SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
Cc1nn(C)c(C(=O)N2C[C@H](C)CN(C(=O)c3ccc(C(N)=O)[nH]3)[C@H](C)C2)c1Cl
|
CcnnC)cC=O)NC[C@H]C)CNC=O)ccccCN)=O))[nH]5))))))[C@H]C)C7))))))))c5Cl
|
[C][C][=N][N][Branch1][C][C][C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][NH1][Ring1][Branch2][C@H1][Branch1][C][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][O][Cl]
|
N14C[C@H](C)CN5[C@H](C)C1.Cc1nn(C)c6c1Cl.c17ccc8[nH]1.C46=O.C57=O.C8(N)=O
|
C=CC[C@@H](C(=O)NC[C@@H]1CC2(CO1)CN(C(=O)c1nc(Cl)cs1)C2)C(C)C
|
C=CC[C@@H]C=O)NC[C@@H]CCCO5))CNC=O)cncCl)cs5))))))C4)))))))))CC)C
|
[C][=C][C][C@@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch1][Branch1][C][O][Ring1][Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=N][C][Branch1][C][Cl][=C][S][Ring1][=Branch1][C][Ring1][=C][C][Branch1][C][C][C]
|
C=CC[C@@H](C3=O)C(C)C.[C@@H]17CC2(CO1)CN4C2.c16nc(Cl)cs1.C46=O.N35.C57
|
COCCN(CCNC(=O)Cc1c(C)cccc1Cl)C(=O)c1cc[nH]n1
|
COCCNCCNC=O)CccC)cccc6Cl))))))))))))C=O)ccc[nH]n5
|
[C][O][C][C][N][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Branch1][C][=O][C][C][=C][NH1][N][=Ring1][Branch1]
|
c19c(C)cccc1Cl.c18cc[nH]n1.C2(=O)C9.C4C5.N356.C6C7.C38=O.CO4.N27
|
O=C(NC[C@@H]1CCN(C(=O)c2cncc(F)c2)C1)C1=NO[C@@H](CC2(O)COC2)C1
|
O=CNC[C@@H]CCNC=O)ccnccF)c6)))))))C5)))))))C=NO[C@@H]CCO)COC4)))))C5
|
[O][=C][Branch2][Ring1][O][N][C][C@@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring1][=C][C][=N][O][C@@H1][Branch1][O][C][C][Branch1][C][O][C][O][C][Ring1][Branch1][C][Ring1][O]
|
O=C3C1=NO[C@@H]7C1.c16cncc(F)c1.[C@@H]18CCN4C1.C19(O)COC1.C46=O.N35.C58.C79
|
O=C(Nc1ncc[nH]1)C(=O)N[C@@H]1C[C@@H]2C[C@H]1N(C(=O)[C@@H]1CCCSC1)C2
|
O=CNcncc[nH]5))))))C=O)N[C@@H]C[C@@H]C[C@H]5NC=O)[C@@H]CCCSC6)))))))C5
|
[O][=C][Branch1][=Branch2][N][C][=N][C][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][C][C@H1][Ring1][Branch1][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][C][C][S][C][Ring1][=Branch1][C][Ring1][=N]
|
[C@@H]17C[C@@H]2C[C@H]1N5C2.[C@@H]18CCCSC1.O=C3C4=O.c16ncc[nH]1.C58=O.N36.N47
|
CC1(C)C[C@@H](CNC(=O)Cn2ccnn2)N(C(=O)[C@H]2CCCC23CC3)C1
|
CCC)C[C@@H]CNC=O)Cnccnn5)))))))))NC=O)[C@H]CCCC5CC3))))))))C5
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][N][C][=C][N][=N][Ring1][Branch1][N][Branch1][S][C][=Branch1][C][=O][C@H1][C][C][C][C][Ring1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][=Branch2]
|
CC1(C)C[C@@H]9N5C1.[C@H]17CCCC12CC2.n18ccnn1.C4(=O)C8.C57=O.C69.N46
|
COc1cc(O)ncc1C(=O)NCC1CC(NC(=O)c2nccc(OC)c2F)C1
|
COcccO)ncc6C=O)NCCCCNC=O)cncccOC))c6F)))))))))C4
|
[C][O][C][=C][C][Branch1][C][O][=N][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][F][C][Ring1][S]
|
c15cc(O)ncc1%10.c19nccc6c1F.C1%11CC8C1.C3%10=O.C49=O.CO5.N37.C7%11.N48.O6C
|
COc1ccc([N+](=O)[O-])cc1N[C@H](c1cc(I)cs1)c1nnnn1C1CC1
|
COcccc[N+]=O)[O-]))cc6N[C@H]cccI)cs5)))))cnnnn5CCC3
|
[C][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][N][C@H1][Branch1][O][C][=C][C][Branch1][C][I][=C][S][Ring1][=Branch1][C][=N][N][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
c12ccc([N+](=O)[O-])cc14.c15cc(I)cs1.c16nnnn17.[C@@H]356.C17CC1.CO2.N34
|
Nc1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3cc4sccc4[nH]3)C2)nc2ccccc12
|
NcccC=O)N[C@H]C[C@H]NC=O)cccsccc5[nH]8))))))))))C4))))))ncccccc%106
|
[N][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][S][C][=C][C][=Ring1][Branch1][NH1][Ring1][Branch2][C][Ring1][#C][=N][C][=C][C][=C][C][=C][Ring2][Ring1][N][Ring1][=Branch1]
|
Nc1cc9nc2ccccc12.c1%10cc2sccc2[nH]1.[C@H]17C[C@H]8C1.C59=O.C6%10=O.N57.N68
|
CC(C)CCC(=O)NCCC(=O)NC[C@H]1CCCCN1C(=O)[C@H]1CCC1(C)C
|
CCC)CCC=O)NCCC=O)NC[C@H]CCCCN6C=O)[C@H]CCC4C)C
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C][C][Ring1][Ring2][Branch1][C][C][C]
|
CC(C)CCC2=O.[C@H]18CCCCN14.[C@H]17CCC1(C)C.C5CC3=O.C47=O.N25.N36.C68
|
CC(C)(CNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)c1c[nH]ccc1=O)C(F)(F)F
|
CCC)CNC=O)[C@H]Cccnc[nH]5))))))NC=O)cc[nH]ccc6=O)))))))))))))CF)F)F
|
[C][C][Branch1][C][C][Branch2][Ring1][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][Ring1][=Branch1][=O][C][Branch1][C][F][Branch1][C][F][F]
|
CC(C)(C4)C(F)(F)F.c16c[nH]ccc1=O.C2(=O)[C@@H]5C7.c17cnc[nH]1.C36=O.N24.N35
|
C[C@@H](CO)C(=O)N1CCC(CCN(C)C(=O)c2cn3ccc(CO)cc3n2)CC1
|
C[C@@H]CO))C=O)NCCCCCNC)C=O)ccncccCO))cc6n9)))))))))))))CC6
|
