][=N][Ring2][Ring1][=Branch2]
|
[C@H]19C[C@H]2C=CC[C@@H](C1)C2.n1%10ccc8n1.CC(C)C%10.[C@@H]6(C)C7.C48=O.N46C.N57C.C59=O
|
CCc1cc(C(=O)NCCN(C[C@@H](C)O)C(=O)[C@H]2CC23CCC(F)(F)CC3)n[nH]1
|
CCcccC=O)NCCNC[C@@H]C)O)))C=O)[C@H]CC3CCCF)F)CC6))))))))))))))n[nH]5
|
[C][C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C@@H1][Branch1][C][C][O][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][=N][NH1][Ring2][Ring1][O]
|
[C@H]1%10CC12CCC(F)(F)CC2.c1%11cc9n[nH]1.C8[C@@H](C)O.C49=O.C6C7.N578.C5%10=O.CC%11.N46
|
COC[C@@H](C)C(=O)N(C1CC1)C1(C(=O)NC[C@H]2C=CCCC2)CCC1
|
COC[C@@H]C)C=O)NCCC3)))CC=O)NC[C@H]C=CCCC6)))))))))CCC4
|
[C][O][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Branch1][#C][C][=Branch1][C][=O][N][C][C@H1][C][=C][C][C][C][Ring1][=Branch1][C][C][C][Ring1][=C]
|
C5[C@@H](C)C3=O.[C@H]1%10C=CCCC1.C169CCC1.N368.C18CC1.C49=O.CO5.N47.C7%10
|
C[C@@H]1C[C@H](C(=O)N[C@@H]2CCCC[C@]23CCN(c2ncc(Br)c(O)n2)C3)[C@@H](C)O1
|
C[C@@H]C[C@H]C=O)N[C@@H]CCCC[C@]6CCNcnccBr)cO)n6))))))C5))))))))))))[C@@H]C)O5
|
[C][C@@H1][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C@][Ring1][=Branch1][C][C][N][Branch1][#C][C][=N][C][=C][Branch1][C][Br][C][Branch1][C][O][=N][Ring1][Branch2][C][Ring1][=N][C@@H1][Branch1][C][C][O][Ring2][Ring1][O]
|
[C@@H]16CCCC[C@]12CCN5C2.c15ncc(Br)c(O)n1.C[C@@H]1C[C@H]7[C@@H](C)O1.C47=O.N46
|
Cc1cccc2c1C[C@@H](C(=O)N1CCC[C@](CO)(NC(=O)COCC(C)C)C1)O2
|
Ccccccc6C[C@@H]C=O)NCCC[C@]CO))NC=O)COCCC)C)))))))C6)))))))O5
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][Ring1][C][O][Branch1][=C][N][C][=Branch1][C][=O][C][O][C][C][Branch1][C][C][C][C][Ring1][P][O][Ring2][Ring1][Branch2]
|
Cc1cccc2c1C[C@@H]8O2.N13CCC[C@@]79C1.C4(=O)C5.C6C(C)C.C38=O.C9O.N47.O56
|
CCOC(=O)[C@H](F)C(=O)N[C@H](C)[C@H](C)NC(=O)c1ccncc1NC(C)=O
|
CCOC=O)[C@H]F)C=O)N[C@H]C)[C@H]C)NC=O)cccncc6NCC)=O
|
[C][C][O][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][Branch1][C][C][=O]
|
C2(=O)[C@H](F)C3=O.c1%10ccncc19.[C@@H]7(C)[C@@H]8C.C4%10=O.C5(C)=O.CC6.O26.N37.N48.N59
|
Cc1ccc(C(=O)NC[C@@]2(C3CC3)CCN(C(=O)[C@H](C)C3CCCC3)C2)c(C)n1
|
CccccC=O)NC[C@@]CCC3)))CCNC=O)[C@H]C)CCCCC5)))))))C5))))))))cC)n6
|
[C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@@][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][C][C][C][Ring1][Branch1][C][Ring1][P][C][Branch1][C][C][=N][Ring2][Ring1][N]
|
[C@]18(C2CC2)CCN5C1.Cc1ccc7c(C)n1.C5(=O)[C@@H]9C.C19CCCC1.C47=O.N46.C68
|
CCN=c1ccc(C(=O)N[C@H]2CN(C(=O)CN(C)C(C)C)C[C@H]2OC)c[nH]1
|
CCN=ccccC=O)N[C@H]CNC=O)CNC)CC)C)))))C[C@H]5OC)))))))))c[nH]6
|
[C][C][N][=C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][Branch1][C][C][C][Branch1][C][C][C][C][C@H1][Ring1][=N][O][C][=C][NH1][Ring2][Ring1][Branch2]
|
CCN=c1ccc9c[nH]1.[C@H]18CN4C[C@H]15.C4(=O)C6.C39=O.N67C.C7(C)C.N38.O5C
|
O=C1CC(CC(=O)N2C[C@@H]3[C@@H](CC(=O)NCCCc4cnccn4)[C@@H]3C2)C1
|
O=CCCCC=O)NC[C@@H][C@@H]CC=O)NCCCccnccn6))))))))))))[C@@H]3C6))))))))C4
|
[O][=C][C][C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][C@@H1][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C][=C][N][=C][C][=N][Ring1][=Branch1][C@@H1][Ring1][S][C][Ring2][Ring1][Ring1][C][Ring2][Ring1][#Branch2]
|
N15C[C@@H]2[C@@H]%10[C@@H]2C1.c18cnccn1.O=C1CC9C1.C9C5=O.C%10C6=O.C7CC8.N67
|
C[C@H](C(=O)N(C)CCN(C)C)[C@H]1CCN(C(=O)CN2CCNC(=O)C2)C1
|
C[C@H]C=O)NC)CCNC)C))))))[C@H]CCNC=O)CNCCNC=O)C6))))))))C5
|
