SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
O=C(NC1([C@@H]2CCCCN2C(=O)C[C@H]2CCC3(CCC3)O2)CC1)c1cccnc1
|
O=CNC[C@@H]CCCCN6C=O)C[C@H]CCCCCC4)))O5)))))))))))))CC3))))ccccnc6
|
[O][=C][Branch2][Ring2][=Branch1][N][C][Branch2][Ring1][N][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C@H1][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][O][Ring1][Branch2][C][C][Ring2][Ring1][Ring2][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
[C@H]18CCC2(CCC2)O1.[C@@H]19CCCCN15.c17cccnc1.C169CC1.C5(=O)C8.O=C47.N46
|
CC[C@@H](C)c1nc(C)cc(=NCC2CN(C(=O)[C@H](CC(C)C)C(N)=O)C2)[nH]1
|
CC[C@@H]C)cncC)cc=NCCCNC=O)[C@H]CCC)C)))CN)=O))))C4))))))[nH]6
|
[C][C][C@@H1][Branch1][C][C][C][=N][C][Branch1][C][C][=C][C][=Branch2][Ring1][=C][=N][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][Branch1][C][N][=O][C][Ring1][=C][NH1][Ring2][Ring1][#Branch1]
|
c14nc(C)cc(=NC5)[nH]1.C3(=O)[C@H](CC(C)C)C(N)=O.C15CN3C1.CC[C@H]4C
|
CCc1nc([C@@H](C)NC(=O)CNC(=O)CC2CCC=CCC2)n[nH]1
|
CCcnc[C@@H]C)NC=O)CNC=O)CCCCC=CCC7))))))))))))))n[nH]5
|
[C][C][C][=N][C][Branch2][Ring1][#Branch2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][C][C][=C][C][C][Ring1][#Branch1][=N][NH1][Ring2][Ring1][=Branch1]
|
C19CCC=CCC1.c17nc8n[nH]1.C3(=O)C6.C4(=O)C9.[C@H]58C.CC7.N35.N46
|
COCCN(CCNC(=O)[C@@]1(F)CCOC1)C(=O)CCc1nc(C)no1
|
COCCNCCNC=O)[C@@]F)CCOC5)))))))))C=O)CCcncC)no5
|
[C][O][C][C][N][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][O][C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][=N][C][Branch1][C][C][=N][O][Ring1][=Branch1]
|
[C@]18(F)CCOC1.c19nc(C)no1.C3(=O)CC9.C4C5.N356.C6C7.C28=O.CO4.N27
|
CC[C@H](O)C(=O)N1C[C@H]2COC[C@@H](C1)N2C(=O)[C@@H](C)COC
|
CC[C@H]O)C=O)NC[C@H]COC[C@@H]C8)N6C=O)[C@@H]C)COC
|
[C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C@@H1][Branch1][Ring2][C][Ring1][Branch2][N][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][O][C]
|
N13C[C@H]2COC[C@@H](C1)N24.CC[C@H](O)C3=O.C4(=O)[C@@H](C)C5.O5C
|
COCCSCC(=O)NCc1ccc2c(c1)CC[C@H]2NC(=O)c1coc(Cl)c1
|
COCCSCC=O)NCcccccc6)CC[C@H]5NC=O)ccocCl)c5
|
[C][O][C][C][S][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][Cl][=C][Ring1][=Branch1]
|
c1%10ccc2c(c1)CC[C@H]2N4.c19coc(Cl)c1.C8C3=O.C5C7.C49=O.CO5.S78.N36.C6%10
|
CCCSCc1ccc(C(=O)NC2CCC(N(C)C(=O)C[C@H](C)COC)CC2)o1
|
CCCSCccccC=O)NCCCCNC)C=O)C[C@H]C)COC)))))))CC6))))))))o5
|
[C][C][C][S][C][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][C][Branch1][P][N][Branch1][C][C][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C][O][C][C][C][Ring1][S][O][Ring2][Ring1][Branch2]
|
C18CCC9CC1.C4(=O)C[C@H](C)C5.c1%11ccc%10o1.CCC6.C3%10=O.N49C.S67.C7%11.N38.O5C
|
CN(CC1CCOCC1)C(=O)[C@@H]1CCN(C(=O)[C@@H]2COC[C@H]2C(N)=O)C(C)(C)C1
|
CNCCCCOCC6)))))))C=O)[C@@H]CCNC=O)[C@@H]COC[C@H]5CN)=O))))))))CC)C)C6
|
[C][N][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][O][C][C@H1][Ring1][Branch1][C][Branch1][C][N][=O][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][C]
|
[C@@H]16CCN4C(C)(C)C1.C19CCOCC1.[C@@H]17COC[C@H]18.CN35.C36=O.C47=O.C8(N)=O.C59
|
CC[C@@H](O)CCNC(=O)[C@]1(CC)CCCN(C(=O)c2occc2COC)C1
|
CC[C@@H]O)CCNC=O)[C@]CC))CCCNC=O)coccc5COC)))))))))C6
|
[C][C][C@@H1][Branch1][C][O][C][C][N][C][=Branch1][C][=O][C@][Branch1][Ring1][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][O][C][C][Ring2][Ring1][C]
|
[C@@]189CCCN4C1.CC[C@@H](O)CC6.c17occc1%10.C38=O.C47=O.N36.C9C.C5%10.O5C
|
C=CC[C@@H](CNC(=O)c1cccc2sncc12)NC(=O)c1nccn2ccnc12
|
C=CC[C@@H]CNC=O)cccccsncc95))))))))))))NC=O)cnccnccnc95
|
[C][=C][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][S][N][=C][C][Ring1][=Branch2][=Ring1][Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][N][C][=C][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
c18cccc2sncc12.c17nccn2ccnc12.C=CC[C@H]5C6.C38=O.C47=O.N36.N45
|
Cc1ccn(CCC(=O)N[C@H]2CCO[C@H]2C(=O)NCC2=NO[C@@H]3CCC[C@H]23)n1
|
CcccnCCC=O)N[C@H]CCO[C@H]5C=O)NCC=NO[C@@H]CCC[C@H]85))))))))))))))))))))n5
|
[C][C][C][=C][N][Branch2][Ring1][P][C][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=N][O][C@@H1][C][C][C][C@H1][Ring1][Branch2][Ring1][Branch1][N][=Ring2][Ring1][O]
|
C6C1=NO[C@@H]2CCC[C@H]12.Cc1ccn9n1.[C@H]17CCO[C@H]18.C9CC4=O.C58=O.N47.N56
|
CCSC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](C)C(=O)NC
|
CCSC[C@H]NC=O)OCC)C)C)))))C=O)NC)[C@@H]C)C=O)NC
|
[C][C][S][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C]
|