[C][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][C][=C][C][Branch1][Ring1][C][O][=C][C][Ring1][Branch2][=N][Ring1][O][C][C][Ring2][Ring1][#Branch1]
|
c17cn2ccc9cc2n1.N14CCC8CC1.C[C@@H](CO)C4=O.C8C6.N56C.C57=O.C9O
|
C[C@H](O)[C@@H](C(=O)NC[C@@]1(NC(=O)c2cnn3c(N)ccnc23)CCOC1)N(C)C
|
C[C@H]O)[C@@H]C=O)NC[C@@]NC=O)ccnncN)ccnc96)))))))))))CCOC5))))))))NC)C
|
[C][C@H1][Branch1][C][O][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=N][N][C][Branch1][C][N][=C][C][=N][C][=Ring1][#Branch2][Ring1][#Branch1][C][C][O][C][Ring2][Ring1][C][N][Branch1][C][C][C]
|
c19cnn2c(N)ccnc12.C[C@H](O)[C@H]6C4=O.[C@@]18%10CCOC1.C59=O.N6(C)C.N47.C7%10.N58
|
CCC(C)(C)C1CCC(CC(=O)N[C@H]2C[C@@H](NC(=O)[C@@H]3COC(=O)N3C)C2)CC1
|
CCCC)C)CCCCCC=O)N[C@H]C[C@@H]NC=O)[C@@H]COC=O)N5C))))))))C4)))))))CC6
|
[C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][Ring1][=C][C][C][Ring2][Ring1][Branch2]
|
C19CCC%10CC1.[C@@H]18COC(=O)N1C.CCC9(C)C.[C@H]16C[C@@H]7C1.C%10C4=O.C58=O.N46.N57
|
C[C@@H](CNC(=O)/C(F)=C/CCF)CN(C)C(=O)[C@@H]1COCC(C)(C)O1
|
C[C@@H]CNC=O)/CF)=C/CCF))))))))CNC)C=O)[C@@H]COCCC)C)O6
|
[C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][/C][Branch1][C][F][=C][/C][C][F][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][O][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][Branch2]
|
[C@@H]16COCC(C)(C)O1.C[C@@H](C4)C5.C2(=O)C=7F.C=7CCF.N35C.C36=O.N24
|
CNC(=O)C(C)(C)C(=O)N1CC[C@H](NC(=O)c2cnc3ncnn3c2O)[C@H](C)C1
|
CNC=O)CC)C)C=O)NCC[C@H]NC=O)ccncncnn5c9O))))))))))))[C@H]C)C6
|
[C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][=N][C][=N][C][=N][N][Ring1][Branch1][C][=Ring1][=Branch2][O][C@H1][Branch1][C][C][C][Ring2][Ring1][Ring2]
|
c18cnc2ncnn2c1O.C4(=O)C(C)(C)C5=O.N15CC[C@H]7[C@H](C)C1.C68=O.CN4.N67
|
CCC1(NC(=O)C(=O)c2cccn2C)CCN(C(=O)C2CC(CC3CC3)C2)CC1
|
CCCNC=O)C=O)ccccn5C)))))))))CCNC=O)CCCCCCC3))))C4)))))CC6
|
[C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][Branch2][C][C][Ring2][Ring1][O]
|
C169CCN5CC1.c17cccn1C.C4(=O)C7=O.C18CC%10C1.C58=O.C1%11CC1.CC9.N46.C%10%11
|
C[C@H](CCNC(=O)C(=O)c1cnn(C(C)(C)C)c1)NC(=O)C[C@H]1CCOC1
|
C[C@H]CCNC=O)C=O)ccnnCC)C)C))c5))))))))))NC=O)C[C@H]CCOC5
|
[C][C@H1][Branch2][Ring1][=N][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][=Branch2][N][C][=Branch1][C][=O][C][C@H1][C][C][O][C][Ring1][Branch1]
|
c16cnn7c1.C[C@@H]4CC5.C2(=O)C6=O.[C@H]18CCOC1.C7(C)(C)C.C3(=O)C8.N25.N34
|
CCCSCC(=O)N1[C@@H]2CC[C@H]1[C@@H]1C[C@]1(NC(=O)Cc1sccc1C)C2
|
CCCSCC=O)N[C@@H]CC[C@H]5[C@@H]C[C@]3NC=O)Ccsccc5C)))))))))C8
|
[C][C][C][S][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C@@H1][C][C@][Ring1][Ring1][Branch1][#C][N][C][=Branch1][C][=O][C][C][S][C][=C][C][=Ring1][Branch1][C][C][Ring2][Ring1][C]
|
N13[C@@H]2CC[C@H]1[C@@H]1C[C@]17C2.c18sccc1C.C6C3=O.C4(=O)C8.CCC5.S56.N47
|
CC[C@@H]1C[C@H](C(=O)N(C)CCC(=O)NC2CC2)CCN1C(=O)C1CC(CF)C1
|
CC[C@@H]C[C@H]C=O)NC)CCC=O)NCCC3)))))))))CCN6C=O)CCCCF))C4
|
[C][C][C@@H1][C][C@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C][C][C][Branch1][Ring1][C][F][C][Ring1][=Branch1]
|
[C@@H]1%10C[C@H]8CCN15.C6CC4=O.C19CC%11C1.C38=O.N36C.C17CC1.C59=O.CC%10.N47.C%11F
|
CSc1cccc(F)c1C(=O)NC[C@]1(NC(=O)CCF)C[C@H]2CC[C@H]1C2
|
CScccccF)c6C=O)NC[C@]NC=O)CCF)))))C[C@H]CC[C@H]6C5
|
[C][S][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][=Branch2][N][C][=Branch1][C][=O][C][C][F][C][C@H1][C][C][C@H1][Ring1][N][C][Ring1][Branch1]
|
c19cccc(F)c17.[C@]168C[C@H]2CC[C@H]1C2.C4(=O)CCF.C37=O.CS9.N35.C58.N46
|
CCCC[C@@H](CC)C(=O)N(C)C1CC(NC(=O)c2ccncc2C2CC2)C1
|
CCCC[C@@H]CC))C=O)NC)CCCNC=O)cccncc6CCC3)))))))))))C4
|
[C][C][C][C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][S]
|
CCCC[C@@H](CC)C3=O.c17ccncc18.C15CC6C1.N35C.C47=O.C18CC1.N46
|
Cc1[nH]c2ccccc2c1CC(=O)N(C)CC(C)(C)NC(=O)[C@H]1CC[C@@H](C)C1
|
Cc[nH]cccccc6c9CC=O)NC)CCC)C)NC=O)[C@H]CC[C@@H]C)C5
|
[C][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C@@H1][Branch1][C][C][C][Ring1][=Branch1]
|
Cc1[nH]c2ccccc2c18.[C@H]17CC[C@@H](C)C1.C5C6(C)C.C8C3=O.N35C.C47=O.N46
|
Cc1cc[nH]c1C(=O)N[C@]12C[C@H]1CN(C(=O)c1ccnc3c(Cl)c(C)ccc13)C2
|
Cccc[nH]c5C=O)N[C@]C[C@H]3CNC=O)cccnccCl)cC)ccc%106)))))))))))C6
|
[C][C][C][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@][C][C@H1][Ring1][Ring1][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Branch1][C][Cl][C][Branch1][C][C][=C][C][=C][Ring1][N][Ring1][Branch2][C][Ring2][Ring1][Ring2]
|
c18ccnc2c(Cl)c(C)ccc12.[C@]126C[C@H]1CN5C2.Cc1cc[nH]c17.C47=O.C58=O.N46