[C][C@H1][Branch1][S][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch1][C][C][C][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][N][C][C][N][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring1][#C]
|
N17CCNC(=O)C1.[C@H]18CCN4C1.C[C@@H]8C3=O.C4(=O)C7.N35C.C5C6.N6(C)C
|
CO[C@H](C(=O)N[C@H]1C[C@@H](CNC(=O)COCC2CCCC2)C1)C1CC1
|
CO[C@H]C=O)N[C@H]C[C@@H]CNC=O)COCCCCCC5)))))))))))C4))))))CCC3
|
[C][O][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][O][C][C][C][C][C][C][Ring1][Branch1][C][Ring1][S][C][C][C][Ring1][Ring1]
|
[C@H]6%11C3=O.[C@H]1%10C[C@@H]%12C1.C14CCCC1.C5(=O)C7.C1%11CC1.CO6.N3%10.C9%12.N59.O78.C84
|
C=CCCCCCCCCN1[C@@H](C)COC[C@@H]1C
|
C=CCCCCCCCCN[C@@H]C)COC[C@@H]6C
|
[C][=C][C][C][C][C][C][C][C][C][N][C@@H1][Branch1][C][C][C][O][C][C@@H1][Ring1][#Branch1][C]
|
C=CCCCCCCCC2.N12[C@@H](C)COC[C@@H]1C
|
Cc1cnsc1C(=O)N[C@@H](C)c1nc(C(=O)N(C)CC(C)(C)O)co1
|
Cccnsc5C=O)N[C@@H]C)cncC=O)NC)CCC)C)O)))))co5
|
[C][C][C][=N][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=N][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][O][=C][O][Ring1][=C]
|
Cc1cnsc16.c18nc7co1.C5C(C)(C)O.C26=O.[C@@H]48C.C37=O.N35C.N24
|
C[C@@H]1[C@@H](NC(=O)[C@]2(c3ccccc3)CCN(C)C2)CCN1C(=O)CCS(C)(=O)=O
|
C[C@@H][C@@H]NC=O)[C@]cccccc6))))))CCNC)C5)))))))CCN5C=O)CCSC)=O)=O
|
[C][C@@H1][C@@H1][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C@][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][Branch1][C][C][C][Ring1][N][C][C][N][Ring2][Ring1][Ring2][C][=Branch1][C][=O][C][C][S][Branch1][C][C][=Branch1][C][=O][=O]
|
C5(=O)CCS(C)(=O)=O.C[C@@H]1[C@@H]6CCN15.[C@@]178CCN(C)C1.c18ccccc1.C47=O.N46
|
CC[C@H](CN(C)C(=O)CC1C[C@@H]2C[C@H]2C1)NC(=O)c1ccc(N)c(C)c1C
|
CC[C@H]CNC)C=O)CCC[C@@H]C[C@H]3C6))))))))))NC=O)ccccN)cC)c6C
|
[C][C][C@H1][Branch2][Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][Branch1][C][C][=C][Ring1][Branch2][C]
|
c17ccc(N)c(C)c1C.C18C[C@@H]2C[C@H]2C1.CC[C@@H]5C6.C3(=O)C8.N36C.C47=O.N45
|
CC[C@H](C(=O)N[C@@H](C)C1(O)CN(C(=O)C2=C(C)CCC2)C1)n1ccc(C2CC2)n1
|
CC[C@H]C=O)N[C@@H]C)CO)CNC=O)C=CC)CCC5))))))C4)))))))ncccCCC3)))n5
|
[C][C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][Branch1][C][O][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][C][C][Ring1][=Branch1][C][Ring1][=N][N][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][Branch2]
|
C4(=O)C1=C(C)CCC1.CC[C@@H]6C3=O.C17(O)CN4C1.n16ccc8n1.[C@@H]57C.C18CC1.N35
|
CN(C[C@@H](O)CF)S(=O)(=O)c1ccc(N2CC[C@@H](c3ccc(F)cc3)C2)c(Br)c1
|
CNC[C@@H]O)CF))))S=O)=O)ccccNCC[C@@H]ccccF)cc6))))))C5)))))cBr)c6
|
[C][N][Branch1][Branch2][C][C@@H1][Branch1][C][O][C][F][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Branch1][N][C][C][C@@H1][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][N][C][Branch1][C][Br][=C][Ring2][Ring1][Ring1]
|
S5(=O)(=O)c1ccc6c(Br)c1.c17ccc(F)cc1.N16CC[C@@H]7C1.C4[C@@H](O)CF.CN45
|
CCc1nnc(C)cc1C(=O)N1CC(F)(F)C[C@H]1CCNC(=O)CNC=O
|
CCcnncC)cc6C=O)NCCF)F)C[C@H]5CCNC=O)CNC=O
|
[C][C][C][=N][N][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][C@H1][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][N][C][=O]
|
c18nnc(C)cc16.N12CC(F)(F)C[C@H]17.C3(=O)C5.C26=O.C7C4.N5C=O.CC8.N34
|
CO[C@H](CSC)C(=O)N1CCC(C)(NC(=O)c2csc(CO)n2)CC1
|
CO[C@H]CSC)))C=O)NCCCC)NC=O)ccscCO))n5)))))))CC6
|
[C][O][C@H1][Branch1][Ring2][C][S][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][P][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][Ring1][C][O][=N][Ring1][#Branch1][C][C][Ring1][P]
|