C9[C@H]6C3=O.[C@H]7(C)C4=O.C5(C)(C)C.C12=O.N37C.CC8.S89.N26.O15.N4C
|
C[C@H]1CN(C(=O)c2cccc(N)n2)CCN1C(=O)c1ccc2nc(O)[nH]c2n1
|
C[C@H]CNC=O)cccccN)n6)))))))CCN6C=O)ccccncO)[nH]c5n9
|
[C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][N][=N][Ring1][#Branch1][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Branch1][C][O][NH1][C][Ring1][=Branch1][=N][Ring1][#Branch2]
|
c16ccc2nc(O)[nH]c2n1.C[C@H]1CN3CCN14.c15cccc(N)n1.C35=O.C46=O
|
CCCSCC(=O)N[C@H]1CCC[C@]12CCN(C(=O)c1ccc(=NC)[nH]c1)C2
|
CCCSCC=O)N[C@H]CCC[C@]5CCNC=O)cccc=NC))[nH]c6)))))))C5
|
[C][C][C][S][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@][Ring1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][=Branch1][Ring1][=N][C][NH1][C][=Ring1][Branch2][C][Ring1][#C]
|
[C@H]17CCC[C@]12CCN4C2.c18ccc(=NC)[nH]c1.C6C3=O.CCC5.C48=O.S56.N37
|
COc1cc(CCO)ccc1NC1(c2nnnn2C2CC2)CC(Br)C1
|
COcccCCO)))ccc6NCcnnnn5CCC3))))))))CCBr)C4
|
[C][O][C][=C][C][Branch1][Ring2][C][C][O][=C][C][=C][Ring1][=Branch2][N][C][Branch1][=N][C][=N][N][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][C][Branch1][C][Br][C][Ring1][=N]
|
c13cc6ccc15.C148CC(Br)C1.c18nnnn17.C6CO.C17CC1.CO3.N45
|
C[C@@H](CSc1ccccc1)C(=O)N[C@@](C)(CNC(=O)c1c(Cl)csc1Cl)C1CC1
|
C[C@@H]CScccccc6))))))))C=O)N[C@@]C)CNC=O)ccCl)csc5Cl)))))))))CCC3
|
[C][C@@H1][Branch1][O][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@][Branch1][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][Cl][=C][S][C][=Ring1][=Branch1][Cl][C][C][C][Ring1][Ring1]
|
c17c(Cl)csc1Cl.C[C@@H](C6)C2=O.c19ccccc1.[C@@]48(C)C5.C37=O.C18CC1.S69.N24.N35
|
CC(C)(C)N1CCC(NC(=O)C2(CO)CCOCC2)CC1
|
CCC)C)NCCCNC=O)CCO))CCOCC6))))))))CC6
|
[C][C][Branch1][C][C][Branch1][C][C][N][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][O][C][C][Ring1][Branch2][C][C][Ring1][P]
|
N14CCC5CC1.C167CCOCC1.CC4(C)C.C36=O.N35.C7O
|
CC(C)c1n[nH]c(CNC(=O)[C@@H](NC(=O)C2CSC2)C2CC2)n1
|
CCC)cn[nH]cCNC=O)[C@@H]NC=O)CCSC4))))))CCC3)))))))n5
|
[C][C][Branch1][C][C][C][=N][NH1][C][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][N][N][C][=Branch1][C][=O][C][C][S][C][Ring1][Ring2][C][C][C][Ring1][Ring1][=N][Ring2][Ring1][Ring2]
|
c18n[nH]c9n1.C3(=O)[C@@H]6%10.C17CSC1.CC8C.C47=O.C1%10CC1.C59.N35.N46
|
CO[C@@H]1C[C@@H](CNC(=O)[C@H]2CCC(F)(F)C2)N(C(=O)c2cc(C)sc2C)C1
|
CO[C@@H]C[C@@H]CNC=O)[C@H]CCCF)F)C5))))))))NC=O)cccC)sc5C)))))))C5
|
[C][O][C@@H1][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2]
|
[C@@H]15C[C@@H]9N4C1.[C@H]17CCC(F)(F)C1.c18cc(C)sc1C.C37=O.C48=O.CO5.C69.N36
|
COc1c(C)ncnc1C(=O)N[C@@H]1CC12CCC(NC(=O)c1cncn1C)CC2
|
COccC)ncnc6C=O)N[C@@H]CC3CCCNC=O)ccncn5C))))))))CC6
|
[C][O][C][=C][Branch1][C][C][N][=C][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][Ring1][Ring1][C][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][C][C][Ring1][#C]
|
[C@@H]16CC12CCC7CC2.c15c8ncnc1C.c19cncn1C.C38=O.C49=O.CO5.N36.N47
|
O=C(N[C@@H]1C[C@H]1[C@H]1CCCN(C(=O)c2cnc(O)c3ccccc23)C1)C1CCC1
|
O=CN[C@@H]C[C@H]3[C@H]CCCNC=O)ccncO)cccccc%106)))))))))))C6))))))))))CCCC4
|
[O][=C][Branch2][Ring2][Branch2][N][C@@H1][C][C@H1][Ring1][Ring1][C@H1][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C][C][C][C][Ring1][Ring2]
|
c18cnc(O)c2ccccc12.[C@@H]16C[C@H]1[C@H]1CCCN5C1.C17CCC1.O=C47.C58=O.N46
|
CC1(C)OC2(CNC(=O)C[C@@H]3CCCOCC3)CC1(NC(=O)CC1CCCC1)C2
|
CCC)OCCNC=O)C[C@@H]CCCOCC7)))))))))))CC5NC=O)CCCCCC5))))))))C4
|
[C][C][Branch1][C][C][O][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][O][C][C][Ring1][#Branch1][C][C][Ring2][Ring1][C][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
CC1(C)OC28CC17C2.[C@@H]19CCCOCC1.C1%10CCCC1.C4(=O)C9.C5(=O)C%10.C68.N46.N57
|
Cn1cncc1CC(=O)N1CC(F)(F)C[C@]1(C)CNC(=O)C[C@H]1OCCC1(C)C
|
Cncncc5CC=O)NCCF)F)C[C@]5C)CNC=O)C[C@H]OCCC5C)C
|
[C][N][C][=N][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][C@][Ring1][#Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C@H1][O][C][C][C][Ring1][Branch1][Branch1][C][C][C]
|
N12CC(F)(F)C[C@@]15C.[C@H]16OCCC1(C)C.Cn1cncc17.C7C2=O.C3(=O)C6.C45.N34
|
CCN(C)CC(=O)N(C)[C@H]1[C@@H]2CN(C(=O)CC[S+](C)[O-])C[C@@H]21
|
CCNC)CC=O)NC)[C@H][C@@H]CNC=O)CC[S+]C)[O-])))))C[C@@H]56
|
[C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][S+1][Branch1][C][C][O-1][C][C@@H1][Ring1][N][Ring1][=N]
|
[C@@H]17[C@H]2CN4C[C@@H]12.C4(=O)CC[S+](C)[O-].C6C3=O.N56C.N37C.CC5
|
CC[C@H](CCOC)C(=O)N[C@H](C(=O)N[C@@H]1CCC[C@H](O)C1)C(C)(C)O
|
CC[C@H]CCOC))))C=O)N[C@H]C=O)N[C@@H]CCC[C@H]O)C6))))))))CC)C)O