|
CCOCCn1cc(C(=O)N[C@@H]2C[C@@H]2NC(=O)CN(C)[C@@H]2CCSC2)cn1
|
CCOCCnccC=O)N[C@@H]C[C@@H]3NC=O)CNC)[C@@H]CCSC5))))))))))))))cn5
|
[C][C][O][C][C][N][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C@@H1][C][C][S][C][Ring1][Branch1][C][=N][Ring2][Ring1][=Branch1]
|
n14cc%12cn1.[C@@H]1%11CCSC1.[C@@H]19C[C@@H]1%10.C5(=O)C8.C7C4.C3%12=O.N8%11C.CC6.O67.N39.N5%10
|
Cc1nc(CNC(=O)C2(O)CC2)oc1C(=O)Nc1ccsc1C
|
CcncCNC=O)CO)CC3))))))oc5C=O)Ncccsc5C
|
[C][C][N][=C][Branch1][#C][C][N][C][=Branch1][C][=O][C][Branch1][C][O][C][C][Ring1][Ring2][O][C][=Ring1][=N][C][=Branch1][C][=O][N][C][C][=C][S][C][=Ring1][Branch1][C]
|
Cc1nc9oc17.c16ccsc1C.C18(O)CC1.C38=O.C47=O.C59.N35.N46
|
COc1ccc(C(=O)N2CCCCC23CC(O)C3)c(C)n1
|
COccccC=O)NCCCCC6CCO)C4))))))))))cC)n6
|
[C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][C][Branch1][C][O][C][Ring1][Branch1][C][Branch1][C][C][=N][Ring2][Ring1][Ring1]
|
N14CCCCC12CC(O)C2.c15ccc6c(C)n1.C46=O.CO5
|
CCCCC[C@](C)(CC)C(=O)NC[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)c1cncnc1
|
CCCCC[C@]C)CC))C=O)NC[C@@H]C[C@@H]C[C@@H]3N6C=O)ccncnc6
|
[C][C][C][C][C][C@][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][N][=C][Ring1][=Branch1]
|
CCCCC[C@](C)(CC)C3=O.[C@@H]17C[C@@H]2C[C@@H]2N14.c16cncnc1.C46=O.N35.C57
|
COCCC(F)(F)CN1C[C@H](c2ccccc2)c2ccccc21
|
COCCCF)F)CNC[C@H]cccccc6))))))cccccc69
|
[C][O][C][C][C][Branch1][C][F][Branch1][C][F][C][N][C][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C]
|
N14C[C@H](c2ccccc2)c2ccccc21.C3CC(F)(F)C4.CO3
|
CO[C@H]1CCC12CC(C(=O)N1C[C@H]3C[C@H]1CN(C(=O)c1c(Cl)ccnc1C)C3)C2
|
CO[C@H]CCC4CCC=O)NC[C@H]C[C@H]5CNC=O)ccCl)ccnc6C))))))))C6)))))))))C4
|
[C][O][C@H1][C][C][C][Ring1][Ring2][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=C][N][=C][Ring1][#Branch1][C][C][Ring1][S][C][Ring2][Ring1][Branch2]
|
N14C[C@H]2C[C@H]1CN5C2.[C@H]16CCC12CC7C2.c18c(Cl)ccnc1C.C47=O.C58=O.CO6
|
CCc1c(Cl)nc[nH]c1=NC[C@@H]1CN(C(=O)[C@@H](C)C2CC2)CC12CCOCC2
|
CCccCl)nc[nH]c6=NC[C@@H]CNC=O)[C@@H]C)CCC3)))))CC5CCOCC6
|
[C][C][C][=C][Branch1][C][Cl][N][=C][NH1][C][Ring1][#Branch1][=N][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][C][Ring1][Ring1][C][C][Ring1][N][C][C][O][C][C][Ring1][=Branch1]
|
[C@@H]14CN3CC12CCOCC2.c16c(Cl)nc[nH]c1=NC4.C3(=O)[C@H]5C.C15CC1.CC6
|
CSc1ccccc1C(=O)N(C)CCCCCCNC(=O)c1sccc1C(F)F
|
CScccccc6C=O)NC)CCCCCCNC=O)csccc5CF)F
|
[C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][C][Branch1][C][F][F]
|
c19ccccc17.C4CCCCC5.c16sccc18.C27=O.N24C.C36=O.C8(F)F.CS9.N35
|
CC#CCCC(=O)N1CC[C@@H]2CN(C(=O)c3ocnc3CCC)C[C@@H]2C1
|
CC#CCCC=O)NCC[C@@H]CNC=O)cocnc5CCC)))))))))C[C@@H]5C9
|
[C][C][#C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][=N][C][=Ring1][Branch1][C][C][C][C][C@@H1][Ring1][#C][C][Ring2][Ring1][Ring1]
|
N14CC[C@@H]2CN5C[C@@H]2C1.CC#CCCC4=O.c16ocnc17.C56=O.C7CC
|
CCOC(=O)[C@@H](OC)C(=O)N1C[C@H](O)CC[C@H](NC(=O)Cc2ccc(F)cc2)C1
|
CCOC=O)[C@@H]OC))C=O)NC[C@H]O)CC[C@H]NC=O)CccccF)cc6)))))))))C7
|
[C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
N14C[C@@H]8CC[C@@H](O)C1.C3(=O)[C@@H]7C4=O.c19ccc(F)cc1.C5(=O)C9.CC6.O36.O7C.N58
|
COC[C@@]1(C(=O)N2CC[C@@](NC(=O)c3ccsc3)(C3CC3)C2)C=CCC1
|
COC[C@@]C=O)NCC[C@@]NC=O)cccsc5)))))))CCC3)))C5))))))C=CCC5
|
[C][O][C][C@@][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C@@][Branch1][=N][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][S][C][=C][C][C][Ring2][Ring1][#Branch1]
|
N14CC[C@@]7(C2CC2)C1.[C@@]18%10C=CCC1.c19ccsc1.C48=O.C59=O.CO6.C6%10.N57
|
CC[C@@H]1CN(CCNC(=NC)NCCSCc2ccccc2F)CCO1
|
CC[C@@H]CNCCNC=NC))NCCSCcccccc6F))))))))))))))))CCO6
|
[C][C][C@@H1][C][N][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][Ring1][=N][C][N][C][C][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][O][Ring2][Ring1][Branch2]
|
[C@@H]18CN3CCO1.c19ccccc1F.N4C(=NC)N5.C3C4.C5C6.CC8.S67.C79
|
Cc1cccc(C)c1C(=O)NC[C@](C)(O)CNC(=O)C1(C)CC1
|
CcccccC)c6C=O)NC[C@]C)O)CNC=O)CC)CC3
|
[C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][C][O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][Ring1][Ring2]
|
Cc1cccc(C)c17.C4[C@](C)(O)C5.C16(C)CC1.C27=O.C36=O.N24.N35
|
C#CC[C@@H](O)C(=O)NCCCC[C@@H](C)NC(=O)c1cn(C)nc1C(F)F
|
C#CC[C@@H]O)C=O)NCCCC[C@@H]C)NC=O)ccnC)nc5CF)F
|
[C][#C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][C][Branch1][C][F][F]
|
C#CC[C@@H](O)C2=O.C4CCC[C@H]5C.c16cn(C)nc17.C36=O.C7(F)F.N24.N35
|