N13CCC6(C)CC1.[C@@H]5(C7)C3=O.c18csc9n1.C48=O.CO5.S7C.N46.C9O
|
COC(=O)[C@H](C)C(=O)N1CC(F)(F)C[C@@H]1C(=O)Nc1ncnc2sccc12
|
COC=O)[C@H]C)C=O)NCCF)F)C[C@@H]5C=O)Ncncncsccc95
|
[C][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=N][C][=N][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
c16ncnc2sccc12.N14CC(F)(F)C[C@@H]17.C3(=O)[C@H](C)C4=O.C57=O.CO3.N56
|
CSc1cc(F)ccc1C(=O)N1CC(O)(CNC(=O)[C@@H]2CC[C@H](C)O2)C1
|
CScccF)ccc6C=O)NCCO)CNC=O)[C@@H]CC[C@H]C)O5))))))))C4
|
[C][S][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][C][C][C@H1][Branch1][C][C][O][Ring1][=Branch1][C][Ring1][#C]
|
c19cc(F)ccc17.N13CC8(O)C1.[C@@H]16CC[C@H](C)O1.C37=O.C46=O.CS9.C58.N45
|
COCC1(C(=O)NC[C@@]2(NC(=O)CCNC(C)=O)CC3CCC2CC3)CC=CC1
|
COCCC=O)NC[C@@]NC=O)CCNCC)=O)))))))CCCCC6CC6)))))))))))CC=CC5
|
[C][O][C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@][Branch1][=C][N][C][=Branch1][C][=O][C][C][N][C][Branch1][C][C][=O][C][C][C][C][C][Ring1][#C][C][C][Ring1][=Branch1][C][C][=C][C][Ring2][Ring1][#Branch2]
|
[C@@]1%105CC2CCC1CC2.C1%12%13CC=CC1.C6(=O)CC%11.C4%12=O.C7(C)=O.CO8.C8%13.N49.C95.N6%10.N7%11
|
CC(C)N1CC(C(=O)N(CC(=O)N(C)CCN=[N+]=[N-])CC2CC2)C1
|
CCC)NCCC=O)NCC=O)NC)CCN=[N+]=[N-]))))))))CCCC3))))))C4
|
[C][C][Branch1][C][C][N][C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][Branch1][#C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][=N+1][=N-1][C][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Branch1]
|
N15CC9C1.C7CN=[N+]=[N-].C6C4=O.CC5C.C39=O.N368.N47C.C1%10CC1.C8%10
|
C=CCO[C@H](C)C(=O)N[C@@H]1C[C@H]1CNC(=O)COc1cc(F)cc(F)c1
|
C=CCO[C@H]C)C=O)N[C@@H]C[C@H]3CNC=O)COcccF)ccF)c6
|
[C][=C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2]
|
c17cc(F)cc(F)c1.[C@@H]5(C)C2=O.[C@@H]19C[C@H]1%10.C3(=O)C6.C=CC4.O45.N29.C8%10.N38.O67
|
Cn1cnnc1SCC(=O)N[C@@H]1COCCN(c2nc(Cl)ncc2C(F)(F)F)C1
|
Cncnnc5SCC=O)N[C@@H]COCCNcncCl)ncc6CF)F)F))))))))C7
|
[C][N][C][=N][N][=C][Ring1][Branch1][S][C][C][=Branch1][C][=O][N][C@@H1][C][O][C][C][N][Branch2][Ring1][Ring2][C][=N][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][C]
|
[C@@H]16COCCN5C1.c15nc(Cl)ncc17.Cn1cnnc18.C4C3=O.C7(F)(F)F.S48.N36
|
CCCCCN(C)CCC(=O)NC(C)(C)[C@@H](C)NC(=O)c1ccc(C)c(Cl)c1Cl
|
CCCCCNC)CCC=O)NCC)C)[C@@H]C)NC=O)ccccC)cCl)c6Cl
|
[C][C][C][C][C][N][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][Branch2][Cl]
|
c18ccc(C)c(Cl)c1Cl.C6(C)(C)[C@H]7C.CCCCC4.C5CC2=O.N45C.C38=O.N26.N37
|
C[C@]1(C[C@H](C(=O)NC2CC(F)(F)C2)N2CC[C@H](c3ccccn3)C2)CCOC1
|
C[C@]C[C@H]C=O)NCCCF)F)C4))))))NCC[C@H]cccccn6))))))C5)))))))CCOC5
|
[C][C@][Branch2][Ring2][Branch2][C][C@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][N][C][C][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][O][C][C][O][C][Ring2][Ring1][O]
|
C[C@]17CCOC1.C7[C@@H]5C4=O.C16CC(F)(F)C1.N15CC[C@H]8C1.c18ccccn1.N46
|
Cc1ccc(CN(C)C(=O)C[S@@+]([O-])Cc2csc(C3CCCC3)n2)cc1
|
CccccCNC)C=O)C[S@@+][O-])CccscCCCCC5)))))n5)))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring1][S][C][N][Branch1][C][C][C][=Branch1][C][=O][C][S@@+1][Branch1][C][O-1][C][C][=C][S][C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][=N][Ring1][#Branch2][C][=C][Ring2][Ring1][=Branch2]
|
Cc1ccc7cc1.C4(=O)C[S@@+]([O-])C6.c16csc8n1.C18CCCC1.N45C.C57
|
COc1cc(C(=O)NCc2ccccc2CNC(=O)[C@H]2CCCO2)sc1Cl
|
COcccC=O)NCcccccc6CNC=O)[C@H]CCCO5)))))))))))))))))sc5Cl
|
[C][O][C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][O][Ring1][Branch1][S][C][=Ring2][Ring1][Branch2][Cl]