|
[C][C][C@H1][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][N][C@H1][Branch1][P][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Branch1][C][O][C][Ring1][#Branch1][C][Branch1][C][C][Branch1][C][C][O]
|
CC[C@H](CC4)C2=O.[C@@H]5(C3=O)C(C)(C)O.[C@@H]16CCC[C@H](O)C1.O4C.N25.N36
|
C[C@@H]1CN(C(=O)[C@@H]2CCCN2C2CC2)C[C@H]1NC(=O)c1cc(F)c(Cl)c(N)c1Cl
|
C[C@@H]CNC=O)[C@@H]CCCN5CCC3)))))))))C[C@H]5NC=O)cccF)cCl)cN)c6Cl
|
[C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][C@H1][Ring1][#C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][Cl][C][Branch1][C][N][=C][Ring1][=Branch2][Cl]
|
c18cc(F)c(Cl)c(N)c1Cl.C[C@@H]1CN3C[C@H]16.[C@@H]17CCCN15.C37=O.C15CC1.C48=O.N46
|
CSCC[C@H](O)c1nnc(N(C)[C@@H]2CCN(Cc3ccccc3)C2)n1C
|
CSCC[C@H]O)cnncNC)[C@@H]CCNCcccccc6)))))))C5))))))n5C
|
[C][S][C][C][C@H1][Branch1][C][O][C][=N][N][=C][Branch2][Ring1][#Branch1][N][Branch1][C][C][C@@H1][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][N][Ring2][Ring1][Ring1][C]
|
c18nnc6n1C.[C@@H]17CCN4C1.c19ccccc1.C5C[C@@H]8O.N67C.CS5.C49
|
CC(C)[C@]1(C)CCN1C(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cnc(C2CC2)o1
|
CCC)[C@]C)CCN4C=O)[C@@H]CCCC[C@]6C)NC=O)ccncCCC3)))o5
|
[C][C][Branch1][C][C][C@][Branch1][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][C][C@][Ring1][=Branch1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2]
|
[C@@H]17CCCC[C@@]15C.[C@@]18(C)CCN13.c16cnc9o1.CC8C.C37=O.C46=O.C19CC1.N45
|
COCCN(CCNC(=O)c1cn(C)nc1Cl)C(=O)c1ccnn1CC1CCC1
|
COCCNCCNC=O)ccnC)nc5Cl))))))))))C=O)cccnn5CCCCC4
|
[C][O][C][C][N][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][Cl][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][C][C][Ring1][Ring2]
|
c1%10cn(C)nc1Cl.c19ccnn1%11.C13CCC1.C5C6.N467.C7C8.C2%10=O.C49=O.CO5.N28.C%113
|
CC1=C[C@H](C(=O)N2Cc3n[nH]cc3[C@@H]2C(=O)N2CCC[C@@H](CC3CC3)C2)SC1
|
CC=C[C@H]C=O)NCcn[nH]cc5[C@@H]8C=O)NCCC[C@@H]CCCC3))))C6))))))))))))))))SC5
|
[C][C][=C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][=N][NH1][C][=C][Ring1][Branch1][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][#Branch2][S][C][Ring2][Ring1][O]
|
N14Cc2n[nH]cc2[C@@H]1C5=O.N15CCC[C@@H]7C1.CC1=C[C@H]6SC1.C46=O.C18CC1.C78
|
COCC=CC(=O)N[C@]12C[C@H]1CN(C(=O)[C@H]1CCCCN1N=O)C2
|
COCC=CC=O)N[C@]C[C@H]3CNC=O)[C@H]CCCCN6N=O)))))))))C6
|
[C][O][C][C][=C][C][=Branch1][C][=O][N][C@][C][C@H1][Ring1][Ring1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C][C][C][N][Ring1][=Branch1][N][=O][C][Ring1][S]
|
[C@H]17CCCCN1N=O.[C@]126C[C@H]1CN4C2.C=8C3=O.C5C=8.C47=O.CO5.N36
|
CCc1cccc(C(=O)N[C@H]2CCC3(CCN(C(=O)c4cscn4)CC3)C2)c1F
|
CCcccccC=O)N[C@H]CCCCCNC=O)ccscn5))))))CC6)))))C5)))))))c6F
|
[C][C][C][=C][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][S][C][=N][Ring1][Branch1][C][C][Ring1][=N][C][Ring1][P][=C][Ring2][Ring1][#Branch2][F]
|
[C@H]17CCC2(CCN6CC2)C1.c1%10cccc9c1F.c18cscn1.C59=O.C68=O.CC%10.N57
|
Cc1ccc2ncc(C(=O)N[C@@H](C)CN(C)CC=Cc3ccccc3)n2c1
|
CccccnccC=O)N[C@@H]C)CNC)CC=Ccccccc6))))))))))))))n5c9
|
[C][C][C][=C][C][=N][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][=Branch1][C][=Ring2][Ring1][#Branch2]
|
Cc1ccc2ncc8n2c1.C=9c1ccccc1.[C@H]5(C)C6.C48=O.N67C.C7C=9.N45
|
O=C(NC/C=C\CNC(=O)C1CCC1)c1cnc(C2CCC2)s1
|
O=CNC/C=C\CNC=O)CCCC4)))))))))))ccncCCCC4))))s5
|
[O][=C][Branch1][P][N][C][/C][=C][\C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][=C][N][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][S][Ring1][=Branch2]
|
c17cnc%10s1.C18CCC1.C1%10CCC1.O=C37.C5C=9.C=9C6.C48=O.N35.N46
|
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](C(=O)O)c1ccccc1F
|
CCC)CC=O)N[C@@H]Cccnc[nH]5))))))C=O)N[C@H]C=O)O))cccccc6F
|
[C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F]
|
c17ccccc1F.CC(C)CC2=O.[C@H]4(C6)C3=O.c16cnc[nH]1.[C@H]57C(=O)O.N24.N35
|
CCCN1CCC[C@H]1C(=O)N1CCC[C@](O)(CNC(=O)C(=O)NCC(F)(F)F)C1
|
CCCNCCC[C@H]5C=O)NCCC[C@]O)CNC=O)C=O)NCCF)F)F))))))))C6
|
[C][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][O][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][Ring1]
|
N12CCC[C@@]9(O)C1.N15CCC[C@H]18.C3(=O)C4=O.C7C(F)(F)F.CCC5.C28=O.C69.N36.N47
|
CCc1cccc(C)c1NC(=O)[C@@H]([C@H](C)C(C)(C)C)N1CCN(C(N)=O)CC1
|
CCcccccC)c6NC=O)[C@@H][C@H]C)CC)C)C)))NCCNCN)=O))CC6
|
[C][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][=N][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][C][N][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2]