CN(C)C(=O)C=CC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)c1ncn(C(C)(C)C)n1
|
CNC)C=O)C=CC=O)NC[C@@H]CCCC[C@@H]6NC=O)cncnCC)C)C))n5
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][=C][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][N][=Ring1][=Branch2]
|
[C@@H]1%10CCCC[C@@H]16.c17ncn9n1.C2(=O)C=8.C=8C3=O.C9(C)(C)C.CN2C.C47=O.N35.C5%10.N46
|
CCC[C@H](CN=c1[nH]c(C)cc(=NCc2cc(C(F)(F)F)cs2)[nH]1)OC
|
CCC[C@H]CN=c[nH]cC)cc=NCcccCF)F)F))cs5)))))))[nH]6))))))))OC
|
[C][C][C][C@H1][Branch2][Ring2][Branch1][C][N][=C][NH1][C][Branch1][C][C][=C][C][=Branch2][Ring1][Ring2][=N][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][S][Ring1][=Branch2][NH1][Ring2][Ring1][C][O][C]
|
CCC[C@@H]3CN=c1[nH]c(C)cc(=NC4)[nH]1.c14cc5cs1.C5(F)(F)F.O3C
|
CCSCc1ccccc1C(=O)N1C[C@H](NC(=O)c2cc(CC)c[nH]2)[C@H]2C[C@@H]21
|
CCSCcccccc6C=O)NC[C@H]NC=O)cccCC))c[nH]5)))))))[C@H]C[C@@H]36
|
[C][C][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][C][=C][NH1][Ring1][#Branch1][C@H1][C][C@@H1][Ring1][Ring1][Ring1][S]
|
c1%10ccccc19.N13C[C@H]7[C@H]2C[C@@H]21.c18cc%11c[nH]1.C39=O.C48=O.CC5.S56.C6%10.N47.C%11C
|
CC(C)CC1(C(=O)NC2CN(C(=O)c3ccc([C@H]4CCCOC4)cc3)C2)CC1
|
CCC)CCC=O)NCCNC=O)cccc[C@H]CCCOC6))))))cc6)))))))C4))))))CC3
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C@H1][C][C][C][O][C][Ring1][=Branch1][C][=C][Ring1][N][C][Ring2][Ring1][C][C][C][Ring2][Ring1][Branch2]
|
c19ccc%11cc1.[C@H]1%11CCCOC1.C17CN6C1.CC(C)C%10.C18%10CC1.C58=O.C69=O.N57
|
C[C@@H]1OCC[C@@]1(C)C(=O)N1CC2(CC(NC(=O)c3cnc4sccc4c3)C2)C1
|
C[C@@H]OCC[C@@]5C)C=O)NCCCCNC=O)ccncsccc5c9)))))))))))C4)))C4
|
[C][C@@H1][O][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][N][=C][S][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring1][S][C][Ring2][Ring1][Ring1]
|
c19cnc2sccc2c1.N15CC2(CC7C2)C1.C[C@@H]1OCC[C@]18C.C58=O.C69=O.N67
|
CC[C@H](C)CC(=O)NC[C@H]1CCCC[C@@H]1Nc1ncc(I)cn1
|
CC[C@H]C)CC=O)NC[C@H]CCCC[C@@H]6NcnccI)cn6
|
[C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=N][C][=C][Branch1][C][I][C][=N][Ring1][#Branch1]
|
CC[C@H](C)CC2=O.[C@H]16CCCC[C@@H]15.c14ncc(I)cn1.N23.C36.N45
|
CCCN(CCC)CCNC(=O)[C@@H]1CSCN1C(=O)C[C@@H]1OCCC1(C)C
|
CCCNCCC)))CCNC=O)[C@@H]CSCN5C=O)C[C@@H]OCCC5C)C
|
[C][C][C][N][Branch1][Ring2][C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][S][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@@H1][O][C][C][C][Ring1][Branch1][Branch1][C][C][C]
|
[C@@H]19OCCC1(C)C.[C@@H]18CSCN13.C3(=O)C9.CCC4.N456.C5CC.C6C7.C28=O.N27
|
COc1c(Cl)cccc1[C@H](NCCOc1c(C)cc(Cl)cc1C)c1nnnn1C
|
COccCl)cccc6[C@H]NCCOccC)ccCl)cc6C)))))))))))cnnnn5C
|
[C][O][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][C@H1][Branch2][Ring1][Ring2][N][C][C][O][C][=C][Branch1][C][C][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][C][C][=N][N][=N][N][Ring1][Branch1][C]
|
c14c(C)cc(Cl)cc1C.c13c8cccc1Cl.c17nnnn1C.[C@@H]578.C6C2.CO3.N56.O24
|
COCCS(=O)(=O)CC(=O)NC[C@H]1CCCN1C(=O)c1nc[nH]c1C(F)(F)F
|
COCCS=O)=O)CC=O)NC[C@H]CCCN5C=O)cnc[nH]c5CF)F)F
|
[C][O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][=C][NH1][C][=Ring1][Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
C4CS(=O)(=O)CC2=O.[C@H]17CCCN13.c16nc[nH]c18.C8(F)(F)F.C36=O.CO4.N25.C57
|
CO[C@@H](CC(C)C)C(=O)N1C[C@H](C(=O)NOC2CCCCC2)CC1(C)C
|
CO[C@@H]CCC)C)))C=O)NC[C@H]C=O)NOCCCCCC6)))))))))CC5C)C
|
[C][O][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][#C][C][=Branch1][C][=O][N][O][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][#C][Branch1][C][C][C]
|
[C@H]4(CC(C)C)C3=O.N13C[C@H]6CC1(C)C.C15CCCCC1.C6(=O)NO5.CO4
|
CC1(NC(=O)CN2CCOCC2=O)CN(C(=O)c2sccc2C(F)F)C1
|
CCNC=O)CNCCOCC6=O))))))))))CNC=O)csccc5CF)F))))))))C4
|
[C][C][Branch1][S][N][C][=Branch1][C][=O][C][N][C][C][O][C][C][Ring1][=Branch1][=O][C][N][Branch1][P][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][C][Branch1][C][F][F][C][Ring2][Ring1][=Branch2]
|
N17CCOCC1=O.CC15CN4C1.c16sccc18.C3(=O)C7.C46=O.C8(F)F.N35
|
O=C(C=CC1CC1)N[C@H]1C[C@@H](CNC(=O)c2ccc(-n3cccc3)c(F)c2)C1
|
O=CC=CCCC3)))))N[C@H]C[C@@H]CNC=O)cccc-ncccc5)))))cF)c6)))))))))C4
|
[O][=C][Branch1][Branch2][C][=C][C][C][C][Ring1][Ring1][N][C@H1][C][C@@H1][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][=C][C][=C][Ring1][Branch1][C][Branch1][C][F][=C][Ring1][N][C][Ring2][Ring1][Ring2]
|
c18ccc%11c(F)c1.[C@H]17C[C@@H]%10C1.n1%11cccc1.O=C4C=9.C=9C1CC1.C58=O.N47.C6%10.N56
|