|
c15cc9sc1Cl.c1%10ccccc1%11.[C@H]18CCCO1.C39=O.C48=O.CO5.N36.C6%10.C7%11.N47
|
CCN(CC)C(=O)CCC(=O)N[C@H]1CC[C@@H]1NC(=O)C=Cc1cncc(F)c1
|
CCNCC))C=O)CCC=O)N[C@H]CC[C@@H]4NC=O)C=CccnccF)c6
|
[C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
C=9c1cncc(F)c1.C2(=O)CCC3=O.[C@H]17CC[C@@H]18.C4(=O)C=9.N256.CC5.C6C.N37.N48
|
CC[C@@H](C)CC(=O)N1CCOC[C@@H]1CCNC(=O)CCN1CCC(C)CC1
|
CC[C@@H]C)CC=O)NCCOC[C@@H]6CCNC=O)CCNCCCC)CC6
|
[C][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][C][N][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1]
|
CC[C@@H](C)CC2=O.N12CCOC[C@@H]16.N15CCC(C)CC1.C3(=O)CC5.C6C4.N34
|
C[C@@H](NC(=O)C[C@H]1OC[C@H]2CN(C(=O)c3cnco3)CC[C@H]21)c1ccc(Br)cn1
|
C[C@@H]NC=O)C[C@H]OC[C@H]CNC=O)ccnco5))))))CC[C@H]69))))))))))))ccccBr)cn6
|
[C][C@@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][C@H1][O][C][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][O][Ring1][Branch1][C][C][C@H1][Ring1][=N][Ring1][S][C][=C][C][=C][Branch1][C][Br][C][=N][Ring1][#Branch1]
|
[C@H]18OC[C@H]2CN5CC[C@H]21.c19ccc(Br)cn1.c17cnco1.C4(=O)C8.C[C@@H]69.C57=O.N46
|
Cc1ccc(NC(=O)[C@H]2CCCC[C@H]2C2CCNCC2)cc1NS(C)(=O)=O
|
CccccNC=O)[C@H]CCCC[C@H]6CCCNCC6))))))))))))))cc6NSC)=O)=O
|
[C][C][=C][C][=C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][C][C][N][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch1][N][S][Branch1][C][C][=Branch1][C][=O][=O]
|
[C@H]17CCCC[C@H]1C1CCNCC1.Cc1ccc5cc16.S4(C)(=O)=O.C37=O.N35.N46
|
CC(C)[C@@H](C(=O)N1CC2(C1)CC(C)(F)C2)[C@@H](C)NC(=O)c1sccc1CO
|
CCC)[C@@H]C=O)NCCC4)CCC)F)C4)))))))[C@@H]C)NC=O)csccc5CO
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch1][C][C][Branch1][C][F][C][Ring1][#Branch1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][C][O]
|
CC(C)[C@@H](C3=O)[C@H]5C.N13CC2(C1)CC(C)(F)C2.c16sccc17.C46=O.N45.C7O
|
C[C@]1(c2cn(CCCO)nn2)COCCN1C(=O)C1(C#N)CC=CC1
|
C[C@]ccnCCCO))))nn5)))))COCCN6C=O)CC#N))CC=CC5
|
[C][C@][Branch1][=C][C][=C][N][Branch1][Branch1][C][C][C][O][N][=N][Ring1][=Branch2][C][O][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][=C][C][Ring1][#Branch1]
|
C[C@]16COCCN13.C14(C#N)CC=CC1.c16cn5nn1.C5CCO.C34=O
|
CC(C)OCCC(=O)N1CC(C)(C)C[C@@H]1CC(=O)NCC[C@@H](C)C(F)(F)F
|
CCC)OCCC=O)NCCC)C)C[C@@H]5CC=O)NCC[C@@H]C)CF)F)F
|
[C][C][Branch1][C][C][O][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
N12CC(C)(C)C[C@@H]17.C6C[C@@H](C)C(F)(F)F.C5CC2=O.C7C3=O.CC4C.O45.N36
|
CC[C@@H]1C[C@H]1C(=O)N1CCC(C[C@H](C)NC(=O)c2cnc(F)cc2C)CC1
|
CC[C@@H]C[C@H]3C=O)NCCCC[C@H]C)NC=O)ccncF)cc6C)))))))))))CC6
|
[C][C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][C][Ring2][Ring1][Ring2]
|
c17cnc(F)cc1C.N13CCC9CC1.[C@@H]18C[C@H]16.C9[C@@H]5C.C36=O.C47=O.CC8.N45
|
CCOC1(C)CCN(c2nc3cc(C)ccc3c(=NCC3(C)CCCC3)[nH]2)CC1
|
CCOCC)CCNcncccC)ccc6c=NCCC)CCCC5)))))))[nH]%10))))))))))CC6
|
[C][C][O][C][Branch1][C][C][C][C][N][Branch2][Ring1][P][C][=N][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][=N][=N][C][C][Branch1][C][C][C][C][C][C][Ring1][=Branch1][NH1][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][#Branch2]
|
c16nc2cc(C)ccc2c(=NC7)[nH]1.C15(C)CCN6CC1.C17(C)CCCC1.CC4.O45
|
CC[C@H](N=c1ccc(Br)c(S(=O)(=O)N2CCC(CNC(C)=O)CC2)[nH]1)C1CCC1
|
CC[C@H]N=ccccBr)cS=O)=O)NCCCCNCC)=O))))CC6)))))))[nH]6)))))))CCCC4
|
[C][C][C@H1][Branch2][Ring2][=Branch2][N][=C][C][=C][C][Branch1][C][Br][=C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch1][Branch2][C][N][C][Branch1][C][C][=O][C][C][Ring1][O][NH1][Ring2][Ring1][Branch1][C][C][C][C][Ring1][Ring2]