|
C2(=O)[C@H]4[C@H](C)C(C)(C)C.c16cccc(C)c15.N14CCN3CC1.C3(N)=O.CC6.N25
|
CC(=C(F)C(=O)N[C@]12C[C@H]1CN(C(=O)C1(C)COC1)C2)C1CC1
|
CC=CF)C=O)N[C@]C[C@H]3CNC=O)CC)COC4)))))C6)))))))))CCC3
|
[C][C][=Branch2][Ring2][Ring1][=C][Branch1][C][F][C][=Branch1][C][=O][N][C@][C][C@H1][Ring1][Ring1][C][N][Branch1][=C][C][=Branch1][C][=O][C][Branch1][C][C][C][O][C][Ring1][Branch1][C][Ring1][=N][C][C][C][Ring1][Ring1]
|
[C@]125C[C@H]1CN4C2.CC=7C1CC1.C=7(F)C3=O.C16(C)COC1.C46=O.N35
|
O=C([C@H]1CCCc2nccn21)N1C[C@@H]2[C@@H](CNC(=O)C3(C4CCC4)CC3)[C@@H]2C1
|
O=C[C@H]CCCcnccn59)))))))))NC[C@@H][C@@H]CNC=O)CCCCC4))))CC3))))))[C@@H]3C6
|
[O][=C][Branch1][=C][C@H1][C][C][C][C][=N][C][=C][N][Ring1][Branch1][Ring1][=Branch2][N][C][C@@H1][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][C][Ring1][#Branch1][C@@H1][Ring1][=C][C][Ring1][P]
|
O=C5[C@H]1CCCc2nccn21.N15C[C@@H]2[C@@H]9[C@@H]2C1.C18(C2CCC2)CC1.C68=O.C79.N67
|
COC1(CNC(=O)[C@H](C)C(C)C)CCN(C(=O)C23CC(C(C)C)(CO2)C3)CC1
|
COCCNC=O)[C@H]C)CC)C))))))CCNC=O)CCCCC)C))CO5))C4)))))CC6
|
[C][O][C][Branch1][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][C][C][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][Branch1][C][C][C][Branch1][Branch1][C][O][Ring1][Branch2][C][Ring1][=Branch2][C][C][Ring2][Ring1][#Branch2]
|
C169CCN5CC1.C4(=O)[C@H](C)C(C)C.C128CC%10(CO1)C2.C58=O.C%10(C)C.CO6.C79.N47
|
CO[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](CNC(=O)C=C(C)C)C12CC2
|
CO[C@@H]CCC[C@H]5C=O)NCC[C@H]CNC=O)C=CC)C))))))C5CC3
|
[C][O][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][C][Ring1][=N][C][C][Ring1][Ring1]
|
N13CC[C@H]9C12CC2.[C@@H]15CCC[C@H]17.C4(=O)C=8.C37=O.C=8(C)C.CO5.C69.N46
|
Cc1nc(N[C@@H]2C[C@H](C)N(C(=O)C[C@@H](C)C(C)C)C2)c(Cl)cc1[N+](=O)[O-]
|
CcncN[C@@H]C[C@H]C)NC=O)C[C@@H]C)CC)C)))))C5))))))cCl)cc6[N+]=O)[O-]
|
[C][C][=N][C][Branch2][Ring1][N][N][C@@H1][C][C@H1][Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][Branch1][C][C][C][C][Ring1][=C][=C][Branch1][C][Cl][C][=C][Ring2][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1]
|
Cc1nc4c(Cl)cc1[N+](=O)[O-].C3(=O)C[C@@H](C)C(C)C.[C@@H]15C[C@H](C)N3C1.N45
|
Cc1cnn(CCC(=O)N2CCC[C@H]([C@H]3C[C@H]3NC(=O)CCc3ccon3)C2)c1
|
CccnnCCC=O)NCCC[C@H][C@H]C[C@H]3NC=O)CCcccon5))))))))))))C6)))))))))c5
|
[C][C][C][=N][N][Branch2][Ring2][=Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Ring2][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][C][=C][O][N][=Ring1][Branch1][C][Ring2][Ring1][Ring1][C][=Ring2][Ring1][N]
|
N14CCC[C@H]([C@H]2C[C@H]26)C1.Cc1cnn7c1.C7CC4=O.C5(=O)CC8.c18ccon1.N56
|
NC(=O)/C=C\C(=O)N[C@@H]1CCC[C@@H](NC(=O)c2ccc(N3CC=CC3)cc2)CC1
|
NC=O)/C=C\C=O)N[C@@H]CCC[C@@H]NC=O)ccccNCC=CC5)))))cc6))))))))CC7
|
[N][C][=Branch1][C][=O][/C][=C][\C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][C][=C][C][Ring1][Branch1][C][=C][Ring1][O][C][C][Ring2][Ring1][Branch1]
|
[C@@H]17CCC[C@@H]8CC1.c19ccc6cc1.N16CC=CC1.NC(=O)C=%10.C=%10C4=O.C59=O.N47.N58
|
Cc1ccnc(C(=O)N[C@H]2CC[C@@H](CNC(=O)Cc3cccc(Cl)c3Cl)C2)c1
|
CcccncC=O)N[C@H]CC[C@@H]CNC=O)CcccccCl)c6Cl)))))))))))C5)))))))c6
|
[C][C][=C][C][=N][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][Ring2][Ring1][C][=C][Ring2][Ring1][O]
|
c1%10cccc(Cl)c1Cl.Cc1ccnc8c1.[C@H]17CC[C@@H]9C1.C5(=O)C%10.C48=O.N47.C69.N56
|
COc1cccc(CNCC(=O)N2CCC[C@H]2C(=O)NC2CC(F)C2)c1
|
COcccccCNCC=O)NCCC[C@H]5C=O)NCCCF)C4)))))))))))))))c6
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][=N][C][N][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][C][Ring1][Branch1][=C][Ring2][Ring1][Branch2]
|
c15cccc%10c1.N13CCC[C@H]19.C18CC(F)C1.C7C3=O.C49=O.CO5.C6%10.N67.N48
|
CCCC(=O)NC1[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCCO4)CC[C@@H]12
|
CCCC=O)NC[C@@H]CCNC=O)cccccc6)OCCCO7)))))))))))CC[C@@H]87
|
[C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][O][Ring1][Branch2][C][C][C@@H1][Ring2][Ring1][Branch1][Ring2][Ring1][Ring2]
|
c18ccc2c(c1)OCCCO2.C17[C@@H]2CCN6CC[C@@H]12.CCCC5=O.C68=O.N57
|
C=Cc1cncc(C(=O)N[C@@H](CC(=C)Cl)C(=O)N2CCCCCO2)c1
|
C=CccnccC=O)N[C@@H]CC=C)Cl)))C=O)NCCCCCO7)))))))))))c6
|
[C][=C][C][=C][N][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=C][Cl][C][=Branch1][C][=O][N][C][C][C][C][C][O][Ring1][#Branch1][=C][Ring2][Ring1][#Branch1]
|
[C@H]4(CC(=C)Cl)C(=O)N1CCCCCO1.C=Cc1cncc5c1.C35=O.N34
|
CCCC[C@H](C)NC(=O)CCN(CC1CC1)C(=O)c1cc(C)oc1CC
|
CCCC[C@H]C)NC=O)CCNCCCC3))))C=O)cccC)oc5CC
|