CSCC[C@@H](NC(=O)CCC(=O)NN(C)C)C(=O)N[C@H](C)c1nnc(C)o1
|
CSCC[C@@H]NC=O)CCC=O)NNC)C))))))))C=O)N[C@H]C)cnncC)o5
|
[C][S][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=N][N][=C][Branch1][C][C][O][Ring1][=Branch1]
|
C2(=O)CCC(=O)NN(C)C.C6C[C@@H]4C3=O.c17nnc(C)o1.[C@H]57C.CS6.N24.N35
|
O=C(CC[C@H]1CCCCN(C(=O)C2COCOC2)C1)N[C@H]1CCCNC1=O
|
O=CCC[C@H]CCCCNC=O)CCOCOC6)))))))C7)))))))))N[C@H]CCCNC6=O
|
[O][=C][Branch2][Ring1][#Branch2][C][C][C@H1][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][O][C][O][C][Ring1][=Branch1][C][Ring1][#C][N][C@H1][C][C][C][N][C][Ring1][=Branch1][=O]
|
[C@H]17CCCCN4C1.[C@H]15CCCNC1=O.C16COCOC1.O=C3CC7.C46=O.N35
|
O=C(CCc1ccco1)N1CC2(CO)CC1(C(=O)N1CCC[C@@H]1C1CC1)C2
|
O=CCCcccco5)))))))NCCCO))CC5C=O)NCCC[C@@H]5CCC3)))))))))C4
|
[O][=C][Branch1][#Branch2][C][C][C][=C][C][=C][O][Ring1][Branch1][N][C][C][Branch1][Ring1][C][O][C][C][Ring1][#Branch1][Branch1][P][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring1][S]
|
N13CC27CC15C2.N14CCC[C@@H]18.O=C3CC6.c16ccco1.C45=O.C18CC1.C7O
|
CCCN(CCNC(=O)c1ccnn1CC)C(=O)CCn1cc([N+](=O)[O-])cn1
|
CCCNCCNC=O)cccnn5CC)))))))))))C=O)CCncc[N+]=O)[O-]))cn5
|
[C][C][C][N][Branch1][P][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=N][Ring1][Branch2]
|
n19cc([N+](=O)[O-])cn1.c17ccnn18.C3(=O)CC9.CCC4.N345.C5C6.C27=O.N26.C8C
|
CC1CCC(C(=O)N(C)C2(C(=O)NC3CC4(C3)CC43CCC3)CC2)CC1
|
CCCCCC=O)NC)CC=O)NCCCC4)CC3CCC4))))))))))CC3)))))CC6
|
[C][C][C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Ring1][Ring2][C][C][C][Ring1][Ring2][C][C][Ring1][#C][C][C][Ring2][Ring1][=Branch2]
|
C18CC2(C1)CC21CCC1.CC1CCC9CC1.C17%10CC1.C59=O.N57C.C6%10=O.N68
|
CSCC[C@@H](NC(=O)C[C@H]1CCCC12CC2)C(=O)N1C[C@H]2CCO[C@H]2C1
|
CSCC[C@@H]NC=O)C[C@H]CCCC5CC3))))))))))C=O)NC[C@H]CCO[C@H]5C8
|
[C][S][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][C][Ring1][Branch1][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C][O][C@H1][Ring1][Branch1][C][Ring1][Branch2]
|
N14C[C@H]2CCO[C@H]2C1.C6C[C@@H]5C4=O.[C@H]17CCCC12CC2.C3(=O)C7.CS6.N35
|
CCOCC(C)(C)C(=O)N1CC[C@@H](C2CCN(C(=O)c3[nH]ccc3CC)CC2)C1
|
CCOCCC)C)C=O)NCC[C@@H]CCCNC=O)c[nH]ccc5CC))))))))CC6))))))C5
|
[C][C][O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch2][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][NH1][C][=C][C][=Ring1][Branch1][C][C][C][C][Ring1][#C][C][Ring2][Ring1][Ring2]
|
N14CC[C@@H](C2CCN5CC2)C1.C7C(C)(C)C4=O.c18[nH]ccc19.C58=O.CC6.O67.C9C
|
CC(C)[C@H](CN(C)C)C(=O)N1CC[C@@](C(=O)NC[C@@H](O)CC(F)(F)F)(C(C)C)C1
|
CCC)[C@H]CNC)C)))C=O)NCC[C@@]C=O)NC[C@@H]O)CCF)F)F)))))))CC)C))C5
|
[C][C][Branch1][C][C][C@H1][Branch1][#Branch1][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C][Branch1][C][F][Branch1][C][F][F][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1]
|
CC(C)[C@H](C4)C2=O.C5[C@@H](O)CC(F)(F)F.N12CC[C@@]67C1.N4(C)C.C36=O.C7(C)C.N35
|
COC1(CCNC(=O)c2cncn2C(C)C)CN(C(=O)c2coc(Cl)n2)C1
|
COCCCNC=O)ccncn5CC)C)))))))))))CNC=O)ccocCl)n5))))))C4
|
[C][O][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][Branch1][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][Cl][=N][Ring1][=Branch1][C][Ring2][Ring1][=Branch2]
|
C15%10CN4C1.c17cncn19.c18coc(Cl)n1.C%10C6.C37=O.C9(C)C.C48=O.CO5.N36
|
C/C=C(\C)C(=O)NCC[C@@H]1CN(C(=O)C(CC)(CC)CC)C[C@H]1C
|
C/C=C\C)C=O)NCC[C@@H]CNC=O)CCC))CC))CC))))C[C@H]5C
|
[C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][C][C][C@H1][Ring1][=C][C]
|
C3(=O)C(CC)(CC)CC.[C@@H]16CN3C[C@H]1C.C=5(C)C2=O.C4C6.CC=5.N24
|
N#Cc1ncc(C(=O)N2CC[C@@H]3CN(C(=O)CC[C@H]4CCOC4)C[C@@H]3C2)s1
|
N#CcnccC=O)NCC[C@@H]CNC=O)CC[C@H]CCOC5))))))))C[C@@H]5C9))))))))))s5
|
[N][#C][C][=N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C@H1][C][C][O][C][Ring1][Branch1][C][C@@H1][Ring1][=C][C][Ring2][Ring1][C][S][Ring2][Ring1][=Branch2]
|
N15CC[C@@H]2CN6C[C@@H]2C1.N#Cc1ncc7s1.C6(=O)CC8.[C@H]18CCOC1.C57=O
|
C=CCSc1ccccc1C(=O)N[C@@H]1C[C@@H]1NC(=O)C(F)(F)c1ccccc1C
|
C=CCScccccc6C=O)N[C@@H]C[C@@H]3NC=O)CF)F)cccccc6C
|
[C][=C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C]
|
c19ccccc17.c18ccccc1C.C3(=O)C8(F)F.[C@@H]15C[C@@H]16.C=CC4.C27=O.S49.N25.N36
|
C=C[C@H](C)NC(=NC[C@@H]1C[C@H]1C(F)(F)F)N1CCN(c2ccc(F)cc2)CC1
|
C=C[C@H]C)NC=NC[C@@H]C[C@H]3CF)F)F)))))))NCCNccccF)cc6))))))CC6
|
[C][=C][C@H1][Branch1][C][C][N][C][=Branch1][S][=N][C][C@@H1][C][C@H1][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F][N][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=N]