|
CC[C@@H]6N=c1ccc(Br)c(S5(=O)=O)[nH]1.N15CCC7CC1.C16CCC1.C3(C)=O.C47.N34
|
CCOc1nc(C(=O)N(CC)[C@H](C)C(=O)NCCCOCC(C)C)co1
|
CCOcncC=O)NCC))[C@H]C)C=O)NCCCOCCC)C))))))))))))co5
|
[C][C][O][C][=N][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][O][C][C][Branch1][C][C][C][=C][O][Ring2][Ring1][#Branch1]
|
c18nc3co1.[C@@H]%10(C)C4=O.C%11CC6.C7C(C)C.C23=O.N29%10.CC5.O58.C9C.N4%11.O67
|
CC1=C(C(=O)N2CC[C@@H](O)[C@H](N(C)C(=O)[C@H]3OCC[C@H]3C(C)C)C2)SCCO1
|
CC=CC=O)NCC[C@@H]O)[C@H]NC)C=O)[C@H]OCC[C@H]5CC)C)))))))))C6)))))))SCCO6
|
[C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][O][C@H1][Branch2][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][O][C][C][C@H1][Ring1][Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1][S][C][C][O][Ring2][Ring1][O]
|
CC1=C(C4=O)SCCO1.N14CC[C@@H](O)[C@H]6C1.[C@H]17OCC[C@H]18.N56C.C57=O.C8(C)C
|
CC(C)(F)CC(=O)N(CCF)[C@H]1CCCN(C(=O)c2cnc(N)c(Cl)c2)C1
|
CCC)F)CC=O)NCCF)))[C@H]CCCNC=O)ccncN)cCl)c6)))))))C6
|
[C][C][Branch1][C][C][Branch1][C][F][C][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][F][C@H1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][N][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Ring1][S]
|
c17cnc(N)c(Cl)c1.CC(C)(F)CC3=O.[C@H]16CCCN4C1.N356.C5CF.C47=O
|
CCOC[C@H](C)C(=O)N1CC[C@H](C)[C@H]1C(=O)N1CCC(C2CCC2)CC1
|
CCOC[C@H]C)C=O)NCC[C@H]C)[C@H]5C=O)NCCCCCCC4))))CC6
|
[C][C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][C][Ring1][#Branch2]
|
N14CCC(C2CCC2)CC1.N13CC[C@H](C)[C@H]17.C6[C@H](C)C3=O.C47=O.CC5.O56
|
C=CCC1(C(=O)N2C[C@H](CNC(=O)C[C@](C)(O)CCC)[C@@H](C)C2)CCCC1
|
C=CCCC=O)NC[C@H]CNC=O)C[C@]C)O)CCC))))))))[C@@H]C)C5))))))CCCC5
|
[C][=C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C@][Branch1][C][C][Branch1][C][O][C][C][C][C@@H1][Branch1][C][C][C][Ring1][P][C][C][C][C][Ring2][Ring1][Branch2]
|
C4(=O)C[C@](C)(O)CCC.N13C[C@H]8[C@@H](C)C1.C167CCCC1.C=CC7.C36=O.C58.N45
|
O=C(C=C1CCC1)NC[C@H]1CN(C(=O)CN2CCSCC2)CC12CCOCC2
|
O=CC=CCCC4)))))NC[C@H]CNC=O)CNCCSCC6))))))))CC5CCOCC6
|
[O][=C][Branch1][Branch2][C][=C][C][C][C][Ring1][Ring2][N][C][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][N][C][C][S][C][C][Ring1][=Branch1][C][C][Ring1][=C][C][C][O][C][C][Ring1][=Branch1]
|
[C@H]18CN4CC12CCOCC2.N16CCSCC1.O=C3C=7.C1=7CCC1.C4(=O)C6.N35.C58
|
CC[C@@H](Cc1ccccc1C)C(=O)NC[C@@H](O)CNC(=O)CCc1ccc(C)o1
|
CC[C@@H]Ccccccc6C))))))))C=O)NC[C@@H]O)CNC=O)CCccccC)o5
|
[C][C][C@@H1][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][C][O][Ring1][=Branch1]
|
CC[C@@H](C7)C2=O.c17ccccc1C.c16ccc(C)o1.C4[C@@H](O)C5.C3(=O)CC6.N24.N35
|
CC[C@@H](C)C(=O)NC1([C@H]2CCN(c3ncnc4c3c(Br)nn4C)C2)CC1
|
CC[C@@H]C)C=O)NC[C@H]CCNcncncc6cBr)nn5C))))))))))C5)))))CC3
|
[C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][N][C@H1][C][C][N][Branch2][Ring1][C][C][=N][C][=N][C][=C][Ring1][=Branch1][C][Branch1][C][Br][=N][N][Ring1][=Branch1][C][C][Ring1][S][C][C][Ring2][Ring1][Ring1]
|
c17ncnc2c1c(Br)nn2C.C16([C@H]2CCN7C2)CC1.CC[C@@H](C)C5=O.N56
|
C#CCO[C@@H](C)C(=O)N[C@H](CCN(C)C)C(=O)NCCCc1nccs1
|
C#CCO[C@@H]C)C=O)N[C@H]CCNC)C))))C=O)NCCCcnccs5
|
[C][#C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][=N][C][=C][S][Ring1][Branch1]
|
[C@@H]6(CC7)C3=O.[C@H]5(C)C2=O.c19nccs1.C8CC9.C#CC4.N7(C)C.O45.N26.N38
|
COC(=O)[C@]12CCCO[C@H]1CN(C(=O)NCc1cc(Br)cc(C)c1F)C2