[C][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][O][C][=Ring1][=Branch1][C][C]
|
c17cc(C)oc18.CCCC[C@@H]4C.C2(=O)CC5.N356.C19CC1.C37=O.N24.C69.C8C
|
Cn1nnnc1CCCNC(=O)[C@H]1C[C@@](C)(NC(=O)CCCCCF)C1
|
Cnnnnc5CCCNC=O)[C@H]C[C@@]C)NC=O)CCCCCF))))))))C4
|
[C][N][N][=N][N][=C][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C@@][Branch1][C][C][Branch1][N][N][C][=Branch1][C][=O][C][C][C][C][C][F][C][Ring1][=C]
|
C3(=O)CCCCCF.Cn1nnnc17.[C@H]16C[C@]5(C)C1.C7CC4.C26=O.N24.N35
|
Cc1cc(C(=O)Nc2cccc(=N)[nH]2)nc(C(F)F)n1
|
CcccC=O)Nccccc=N)[nH]6))))))))ncCF)F))n6
|
[C][C][=C][C][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][C][=N][NH1][Ring1][#Branch1][=N][C][Branch1][=Branch1][C][Branch1][C][F][F][=N][Ring2][Ring1][Ring1]
|
Cc1cc5nc6n1.c14cccc(=N)[nH]1.C35=O.C6(F)F.N34
|
CCO[C@@H](CC(=O)N(C)[C@@H]1CCN(C(=O)c2cc(CO)c(C)o2)C1)C1=CCCC1
|
CCO[C@@H]CC=O)NC)[C@@H]CCNC=O)cccCO))cC)o5))))))C5))))))))C=CCCC5
|
[C][C][O][C@@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][O][=C][Branch1][C][C][O][Ring1][Branch2][C][Ring1][#C][C][=C][C][C][C][Ring1][Branch1]
|
[C@H]6(CC3=O)C1=CCCC1.c18cc9c(C)o1.[C@@H]17CCN4C1.N37C.C48=O.CC5.O56.C9O
|
C=C1CC[C@@H]1C(=O)N[C@@]1(C)CCN(C(=O)c2ccccc2NCC(F)(F)F)C1
|
C=CCC[C@@H]4C=O)N[C@@]C)CCNC=O)cccccc6NCCF)F)F)))))))))))C5
|
[C][=C][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C@@][Branch1][C][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][Ring2]
|
[C@]15(C)CCN4C1.c19ccccc17.C=C1CC[C@@H]18.C6C(F)(F)F.C38=O.C49=O.N35.N67
|
COC(=O)NCC(=O)N1CC[C@@H]2CCN(C(=O)c3coc4c3COC4)C[C@H]21
|
COC=O)NCC=O)NCC[C@@H]CCNC=O)ccocc5COC5)))))))))C[C@H]69
|
[C][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][C][O][C][Ring1][Branch1][C][C@H1][Ring1][S][Ring2][Ring1][Ring1]
|
N17CC[C@@H]2CCN8C[C@H]21.c1%10coc2c1COC2.C9C7=O.C56=O.C8%10=O.CO5.N69
|
C[C@@H](CCN1C(=O)c2ccccc2C1=O)S(=O)(=O)NCc1cc2ccccc2s1
|
C[C@@H]CCNC=O)cccccc6C9=O))))))))))))S=O)=O)NCcccccccc6s9
|
[C][C@@H1][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2]
|
N15C(=O)c2ccccc2C1=O.c16cc2ccccc2s1.C[C@@H](CC5)S4(=O)=O.N34.C36
|
O=C(CC1(N2CCCC2)CC1)N[C@H]1CCC[C@H]1NC(=O)CN=c1cc[nH]cc1
|
O=CCCNCCCC5)))))CC3))))N[C@H]CCC[C@H]5NC=O)CN=ccc[nH]cc6
|
[O][=C][Branch1][S][C][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][C][Ring1][Branch2][N][C@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][=C][C][=C][NH1][C][=C][Ring1][=Branch1]
|
C4(=O)CN=c1cc[nH]cc1.[C@H]16CCC[C@H]17.N15CCCC1.O=C3C8.C158CC1.N36.N47
|
CC[C@]1(C(=O)N2CCC[C@@H](CNC(=O)C#CC3CC(F)(F)C3)C2)CC[C@@H](O)CC1
|
CC[C@]C=O)NCCC[C@@H]CNC=O)C#CCCCF)F)C4)))))))))C6)))))))CC[C@@H]O)CC6
|
[C][C][C@][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][#C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][Ring2][Ring1][C][C][C][C@@H1][Branch1][C][O][C][C][Ring2][Ring1][O]
|
C5(=O)C#CC1CC(F)(F)C1.[C@]178CC[C@@H](O)CC1.N14CCC[C@@H]9C1.C47=O.CC8.C69.N56
|
CO[C@@]1(C(=O)N2CC(N(C)C(=O)COCc3ncnn3C)C2)CCSC1
|
CO[C@@]C=O)NCCNC)C=O)COCcncnn5C)))))))))))C4)))))CCSC5
|
[C][O][C@@][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][C][=N][C][=N][N][Ring1][Branch1][C][C][Ring1][P][C][C][S][C][Ring2][Ring1][Branch2]
|
[C@]16%10CCSC1.c1%11ncnn1C.N14CC9C1.C5(=O)C7.C4%10=O.N59C.CO6.O78.C8%11
|
CC(C)CCCCN(C)C(=O)CC1(CNC(=O)C2(C#N)C[C@@H]3C[C@H]3C2)CC1
|
CCC)CCCCNC)C=O)CCCNC=O)CC#N))C[C@@H]C[C@H]3C6)))))))))CC3
|
[C][C][Branch1][C][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C@@H1][C][C@H1][Ring1][Ring1][C][Ring1][Branch2][C][C][Ring1][#C]
|
C18(C#N)C[C@@H]2C[C@H]2C1.CC(C)CCCC6.C4(=O)C9.C19%10CC1.N46C.C58=O.C7%10.N57
|
CC[C@@H](O)C(=O)N(C)C[C@@H](C)N(C)C(=O)Cc1ccc2c(c1)NC(=O)C2
|
CC[C@@H]O)C=O)NC)C[C@@H]C)NC)C=O)Ccccccc6)NC=O)C5
|
[C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Ring1][#Branch1]
|
c17ccc2c(c1)NC(=O)C2.CC[C@@H](O)C3=O.C5[C@H]6C.C4(=O)C7.N35C.N46C
|
Cc1ccn(C)c1C(=O)N[C@H]1CC[C@@H](C(=O)N2Cc3cccc(F)c3C2)C1
|
CcccnC)c5C=O)N[C@H]CC[C@@H]C=O)NCcccccF)c6C9))))))))))C5
|
[C][C][C][=C][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring1][#Branch2][C][Ring1][P]
|
N15Cc2cccc(F)c2C1.Cc1ccn(C)c17.[C@H]16CC[C@@H]8C1.C47=O.C58=O.N46
|
CO[C@H](CC1CC(F)(F)C1)C(=O)NC[C@@H](C)CC(F)F
|
CO[C@H]CCCCF)F)C4)))))C=O)NC[C@@H]C)CCF)F
|
[C][O][C@H1][Branch1][=C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C][Branch1][C][F][F]
|
C4[C@@H](C)CC(F)F.[C@@H]3(C5)C2=O.C15CC(F)(F)C1.CO3.N24
|
C[C@@H](NC(=O)c1c[nH]cc1C1CC1)[C@H]1CCN(C(=O)Cc2coc(C(F)F)n2)C1