|
N3C(=NC5)N1CCN4CC1.c14ccc(F)cc1.C=C[C@@H]3C.[C@@H]15C[C@H]16.C6(F)(F)F
|
CC(C)CN(CC(=O)N1CC[C@@H](C)[C@@H]1C)C(=O)c1cccc(CO)n1
|
CCC)CNCC=O)NCC[C@@H]C)[C@@H]5C))))))))C=O)cccccCO))n6
|
[C][C][Branch1][C][C][C][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C@@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][O][=N][Ring1][Branch2]
|
N12CC[C@@H](C)[C@@H]1C.c16cccc7n1.CC(C)C4.C5C2=O.N345.C36=O.C7O
|
CC(C)(NC(=O)c1cscn1)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H](C3CC3)O2)C1
|
CCC)NC=O)ccscn5)))))))[C@@H]CCNC=O)[C@H]CCC[C@@H]CCC3)))O6)))))))C5
|
[C][C][Branch1][C][C][Branch1][=N][N][C][=Branch1][C][=O][C][=C][S][C][=N][Ring1][Branch1][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][=Branch2][C][Ring1][S]
|
[C@H]17CCC[C@@H]%10O1.[C@@H]19CCN5C1.c18cscn1.CC69C.C48=O.C57=O.C1%10CC1.N46
|
C[C@H]1C[C@H](NC(=O)C(F)(F)C2(O)CCCC2)CN1C(=O)c1cc(Cl)cs1
|
C[C@H]C[C@H]NC=O)CF)F)CO)CCCC5))))))))CN5C=O)cccCl)cs5
|
[C][C@H1][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][O][C][C][C][C][Ring1][=Branch1][C][N][Ring1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][S][Ring1][=Branch1]
|
C[C@H]1C[C@H]5CN14.C3(=O)C7(F)F.C17(O)CCCC1.c16cc(Cl)cs1.C46=O.N35
|
C#C[C@]1(O)C[C@@H](C(=O)N[C@@H]2CCN(C3CCN(C(=O)c4cnn(C)c4)CC3)C2)C1
|
C#C[C@]O)C[C@@H]C=O)N[C@@H]CCNCCCNC=O)ccnnC)c5))))))CC6))))))C5)))))))C4
|
[C][#C][C@][Branch1][C][O][C][C@@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][=Branch2][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][Ring1][=C][C][Ring2][Ring1][Ring1][C][Ring2][Ring1][O]
|
C#C[C@]1(O)C[C@@H]9C1.C18CCN6CC1.[C@@H]17CCN8C1.c1%10cnn(C)c1.C59=O.C6%10=O.N57
|
COC(=O)CCCC(=O)CNC(=O)CCc1cccc(Br)c1
|
COC=O)CCCC=O)CNC=O)CCcccccBr)c6
|
[C][O][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1]
|
C2(=O)CCCC(=O)C4.c15cccc(Br)c1.C3(=O)CC5.CO2.N34
|
CCCCC(=O)NC[C@H]1CN(C(=O)CCc2cncc(O)c2)C[C@H](C(F)(F)F)O1
|
CCCCC=O)NC[C@H]CNC=O)CCccnccO)c6)))))))))C[C@H]CF)F)F))O6
|
[C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][=C][N][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][C@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][O][Ring2][Ring1][Branch1]
|
[C@H]16CN4C[C@H]7O1.c18cncc(O)c1.CCCCC3=O.C4(=O)CC8.C7(F)(F)F.N35.C56
|
CO[C@H](F)C(=O)NCC[C@H](C)CCNC(=O)CCN1CCC(C)CC1
|
CO[C@H]F)C=O)NCC[C@H]C)CCNC=O)CCNCCCC)CC6
|
[C][O][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][N][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1]
|
C5C[C@H](C)CC6.N17CCC(C)CC1.[C@@H]4(F)C2=O.C3(=O)CC7.CO4.N25.N36
|
CO[C@@H](C(=O)NCC1(F)CCN(C(=O)C23CCC(OC)(CC2)CC3)CC1)C(C)C
|
CO[C@@H]C=O)NCCF)CCNC=O)CCCCOC))CC6))CC6)))))))CC6)))))))))CC)C
|
[C][O][C@@H1][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring1][O][C][Branch1][Branch1][C][C][Ring1][Branch2][C][C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring1][C][Branch1][C][C][C]
|
C129CCC7(CC1)CC2.C1%10(F)CCN5CC1.[C@H]6(C4=O)C(C)C.C59=O.CO6.N48.C8%10.O7C
|
Cc1ncncc1C(=O)NC[C@@H]1CN(C(=O)C=Cc2cnn(C)c2)CC(C)(C)C1
|
Ccncncc6C=O)NC[C@@H]CNC=O)C=CccnnC)c5))))))))CCC)C)C6
|
[C][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][C]
|
[C@@H]18CN4CC(C)(C)C1.Cc1ncncc16.C=7c1cnn(C)c1.C4(=O)C=7.C36=O.N35.C58
|
CCc1noc(CC)c1CC(=O)N[C@@H]1CC[C@@H]1CNC(=O)[C@@H]1C=CCC1
|
CCcnocCC))c5CC=O)N[C@@H]CC[C@@H]4CNC=O)[C@@H]C=CCC5
|
[C][C][C][=N][O][C][Branch1][Ring1][C][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][C][=C][C][C][Ring1][Branch1]
|
c17noc8c1%10.[C@@H]15CC[C@@H]19.[C@@H]16C=CCC1.C%10C2=O.C36=O.CC7.C8C.N25.C49.N34
|
CC(C)n1cc(C(=O)N[C@@H](C)C[C@H](C)NC(=O)c2c[nH]c(Br)c2)cn1
|
CCC)nccC=O)N[C@@H]C)C[C@H]C)NC=O)cc[nH]cBr)c5))))))))))))cn5
|
[C][C][Branch1][C][C][N][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][NH1][C][Branch1][C][Br][=C][Ring1][=Branch1][C][=N][Ring2][Ring1][=Branch1]
|
n19cc7cn1.[C@H]5(C)C[C@@H]6C.c18c[nH]c(Br)c1.CC9C.C37=O.C48=O.N35.N46
|
CNc1scnc1C(=O)NC1CC([C@H](F)C(=O)NCc2ccc(C)nc2O)C1
|
CNcscnc5C=O)NCCC[C@H]F)C=O)NCccccC)nc6O)))))))))))C4
|
[C][N][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][O][C][Ring2][Ring1][C]
|
c1%10ccc(C)nc1O.c16scnc18.C17CC9C1.[C@@H]9(F)C4=O.C38=O.CN6.N37.N45.C5%10
|
Cc1ccc(CC(=O)NC2CC3(C2)CC(NC(=O)C24CCC(C2)C4)C3)cc1C
|
CccccCC=O)NCCCC4)CCNC=O)CCCCC5)C5)))))))C4)))))))))cc6C
|
[C][C][=C][C][=C][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][=C][C][=C][Ring2][Ring1][#Branch2][C]