|
COC=O)[C@]CCCO[C@H]6CNC=O)NCcccBr)ccC)c6F))))))))))C9
|
[C][O][C][=Branch1][C][=O][C@][C][C][C][O][C@H1][Ring1][=Branch1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][C][Br][=C][C][Branch1][C][C][=C][Ring1][Branch2][F][C][Ring2][Ring1][=Branch1]
|
[C@]127CCCO[C@H]1CN4C2.c18cc(Br)cc(C)c1F.C37=O.C45=O.CO3.N56.C68
|
CC[C@@H](CNC(=O)CCCC(F)F)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1
|
CC[C@@H]CNC=O)CCCCF)F))))))))NC=O)ccccc[N+]=O)[O-]))ccc6o9
|
[C][C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][F][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][O][Ring1][N]
|
c17cc2cc([N+](=O)[O-])ccc2o1.C3(=O)CCCC(F)F.CC[C@H]5C6.C47=O.N36.N45
|
CCN(CC)S(=O)(=O)CC(=O)N(C)[C@@H]1C[C@H]2C[C@@H]1N(C(=O)CC(C)(C)C1CC1)C2
|
CCNCC))S=O)=O)CC=O)NC)[C@@H]C[C@H]C[C@@H]5NC=O)CCC)C)CCC3))))))C5
|
[C][C][N][Branch1][Ring1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C@H1][C][C@@H1][Ring1][Branch1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring1][=C]
|
[C@@H]18C[C@H]2C[C@@H]1N4C2.S7(=O)(=O)CC3=O.C4(=O)CC9(C)C.N567.N38C.C19CC1.CC5.C6C
|
C[C@@H](NC(=O)C(C)(C)F)[C@@H](CO)NC(=O)C[C@H](n1ccnc1)C(F)(F)F
|
C[C@@H]NC=O)CC)C)F))))[C@@H]CO))NC=O)C[C@H]nccnc5)))))CF)F)F
|
[C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][F][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][C@H1][Branch1][Branch2][N][C][=C][N][=C][Ring1][Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)C[C@H]6C(F)(F)F.C[C@@H]4[C@H]5CO.C2(=O)C(C)(C)F.n16ccnc1.N24.N35
|
CC(C)CO[C@H]1C[C@H](NC(=O)NCCc2ccc(NS(C)(=O)=O)cc2)C1(C)C
|
CCC)CO[C@H]C[C@H]NC=O)NCCccccNSC)=O)=O)))cc6)))))))))))C4C)C
|
[C][C][Branch1][C][C][C][O][C@H1][C][C@H1][Branch2][Ring1][N][N][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][Branch1][#Branch2][N][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][O][C][Ring2][Ring1][Branch1][Branch1][C][C][C]
|
[C@H]16C[C@H]%10C1(C)C.c1%11ccc9cc1.CC(C)C5.S8(C)(=O)=O.C34=O.C7C%11.O56.N3%10.N47.N89
|
CC[C@@H](CN(CC)C(=O)c1ccc(OC(C)C)nc1)NC(=O)C1(CO)CCCC1
|
CC[C@@H]CNCC))C=O)ccccOCC)C)))nc6)))))))))NC=O)CCO))CCCC5
|
[C][C][C@@H1][Branch2][Ring1][O][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][O][C][Branch1][C][C][C][N][=C][Ring1][#Branch2][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][C][C][Ring1][#Branch1]
|
c1%11ccc6nc1.C1%103CCCC1.CC[C@H]7C8.N289.C2%11=O.C5(C)C.C4%10=O.C9C.O56.N47.C3O
|
Nc1c(Cl)ccc(C(=O)N2CC[C@@H](NC(=O)[C@H]3C[C@@H](F)C3)[C@H](F)C2)c1Cl
|
NccCl)cccC=O)NCC[C@@H]NC=O)[C@H]C[C@@H]F)C4))))))[C@H]F)C6)))))))c6Cl
|
[N][C][=C][Branch1][C][Cl][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][F][C][Ring1][Branch1][C@H1][Branch1][C][F][C][Ring1][#C][=C][Ring2][Ring1][Branch2][Cl]
|
Nc1c(Cl)ccc8c1Cl.N14CC[C@@H]6[C@H](F)C1.[C@H]17C[C@@H](F)C1.C48=O.C57=O.N56
|
Cc1cnc(CN2CCC(F)(F)[C@H](CNC(=O)CCn3ccccc3=O)C2)s1
|
CccncCNCCCF)F)[C@H]CNC=O)CCnccccc6=O))))))))))))C6)))))))s5
|
[C][C][=C][N][=C][Branch2][Ring2][Branch1][C][N][C][C][C][Branch1][C][F][Branch1][C][F][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][N][C][=C][C][=C][C][Ring1][=Branch1][=O][C][Ring2][Ring1][Branch1][S][Ring2][Ring1][O]
|
N15CCC(F)(F)[C@H]9C1.n17ccccc1=O.Cc1cnc8s1.C4(=O)CC7.C58.C69.N46
|
Cc1cc2c(NC(=O)c3cc[nH]c(=N)c3)cccc2cn1
|
CccccNC=O)ccc[nH]c=N)c6))))))))cccc6cn%10
|
[C][C][=C][C][=C][Branch1][P][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=Branch1][C][=N][C][=Ring1][#Branch1][C][=C][C][=C][Ring1][S][C][=N][Ring2][Ring1][Ring2]