|
C[C@@H]NC=O)cc[nH]cc5CCC3))))))))))[C@H]CCNC=O)CccocCF)F))n5)))))))C5
|
[C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][NH1][C][=C][Ring1][Branch1][C][C][C][Ring1][Ring1][C@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][=C][O][C][Branch1][=Branch1][C][Branch1][C][F][F][=N][Ring1][Branch2][C][Ring1][S]
|
c16c[nH]cc1%10.[C@H]19CCN4C1.c17coc8n1.C4(=O)C7.C[C@@H]59.C36=O.C1%10CC1.C8(F)F.N35
|
CCCc1ccc(CC(=O)NC[C@@H](C)CNC(=O)C2CCC(C)(O)CC2)cc1
|
CCCccccCC=O)NC[C@@H]C)CNC=O)CCCCC)O)CC6))))))))))))))cc6
|
[C][C][C][C][=C][C][=C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][Branch1][C][O][C][C][Ring1][Branch2][C][=C][Ring2][Ring1][=Branch2]
|
C17CCC(C)(O)CC1.c18ccc9cc1.C5[C@@H](C)C6.C9C3=O.CCC8.C47=O.N35.N46
|
CCCCC(=O)N1CSC[C@@H]1C(=O)N1C[C@H](O)[C@H](NC(=O)c2c(C)nsc2C)C1
|
CCCCC=O)NCSC[C@@H]5C=O)NC[C@H]O)[C@H]NC=O)ccC)nsc5C))))))))C5
|
[C][C][C][C][C][=Branch1][C][=O][N][C][S][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][S][C][=Ring1][=Branch1][C][C][Ring1][S]
|
N14C[C@@H]6[C@@H](O)C1.c18c(C)nsc1C.CCCCC3=O.N13CSC[C@@H]17.C47=O.C58=O.N56
|
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCC[C@H](C3CC3)C2)c1
|
CC=O)NcccccCC=O)N[C@@H]CCC[C@H]CCC3)))C6)))))))))c6
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=Branch2][=C][Ring2][Ring1][Ring1]
|
[C@@H]17CCC[C@H](C2CC2)C1.c16cccc8c1.C8C5=O.CC4=O.N46.N57
|
CC(C)[C@H]1CC[C@H](C(=O)NCc2ccc(Cl)o2)N1C(=O)c1cccnn1
|
CCC)[C@H]CC[C@H]C=O)NCccccCl)o5))))))))N5C=O)ccccnn6
|
[C][C][Branch1][C][C][C@H1][C][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][Cl][O][Ring1][=Branch1][N][Ring1][#C][C][=Branch1][C][=O][C][=C][C][=C][N][=N][Ring1][=Branch1]
|
[C@H]18CC[C@H]6N14.c19ccc(Cl)o1.c17cccnn1.CC8C.C36=O.C47=O.N35.C59
|
CCn1nc(C)cc1C(=O)NC1CC2(CCN(C(=O)C[C@H]3CCCOC3)CC2)C1
|
CCnncC)cc5C=O)NCCCCCNC=O)C[C@H]CCCOC6))))))))CC6)))))C4
|
[C][C][N][N][=C][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C]
|
C16CC2(CCN5CC2)C1.n18nc(C)cc17.[C@H]19CCCOC1.C5(=O)C9.C47=O.CC8.N46
|
CC[C@]1(O)CCN(C(=O)C[C@@H](NC(=O)c2cc(Cl)no2)C(F)(F)F)C1
|
CC[C@]O)CCNC=O)C[C@@H]NC=O)cccCl)no5)))))))CF)F)F)))))C5
|
[C][C][C@][Branch1][C][O][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][O][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][#Branch1]
|
C3(=O)C[C@@H]5C(F)(F)F.[C@@]17(O)CCN3C1.c16cc(Cl)no1.C46=O.CC7.N45
|
O=C(C[C@H](O)c1ccccc1)N[C@H]1C[C@@H](F)CN(C(=O)c2ccc(C(F)F)o2)C1
|
O=CC[C@H]O)cccccc6))))))))N[C@H]C[C@@H]F)CNC=O)ccccCF)F))o5))))))C6
|
[O][=C][Branch1][=C][C][C@H1][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C@H1][C][C@@H1][Branch1][C][F][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][F][F][O][Ring1][Branch2][C][Ring1][P]
|
[C@H]15C[C@@H](F)CN4C1.O=C3C[C@@H]8O.c18ccccc1.c16ccc7o1.C46=O.C7(F)F.N35
|
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NC[C@H](O)CNC(N)=O)C1=O
|
C[C@@]CCC3)))NC=O)NCC=O)NC[C@H]O)CNCN)=O)))))))))C5=O
|
[C][C@@][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][C][Branch1][C][N][=O][C][Ring2][Ring1][Branch1][=O]
|
C[C@@]18NC(=O)N7C1=O.C5[C@H](O)C6.C7C3=O.C18CC1.C4(N)=O.N35.N46
|
CN(C)CCC1(C(=O)N[C@H]2CN(C(=O)c3ccc(Cl)o3)CC[C@H]2C(F)(F)F)CC1
|
CNC)CCCC=O)N[C@H]CNC=O)ccccCl)o5))))))CC[C@H]6CF)F)F))))))))))CC3
|
[C][N][Branch1][C][C][C][C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][O][Ring1][=Branch1][C][C][C@H1][Ring1][=C][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring2][Ring1][Branch2]
|
[C@H]17CN5CC[C@H]1%11.c18ccc(Cl)o1.C19%10CC1.C%11(F)(F)F.CN6C.C6C%10.C49=O.C58=O.N47
|
C=C=CCC(=O)N1CCC[C@H]([C@@H](C)C(=O)NCC2(C)CC3(CC3)C2)C1
|
C=C=CCC=O)NCCC[C@H][C@@H]C)C=O)NCCC)CCCC3))C4))))))))C6
|
[C][=C][=C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][#Branch2][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
N14CCC[C@H]7C1.C18(C)CC2(CC2)C1.C=C=CCC4=O.[C@H]7(C)C5=O.N56.C68
|
CC[C@@]1(C(=O)NOCC(F)(F)F)CCCN(C(=O)[C@@H](CC2CC2)OC)C1
|
CC[C@@]C=O)NOCCF)F)F))))))CCCNC=O)[C@@H]CCCC3))))OC))))C6
|
[C][C][C@@][Branch1][S][C][=Branch1][C][=O][N][O][C][C][Branch1][C][F][Branch1][C][F][F][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][O][C][C][Ring2][Ring1][Branch2]
|
[C@@]167CCCN3C1.C3(=O)[C@H]5C8.C6(=O)NO4.C4C(F)(F)F.C18CC1.CC7.O5C
|
CC(C)OCC(C)(C)C(=O)N1CCC[C@@H]1CNC(=O)c1coc(C2CC2)n1
|
CCC)OCCC)C)C=O)NCCC[C@@H]5CNC=O)ccocCCC3)))n5
|
[C][C][Branch1][C][C][O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][Branch2]
|