|
Cc1ccc%10cc1C.C17CC2(C1)CC8C2.C129CCC(C1)C2.C%10C5=O.C69=O.N57.N68
|
Nc1ccc(C(=O)N[C@]23CCN(C(=O)Cc4ccnc(Cl)c4F)C[C@H]2C3)cc1Cl
|
NccccC=O)N[C@]CCNC=O)CcccncCl)c6F)))))))))C[C@H]6C7)))))))))cc6Cl
|
[N][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][C][C@H1][Ring1][P][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][O][Cl]
|
Nc1ccc8cc1Cl.[C@]127CCN6C[C@H]1C2.c19ccnc(Cl)c1F.C6(=O)C9.C58=O.N57
|
O=C(c1cnnc(Cl)c1)N1CCC[C@@]2(CCCN(C(=O)c3sccc3I)C2)C1
|
O=CccnncCl)c6))))))NCCC[C@@]CCCNC=O)csccc5I)))))))C6)))))C6
|
[O][=C][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][C][C][C][C@@][Branch2][Ring1][=Branch1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][I][C][Ring1][=C][C][Ring2][Ring1][Ring1]
|
N14CCC[C@@]2(CCCN5C2)C1.c17cnnc(Cl)c1.c16sccc1I.O=C47.C56=O
|
CCc1ncsc1C(=O)N[C@@H]1C[C@@H]2CN(C(=O)c3cnc(Cl)s3)CCN2C1=O
|
CCcncsc5C=O)N[C@@H]C[C@@H]CNC=O)ccncCl)s5))))))CCN6C9=O
|
[C][C][C][N][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Cl][S][Ring1][=Branch1][C][C][N][Ring1][=C][C][Ring1][P][=O]
|
[C@@H]16C[C@@H]2CN5CCN2C1=O.c19ncsc17.c18cnc(Cl)s1.C47=O.C58=O.CC9.N46
|
O=C(N[C@H]1COC[C@H]1C(=O)NC[C@H]1C[C@@H](O)C12CCC2)C1=CCCCC1
|
O=CN[C@H]COC[C@H]5C=O)NC[C@H]C[C@@H]O)C4CCC4))))))))))))))))C=CCCCC6
|
[O][=C][Branch2][Ring1][=N][N][C@H1][C][O][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][C][O][C][Ring1][Branch1][C][C][C][Ring1][Ring2][C][=C][C][C][C][C][Ring1][=Branch1]
|
O=C3C1=CCCCC1.[C@H]18C[C@@H](O)C12CCC2.[C@H]16COC[C@H]17.C47=O.N36.N45.C58
|
O=C(Nc1cccnc1O)c1cc(Cl)ncc1NS(=O)(=O)c1cccc(Br)c1
|
O=CNccccnc6O))))))))cccCl)ncc6NS=O)=O)cccccBr)c6
|
[O][=C][Branch1][O][N][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][=C][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1]
|
S3(=O)(=O)c1cccc(Br)c1.c16cc(Cl)ncc15.c14cccnc1O.O=C26.N24.N35
|
C=CCOCC(=O)N[C@@H]1CN(C(=O)C(C)(C)CCC(=O)OC)CC(F)(F)C1
|
C=CCOCC=O)N[C@@H]CNC=O)CC)C)CCC=O)OC)))))))CCF)F)C6
|
[C][=C][C][O][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][O][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][Ring1]
|
C4(=O)C(C)(C)CCC2=O.[C@@H]17CN4CC(F)(F)C1.C6C3=O.C=CC5.O56.N37.O2C
|
C[C@H](CNC(=O)C[C@@H](C)C(C)(C)NC(=O)c1ccc2cncn2c1)C(F)(F)F
|
C[C@H]CNC=O)C[C@@H]C)CC)C)NC=O)cccccncn5c9)))))))))))))))))CF)F)F
|
[C][C@H1][Branch2][Ring2][Branch1][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][N][Ring1][Branch1][C][=Ring1][=Branch2][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)C[C@@H](C)C6(C)C.c17ccc2cncn2c1.C[C@H](C5)C(F)(F)F.C47=O.N35.N46
|
CC(C)CCC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)Cn3cc4ccccc4n3)[C@@H]2C1
|
CCC)CCC=O)NC[C@@H]CCC[C@@H]NC=O)Cnccccccc6n9))))))))))))[C@@H]6C9
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][N][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][=Branch2][C@@H1][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch1]
|
N15C[C@@H]2CCC[C@@H]7[C@@H]2C1.n18cc2ccccc2n1.CC(C)CCC5=O.C6(=O)C8.N67
|
CC(C)CCOCC(=O)NCCN(C)C(=O)[C@H]1CC(c2cccc(Cl)c2F)=NO1
|
CCC)CCOCC=O)NCCNC)C=O)[C@H]CCcccccCl)c6F)))))))=NO5
|
[C][C][Branch1][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][Branch1][=N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][=N][O][Ring1][=N]
|
[C@H]19CC(c2cccc(Cl)c2F)=NO1.CC(C)CC5.C6C3=O.C7C8.N48C.C49=O.O56.N37
|
CN1CC[C@H](O)[C@H](NC(=O)[C@H]2CC=C[C@H](NC(=O)[C@H]3CCCO3)C2)C1
|
CNCC[C@H]O)[C@H]NC=O)[C@H]CC=C[C@H]NC=O)[C@H]CCCO5)))))))C6))))))))C6
|
[C][N][C][C][C@H1][Branch1][C][O][C@H1][Branch2][Ring1][N][N][C][=Branch1][C][=O][C@H1][C][C][=C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][C][C][O][Ring1][Branch1][C][Ring1][=C][C][Ring2][Ring1][Branch2]
|
CN1CC[C@H](O)[C@H]6C1.[C@H]19CC=C[C@H]7C1.[C@H]18CCCO1.C49=O.C58=O.N46.N57
|
Cc1cc(C#N)c(NC(=O)c2cccc(NS(=O)(=O)c3cccc(Br)c3F)c2)s1
|
CcccC#N))cNC=O)cccccNS=O)=O)cccccBr)c6F)))))))))c6))))))))s5
|
[C][C][=C][C][Branch1][Ring1][C][#N][=C][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][F][=C][Ring2][Ring1][C][S][Ring2][Ring1][N]
|
S5(=O)(=O)c1cccc(Br)c1F.Cc1cc(C#N)c6s1.c18cccc7c1.C48=O.N46.N57
|
COC(=O)[C@H]1CC[C@H](C(=O)NCCCCCCN(C)C(=O)C2(CSC)CC2)CC1
|
COC=O)[C@H]CC[C@H]C=O)NCCCCCCNC)C=O)CCSC)))CC3)))))))))))))CC6
|
[C][O][C][=Branch1][C][=O][C@H1][C][C][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][Ring2][C][S][C][C][C][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2]