|
Cc1cc2c5cccc2cn1.c16cc[nH]c(=N)c1.C46=O.N45
|
Cc1ccn2cc(C(=O)NCC[C@H]3C[C@@H](NC(=O)[C@@H]4C[C@@H]4CF)C3)nc2c1
|
CcccnccC=O)NCC[C@H]C[C@@H]NC=O)[C@@H]C[C@@H]3CF)))))))C4))))))))nc5c9
|
[C][C][C][=C][N][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C@H1][C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][F][C][Ring1][N][N][=C][Ring2][Ring1][=Branch1][C][=Ring2][Ring1][#Branch2]
|
Cc1ccn2cc9nc2c1.[C@H]1%11C[C@@H]8C1.[C@@H]1%10C[C@@H]1%12.C59=O.C7C%11.C6%10=O.N57.N68.C%12F
|
Cc1c(C(=O)N[C@H]2CCO[C@H](C)C2)sc2ccc(Cl)cc12
|
CccC=O)N[C@H]CCO[C@H]C)C6))))))))sccccCl)cc96
|
[C][C][=C][Branch1][P][C][=Branch1][C][=O][N][C@H1][C][C][O][C@H1][Branch1][C][C][C][Ring1][#Branch1][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring2][Ring1][Ring2][Ring1][#Branch1]
|
Cc1c5sc2ccc(Cl)cc12.[C@H]14CCO[C@H](C)C1.C35=O.N34
|
Cc1cncc(/C=C/C(=O)NCC2CN(C(=O)c3n[nH]c4nccc(Cl)c34)C2)c1
|
Cccncc/C=C/C=O)NCCCNC=O)cn[nH]cncccCl)c96))))))))))C4)))))))))c6
|
[C][C][=C][N][=C][C][Branch2][Ring2][=Branch1][/C][=C][/C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=N][NH1][C][=N][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch2][Ring1][#Branch1][C][Ring1][S][=C][Ring2][Ring1][N]
|
c18n[nH]c2nccc(Cl)c12.Cc1cncc(C=9)c1.C1%10CN6C1.C=9C5=O.C68=O.N57.C7%10
|
C=CC1(C(=O)NCC23CC(NC(=O)[C@H](C)n4ccc(C)n4)(C2)C3)CCC1
|
C=CCC=O)NCCCCNC=O)[C@H]C)ncccC)n5))))))))C4)C4)))))))CCC4
|
[C][=C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=C][C][Branch1][C][C][=N][Ring1][=Branch1][Branch1][Ring2][C][Ring1][#C][C][Ring1][S][C][C][C][Ring2][Ring1][Branch2]
|
C=CC19CCC1.C12%11CC8(C1)C2.n1%10ccc(C)n1.C6(=O)[C@@H]%10C.C59=O.N57.C7%11.N68
|
CC[C@H](C)N(CCO)C(=O)[C@@H](C)CN(C)C(=O)[C@H]1CCOC(C)(C)C1
|
CC[C@H]C)NCCO)))C=O)[C@@H]C)CNC)C=O)[C@H]CCOCC)C)C6
|
[C][C][C@H1][Branch1][C][C][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2]
|
[C@H]17CCOC(C)(C)C1.C2(=O)[C@@H](C)C6.CC[C@@H]4C.N245.C5CO.N36C.C37=O
|
COC1(C(=O)NC[C@H]2COC(C)(C)CN2C(=O)Cc2c(C)cc(C)cc2C)CC1
|
COCC=O)NC[C@H]COCC)C)CN6C=O)CccC)ccC)cc6C))))))))))))))))))CC3
|
[C][O][C][Branch2][Ring2][=Branch2][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][Branch1][C][C][C][=C][Branch1][C][C][C][=C][Ring1][Branch2][C][C][C][Ring2][Ring1][O]
|
[C@H]18COC(C)(C)CN14.c19c(C)cc(C)cc1C.C157CC1.C4(=O)C9.C37=O.CO5.N36.C68
|
CCC[C@@H]1C[C@H]1C(=O)NCC12CC(NC(=O)c3oc(Br)cc3C)(CO1)C2
|
CCC[C@@H]C[C@H]3C=O)NCCCCNC=O)cocBr)cc5C))))))))CO5))C4
|
[C][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][P][N][C][=Branch1][C][=O][C][O][C][Branch1][C][Br][=C][C][=Ring1][=Branch1][C][Branch1][Branch1][C][O][Ring1][#C][C][Ring1][S]
|
C12%10CC7(CO1)C2.c18oc(Br)cc1C.[C@@H]1%11C[C@H]19.CCC%11.C49=O.C58=O.N46.C6%10.N57
|
CCOc1ccc(N[C@H](c2nnnn2CCSC)[C@@](C)(CC)OC)cc1OCC
|
CCOccccN[C@H]cnnnn5CCSC)))))))))[C@@]C)CC))OC)))))cc6OCC
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C@H1][Branch1][N][C][=N][N][=N][N][Ring1][Branch1][C][C][S][C][C@@][Branch1][C][C][Branch1][Ring1][C][C][O][C][C][=C][Ring2][Ring1][#Branch1][O][C][C]
|
c17ccc%11cc18.[C@@H]94[C@@]5(C)CC.c14nnnn1%12.C%12C%10.CC3.O37.N9%11.S%10C.O5C.O68.C6C
|
CC[C@H](C(=O)N1CCO[C@H](CNC(=O)c2onc3c2CCCC3)C1)[C@H](C)O
|
CC[C@H]C=O)NCCO[C@H]CNC=O)concc5CCCC6))))))))))))C6)))))))[C@H]C)O
|
[C][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][O][N][=C][C][=Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C@H1][Branch1][C][C][O]