C6C(C)(C)C3=O.N13CCC[C@@H]19.c18coc%10n1.CC5C.C48=O.C1%10CC1.O56.C79.N47
|
COc1ccc([C@H](C)C(=O)NC2(C)CN(C(=O)CCN3CCC(C)CC3)C2)cc1
|
COcccc[C@H]C)C=O)NCC)CNC=O)CCNCCCC)CC6)))))))))C4)))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][N][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring1][S][C][=C][Ring2][Ring1][O]
|
c16ccc9cc1.N18CCC(C)CC1.C17(C)CN5C1.[C@@H]9(C)C4=O.C5(=O)CC8.CO6.N47
|
Cc1ncc(CO)c(CNCc2cnc(C(C)C)n2C)c1O
|
CcnccCO))cCNCccncCC)C))n5C)))))))))c6O
|
[C][C][=N][C][=C][Branch1][Ring1][C][O][C][Branch2][Ring1][Ring1][C][N][C][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][N][Ring1][Branch2][C][=C][Ring2][Ring1][Ring2][O]
|
Cc1ncc7c8c1O.c15cnc6n1C.C6(C)C.C7O.C38.N34.C45
|
C[C@@H]1CC[C@@H](CNC(=O)C23CC4C[C@@H]2[C@@H]3C4)N(C(=O)c2cocn2)C1
|
C[C@@H]CC[C@@H]CNC=O)CCCC[C@@H]5[C@@H]6C5))))))))))NC=O)ccocn5))))))C6
|
[C][C@@H1][C][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][C][C@@H1][Ring1][Branch1][C@@H1][Ring1][=Branch1][C][Ring1][Branch1][N][Branch1][N][C][=Branch1][C][=O][C][=C][O][C][=N][Ring1][Branch1][C][Ring2][Ring1][Branch2]
|
C[C@@H]1CC[C@@H]%10N6C1.C129CC3C[C@@H]1[C@@H]2C3.c18cocn1.C59=O.C68=O.C7%10.N57
|
CN1CCOC[C@H]1C(=O)NCCCOCCNC(=O)c1n[nH]c2c1C[C@H]1C[C@@H]21
|
CNCCOC[C@H]6C=O)NCCCOCCNC=O)cn[nH]cc5C[C@H]C[C@@H]63
|
[C][N][C][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][O][C][C][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][C@H1][C][C@@H1][Ring1][=Branch1][Ring1][Ring1]
|
c1%10n[nH]c2c1C[C@H]1C[C@@H]21.CN1CCOC[C@H]19.C7CC5.C39=O.C6C8.C4%10=O.N37.O56.N48
|
Cc1ccc(Oc2ccc(NC(=O)NCc3c(Br)cnn3C)cc2)cn1
|
CccccOccccNC=O)NCccBr)cnn5C))))))))))cc6)))))))cn6
|
[C][C][=C][C][=C][Branch2][Ring1][S][O][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][N][C][C][=C][Branch1][C][Br][C][=N][N][Ring1][=Branch1][C][C][=C][Ring2][Ring1][C][C][=N][Ring2][Ring1][=Branch2]
|
Cc1ccc6cn1.c17ccc9cc1.c1%10c(Br)cnn1C.C45=O.O67.N49.N58.C8%10
|
CCC[C@@H]1CN(C(=O)C2(CC)CC2)CCN1C(=O)[C@@H](O)C(F)F
|
CCC[C@@H]CNC=O)CCC))CC3))))CCN6C=O)[C@@H]O)CF)F
|
[C][C][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][Branch1][Ring1][C][C][C][C][Ring1][Branch1][C][C][N][Ring1][=N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][Branch1][C][F][F]
|
[C@@H]16CN3CCN14.C4(=O)[C@@H](O)C(F)F.C157CC1.CCC6.C35=O.C7C
|
O=C(NCc1cnc(Br)s1)C1=NO[C@]2(CCN(C(=O)CCc3cnc[nH]3)C2)C1
|
O=CNCccncBr)s5)))))))C=NO[C@]CCNC=O)CCccnc[nH]5))))))))C5))))C5
|
[O][=C][Branch1][=N][N][C][C][=C][N][=C][Branch1][C][Br][S][Ring1][=Branch1][C][=N][O][C@][Branch2][Ring1][=Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][=C][N][=C][NH1][Ring1][Branch1][C][Ring1][=C][C][Ring2][Ring1][C]
|
O=C4C1=NO[C@]2(CCN5C2)C1.c17cnc(Br)s1.C5(=O)CC8.c18cnc[nH]1.N46.C67
|
Cc1ncn(O)c1C(=O)N[C@H](C)[C@H](NC(=O)CSCC(F)(F)F)C1CCCCC1
|
CcncnO)c5C=O)N[C@H]C)[C@H]NC=O)CSCCF)F)F)))))))CCCCCC6
|
[C][C][N][=C][N][Branch1][C][O][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][S][C][C][Branch1][C][F][Branch1][C][F][F][C][C][C][C][C][C][Ring1][=Branch1]
|
Cc1ncn(O)c18.C19CCCCC1.[C@@H]4(C)[C@H]59.C7C(F)(F)F.C3(=O)C6.C28=O.N24.N35.S67
|
CC(C)COC[C@H](O)CN1C[C@@H]2CN(C(=O)c3cc[nH]n3)C[C@@H]2C1
|
CCC)COC[C@H]O)CNC[C@@H]CNC=O)ccc[nH]n5))))))C[C@@H]5C8
|
[C][C][Branch1][C][C][C][O][C][C@H1][Branch1][C][O][C][N][C][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][NH1][N][=Ring1][Branch1][C][C@@H1][Ring1][N][C][Ring1][#C]
|
N17C[C@H]2CN4C[C@H]2C1.C6[C@H](O)C7.c18cc[nH]n1.CC(C)C5.C48=O.O56
|
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](NC(=O)Cc2nnc(S)n2C)[C@H](O)C1
|
Cncc[N+]=O)[O-]))cc5C=O)NCC[C@@H]NC=O)CcnncS)n5C)))))))))[C@H]O)C6
|
[C][N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=N][N][=C][Branch1][C][S][N][Ring1][=Branch1][C][C@H1][Branch1][C][O][C][Ring2][Ring1][C]
|
Cn1cc([N+](=O)[O-])cc16.N13CC[C@@H]5[C@H](O)C1.c17nnc(S)n1C.C4(=O)C7.C36=O.N45
|
CCC[C@@H](NC(C)=O)C(=O)NC[C@@]1(C)CCN(C(=O)c2cc(O)n(C)n2)C1
|
CCC[C@@H]NCC)=O)))C=O)NC[C@@]C)CCNC=O)cccO)nC)n5))))))C5
|
[C][C][C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][Branch1][C][O][N][Branch1][C][C][N][=Ring1][#Branch1][C][Ring1][#C]
|
CCC[C@@H]6C4=O.[C@]19(C)CCN5C1.c18cc(O)n(C)n1.C3(C)=O.C58=O.N36.N47.C79
|
Nc1c(-c2noc(C=CC3CC3)n2)cnn1-c1ccc(F)c(F)c1
|
Ncc-cnocC=CCCC3)))))n5)))))cnn5-ccccF)cF)c6
|
[N][C][=C][Branch1][P][C][=N][O][C][Branch1][Branch2][C][=C][C][C][C][Ring1][Ring1][=N][Ring1][#Branch2][C][=N][N][Ring1][#C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2]