|
[C@H]1%10CC[C@H]%11CC1.C7CCCCC8.C1%124CC1.C3%10=O.C5%11=O.N68C.C6%12=O.CO3.N57.C94.S9C
|
FC1(F)C[C@]12CCCN(C[C@H]1CCCC13CCOCC3)CC2
|
FCF)C[C@]3CCCNC[C@H]CCCC5CCOCC6)))))))))))CC7
|
[F][C][Branch1][C][F][C][C@][Ring1][Ring2][C][C][C][N][Branch1][S][C][C@H1][C][C][C][C][Ring1][Branch1][C][C][O][C][C][Ring1][=Branch1][C][C][Ring2][Ring1][C]
|
FC1(F)C[C@]12CCCN4CC2.[C@H]15CCCC12CCOCC2.C45
|
C[C@@H](CNC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)C#CC(C)(C)O)C2)n1cccn1
|
C[C@@H]CNC=O)[C@H]C[C@H]C=C[C@H]6NC=O)C#CCC)C)O)))))C6)))))))))))ncccn5
|
[C][C@@H1][Branch2][Ring2][Ring1][C][N][C][=Branch1][C][=O][C@H1][C][C@H1][C][=C][C@H1][Ring1][=Branch1][N][Branch1][#C][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][=C][N][C][=C][C][=N][Ring1][Branch1]
|
[C@H]16C[C@H]2C=C[C@H]1N4C2.C4(=O)C#CC(C)(C)O.n17cccn1.C[C@H]7C5.C36=O.N35
|
C[C@H]1COCC[C@@H]1C(=O)NCCNC(=O)c1cc(C2CCOCC2)on1
|
C[C@H]COCC[C@@H]6C=O)NCCNC=O)cccCCCOCC6))))))on5
|
[C][C@H1][C][O][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][O][N][=Ring1][O]
|
C[C@H]1COCC[C@@H]18.c17cc9on1.C19CCOCC1.C38=O.C5C6.C47=O.N35.N46
|
CC[C@@H](C(=O)N1CCC[C@@H]1[C@H](C)NC(=O)CCSc1ccccn1)N(C)C
|
CC[C@@H]C=O)NCCC[C@@H]5[C@H]C)NC=O)CCScccccn6))))))))))))))))))NC)C
|
[C][C][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][S][C][=C][C][=C][C][=N][Ring1][=Branch1][N][Branch1][C][C][C]
|
CC[C@H]4C2=O.N12CCC[C@@H]17.c18ccccn1.C3(=O)CC6.[C@@H]57C.N4(C)C.N35.S68
|
Cc1c(C(=O)N2CCC[C@H](NC(=O)[C@@H]3CC(=O)N3)[C@@H]2C)oc2ccccc12
|
CccC=O)NCCC[C@H]NC=O)[C@@H]CC=O)N4))))))[C@@H]6C))))))))occcccc96
|
[C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][Ring1][Branch1][C@@H1][Ring1][=C][C][O][C][=C][C][=C][C][=C][Ring2][Ring1][#Branch2][Ring1][=Branch1]
|
Cc1c8oc2ccccc12.N14CCC[C@H]6[C@@H]1C.[C@@H]17CC(=O)N1.C48=O.C57=O.N56
|
CCC(CC)C[C@H](F)C(=O)NCCc1n[nH]cc1C(=O)NC[C@H](C)CC(=O)OC
|
CCCCC))C[C@H]F)C=O)NCCcn[nH]cc5C=O)NC[C@H]C)CC=O)OC
|
[C][C][C][Branch1][Ring1][C][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][O][C]
|
CCC(CC)C[C@H](F)C3=O.C6[C@H](C)CC2=O.c18n[nH]cc17.C5C8.C47=O.N35.N46.O2C
|
C[C@H](CN(C)C(=O)c1nccc2ncccc12)NC(=O)c1csc(C(F)F)n1
|
C[C@H]CNC)C=O)cncccncccc%106)))))))))))))NC=O)ccscCF)F))n5
|
[C][C@H1][Branch2][Ring1][Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=N][C][=C][C][=N][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][=Branch1][C][Branch1][C][F][F][=N][Ring1][Branch2]
|
c17nccc2ncccc12.c18csc9n1.C[C@@H]5C6.N36C.C37=O.C48=O.C9(F)F.N45
|
CCOC[C@@H](NC(=O)CC(C)(C)C(F)F)C(=O)N1CC[C@H](N2CCCC2)C1
|
CCOC[C@@H]NC=O)CCC)C)CF)F))))))C=O)NCC[C@H]NCCCC5)))))C5
|
[C][C][O][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][Ring1][#Branch2]
|
C3(=O)CC(C)(C)C(F)F.C6[C@@H]7C4=O.N14CC[C@H]8C1.N18CCCC1.CC5.O56.N37
|
CCC(CC)C(=O)NC[C@@H]1CN(C)CCN1C(=O)C[C@H](O)CN(C)C
|
CCCCC))C=O)NC[C@@H]CNC)CCN6C=O)C[C@H]O)CNC)C
|
[C][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C@H1][Branch1][C][O][C][N][Branch1][C][C][C]
|
[C@@H]16CN(C)CCN13.CCC(CC)C2=O.C3(=O)C[C@H](O)C5.N5(C)C.N24.C46
|
Cn1ccc(C(=O)NC[C@@H]2[C@H]3C[C@H]3CN2C(=O)Cn2ccc3ccc(F)cc32)c1
|
CncccC=O)NC[C@@H][C@H]C[C@H]3CN6C=O)CnccccccF)cc69))))))))))))))))))))c5
|
[C][N][C][=C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C@H1][C][C@H1][Ring1][Ring1][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][N][C][=C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][#Branch2][=C][Ring2][Ring1][N]
|
n18ccc2ccc(F)cc21.[C@@H]19[C@H]2C[C@H]2CN15.Cn1ccc7c1.C5(=O)C8.C47=O.N46.C69
|
O=C(Nc1ccc(OC(F)(F)[C@H](F)Cl)cc1)N1CC2(C1)CC1(CCC1)C2
|
O=CNccccOCF)F)[C@H]F)Cl))))cc6)))))))NCCC4)CCCCC4)))C4
|
[O][=C][Branch2][Ring1][=Branch2][N][C][=C][C][=C][Branch1][=C][O][C][Branch1][C][F][Branch1][C][F][C@H1][Branch1][C][F][Cl][C][=C][Ring1][=N][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][Branch2]
|
N14CC2(C1)CC1(CCC1)C2.c17ccc6cc1.C5(F)(F)[C@H](F)Cl.O=C34.N37.O56
|
N#Cc1cccc(CC(=O)N[C@H]2COCC[C@H]2C(=O)N2CC[C@H]2C2CCC2)c1
|
N#CcccccCC=O)N[C@H]COCC[C@H]6C=O)NCC[C@H]4CCCC4))))))))))))))))))c6
|
[N][#C][C][=C][C][=C][C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C@H1][C][O][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Ring1][Ring2][C][C][C][C][Ring1][Ring2][=C][Ring2][Ring1][#Branch2]
|
N#Cc1cccc7c1.[C@H]15COCC[C@H]16.N14CC[C@H]18.C7C3=O.C18CCC1.C46=O.N35
|
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