|
c17onc2c1CCCC2.CC[C@H](C4=O)[C@H](C)O.N14CCO[C@H]8C1.C57=O.C68.N56
|
COC(=O)N[C@@H](C)C(=O)N1C[C@H](NC(=O)[C@H]2CC(F)(F)CS2)CC(F)(F)C1
|
COC=O)N[C@@H]C)C=O)NC[C@H]NC=O)[C@H]CCF)F)CS5)))))))CCF)F)C6
|
[C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][Branch1][C][F][Branch1][C][F][C][S][Ring1][#Branch1][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][C]
|
N15C[C@H]8CC(F)(F)C1.[C@H]19CC(F)(F)CS1.[C@H]7(C)C5=O.C34=O.C69=O.CO3.N47.N68
|
N#Cc1cc(C(=O)N2CCN(C(=O)Cc3cn[nH]c3)[C@@H](c3cccnc3)C2)cs1
|
N#CcccC=O)NCCNC=O)Cccn[nH]c5)))))))[C@@H]ccccnc6))))))C6)))))))cs5
|
[N][#C][C][=C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=N][NH1][C][=Ring1][Branch1][C@@H1][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][=C][S][Ring2][Ring1][O]
|
N14CCN5[C@@H]8C1.N#Cc1cc6cs1.c18cccnc1.c17cn[nH]c1.C5(=O)C7.C46=O
|
C[C@H]1CCC[C@@H](CC(=O)NCCCNC(=O)C2(NC(N)=O)CCCCC2)C1
|
C[C@H]CCC[C@@H]CC=O)NCCCNC=O)CNCN)=O)))CCCCC6))))))))))))))C6
|
[C][C@H1][C][C][C][C@@H1][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][C][C][C][C][Ring1][#Branch2][C][Ring2][Ring1][#Branch2]
|
C[C@H]1CCC[C@@H]%10C1.C189CCCCC1.C%10C3=O.C6CC7.C49=O.C5(N)=O.N36.N47.N58
|
O=C(CN[C@H]1[C@H]2CC[C@H]3[C@@H](C2)C[C@H]31)Nc1ccc(Br)cc1Br
|
O=CCN[C@H][C@H]CC[C@H][C@@H]C6)C[C@H]48))))))))))NccccBr)cc6Br
|
[O][=C][Branch2][Ring1][Ring2][C][N][C@H1][C@H1][C][C][C@H1][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][C@H1][Ring1][Branch1][Ring1][=Branch2][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Br]
|
[C@H]17[C@H]2CC[C@H]3[C@@H](C2)C[C@@H]13.c16ccc(Br)cc1Br.O=C4C5.N57.N46
|
Cc1ncc(CCC(=O)N2CCC(N(C)C(=O)[C@@H]3CCC(=O)N3C3CC3)CC2)o1
|
CcnccCCC=O)NCCCNC)C=O)[C@@H]CCC=O)N5CCC3))))))))))CC6)))))))))o5
|
[C][C][=N][C][=C][Branch2][Ring2][#Branch2][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][Ring1][O][Ring2][Ring1][N]
|
N14CCC6CC1.[C@@H]17CCC(=O)N19.Cc1ncc8o1.C8CC4=O.N56C.C57=O.C19CC1
|
COCC[C@H](OC)C(=O)N[C@H](C)CCNC(=O)[C@H]1CC[C@H](N(C)C)CC1
|
COCC[C@H]OC))C=O)N[C@H]C)CCNC=O)[C@H]CC[C@H]NC)C))CC6
|
[C][O][C][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][C][Ring1][=Branch2]
|
C4C[C@H]5C2=O.[C@H]19CC[C@H]8CC1.[C@@H]6(C)CC7.C39=O.N8(C)C.CO4.O5C.N26.N37
|
Cc1ccc(NC(=O)C2(F)CCN(Cc3cc(O)ccc3O)CC2)c(C)n1
|
CccccNC=O)CF)CCNCcccO)ccc6O))))))))CC6))))))))cC)n6
|
[C][C][=C][C][=C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][Branch1][C][F][C][C][N][Branch1][=C][C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][O][C][C][Ring1][S][C][Branch1][C][C][=N][Ring2][Ring1][#Branch2]
|
Cc1ccc6c(C)n1.C17(F)CCN5CC1.c18cc(O)ccc1O.C47=O.N46.C58
|
C[C@H]1COC[C@H](CNC(=O)CCc2cnc(C3(C)CC3)o2)O1
|
C[C@H]COC[C@H]CNC=O)CCccncCC)CC3)))o5))))))))))O6
|
[C][C@H1][C][O][C][C@H1][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][C][C][=C][N][=C][Branch1][=Branch2][C][Branch1][C][C][C][C][Ring1][Ring2][O][Ring1][=Branch2][O][Ring2][Ring1][Branch1]
|
C[C@H]1COC[C@H]6O1.c17cnc8o1.C4(=O)CC7.C18(C)CC1.C56.N45
|
Cc1cnn(CC(=O)N2C[C@@H]3CCC[C@H](NC(=O)[C@H](C)OC4CCCC4)[C@H]3C2)c1
|
CccnnCC=O)NC[C@@H]CCC[C@H]NC=O)[C@H]C)OCCCCC5)))))))))[C@H]6C9)))))))))))c5
|
[C][C][C][=N][N][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][C][C][C][C][Ring1][Branch1][C@H1][Ring1][P][C][Ring2][Ring1][Ring2][C][=Ring2][Ring1][N]
|
N15C[C@@H]2CCC[C@H]9[C@H]2C1.Cc1cnn%10c1.C6(=O)[C@@H]7C.C18CCCC1.C%10C5=O.N69.O78
|
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