|
c15ccc(F)c(F)c1.Nc1c6cnn15.c16noc(C=4)n1.C=4C1CC1
|
COC(=O)[C@@H]1CC[C@]1(C)C(=O)NC1CC(NC(=O)C(=O)N=c2cc(C)o[nH]2)C1
|
COC=O)[C@@H]CC[C@]4C)C=O)NCCCNC=O)C=O)N=cccC)o[nH]5)))))))))C4
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C][C@][Ring1][Ring2][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][=C][C][=C][Branch1][C][C][O][NH1][Ring1][=Branch1][C][Ring1][S]
|
C5(=O)C(=O)N=c1cc(C)o[nH]1.[C@@H]18CC[C@@]19C.C16CC7C1.C38=O.C49=O.CO3.N46.N57
|
Cc1ccc(C(=O)N2CCN(C(=O)Cc3cscn3)[C@@H](c3ccccn3)C2)cc1
|
CccccC=O)NCCNC=O)Cccscn5)))))))[C@@H]cccccn6))))))C6)))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][C][=N][Ring1][Branch1][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][N]
|
N14CCN5[C@@H]8C1.Cc1ccc6cc1.c18ccccn1.c17cscn1.C5(=O)C7.C46=O
|
COC(=O)C(C)(C)C1(NC(=O)c2cc3cc(C4CC4)ccc3[nH]2)CCC1
|
COC=O)CC)C)CNC=O)cccccCCC3)))ccc6[nH]9)))))))))))CCC4
|
[C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][C][=C][Ring1][=Branch2][NH1][Ring1][N][C][C][C][Ring2][Ring1][Ring1]
|
c18cc2cc%10ccc2[nH]1.C5(=O)C9(C)C.C179CCC1.C68=O.C1%10CC1.CO5.N67
|
CCC1=NO[C@@H](CC(=O)N[C@H]2CN(C(=O)Cc3cn(CC)nn3)C[C@H]2OC)C1
|
CCC=NO[C@@H]CC=O)N[C@H]CNC=O)CccnCC))nn5)))))))C[C@H]5OC))))))))))C5
|
[C][C][C][=N][O][C@@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring1][C][C][N][=N][Ring1][#Branch1][C][C@H1][Ring1][#C][O][C][C][Ring2][Ring1][#Branch2]
|
CCC1=NO[C@@H]9C1.[C@H]17CN5C[C@H]16.c1%10cn8nn1.C9C4=O.C5(=O)C%10.N47.C8C.O6C
|
Cc1nnccc1C(=O)N1C[C@@H]2CCC[C@H](NC(=O)c3nncn3C)[C@H]2C1
|
Ccnnccc6C=O)NC[C@@H]CCC[C@H]NC=O)cnncn5C))))))))[C@H]6C9
|
[C][C][=N][N][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=N][N][=C][N][Ring1][Branch1][C][C@H1][Ring1][#C][C][Ring2][Ring1][C]
|
N14C[C@@H]2CCC[C@H]6[C@H]2C1.Cc1nnccc18.c17nncn1C.C48=O.C57=O.N56
|
CC(C)[C@@H](NS(N)(=O)=O)C(=O)NC[C@@H]1CC(C)(C)CN1C(=O)CS(=O)(=O)C1CC1
|
CCC)[C@@H]NSN)=O)=O)))C=O)NC[C@@H]CCC)C)CN5C=O)CS=O)=O)CCC3
|
[C][C][Branch1][C][C][C@@H1][Branch1][#Branch2][N][S][Branch1][C][N][=Branch1][C][=O][=O][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch1][C][C][Branch1][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1]
|
C3(=O)CS(=O)(=O)C1CC1.[C@@H]16CC(C)(C)CN13.CC(C)[C@@H]4C2=O.N4S(N)(=O)=O.N25.C56
|
Cc1nn(C)cc1CCC(=O)NC(CNC(=O)CCC(C)(C)C)c1ccccc1
|
CcnnC)cc5CCC=O)NCCNC=O)CCCC)C)C)))))))cccccc6
|
[C][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C3(=O)CCC(C)(C)C.Cc1nn(C)cc16.c17ccccc1.C6CC2=O.C47C5.N24.N35
|
CSCC[C@H](O)C(=O)N[C@@H]1COC2(C1)CN(C(=O)CCNC(=O)OC(C)(C)C)C2
|
CSCC[C@H]O)C=O)N[C@@H]COCC5)CNC=O)CCNC=O)OCC)C)C))))))))C4
|
[C][S][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][P]
|
[C@@H]1%10COC2(C1)CN5C2.C9C[C@H](O)C4=O.C5(=O)CC8.C7(C)(C)C.C36=O.CS9.N4%10.N68.O37
|
CCC[C@@H](CC(C)C)C(=O)N(C)C[C@@H](C)N(C)C(=O)c1ccn2cncc2c1
|
CCC[C@@H]CCC)C)))C=O)NC)C[C@@H]C)NC)C=O)cccncncc5c9
|
[C][C][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][C][=N][C][=C][Ring1][Branch1][C][=Ring1][=Branch2]
|
CCC[C@@H](CC(C)C)C3=O.c17ccn2cncc2c1.C5[C@H]6C.N35C.N46C.C47=O
|
O=C(N[C@@H]1COC[C@@H]1NC(=O)c1cccnc1OC(F)F)c1cccc(Cl)c1
|
O=CN[C@@H]COC[C@@H]5NC=O)ccccnc6OCF)F)))))))))))))))))cccccCl)c6
|
[O][=C][Branch2][Ring1][N][N][C@@H1][C][O][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][Branch1][C][F][F][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]
|
c18cccnc14.c17cccc(Cl)c1.[C@@H]15COC[C@@H]16.O4C(F)F.O=C27.C38=O.N25.N36
|
C[C@@H](CNC(=O)C1(Cc2cccnc2)CC1)NC(=O)c1cncc2sccc12
|
C[C@@H]CNC=O)CCccccnc6)))))))CC3))))))NC=O)ccnccsccc95
|
[C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][N][=C][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
c18cncc2sccc12.c1%10cccnc1.C[C@H]5C6.C179CC1.C37=O.C48=O.N36.C9%10.N45
|
CC(C)(CO)c1cn(C[C@@H]2N(C(=O)CCCc3cccs3)CC2(C)C)nn1
|
CCC)CO))ccnC[C@@H]NC=O)CCCccccs5)))))))))CC4C)C))))))nn5
|
[C][C][Branch1][C][C][Branch1][Ring1][C][O][C][=C][N][Branch2][Ring1][N][C][C@@H1][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][=C][Branch1][C][C][C][N][=N][Ring2][Ring1][=Branch1]
|
[C@@H]16N4CC1(C)C.c17cn5nn1.C4(=O)CCC8.CC7(C)CO.c18cccs1.C56
|
CC[C@@]1(C(=O)NC2CC(CF)C2)CCCN1C(=O)Cc1ccccc1O
|
CC[C@@]C=O)NCCCCF))C4))))))CCCN5C=O)Ccccccc6O
|
[C][C][C@@][Branch1][S][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][F][C][Ring1][=Branch1][C][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O]
|
[C@@]167CCCN14.c19ccccc1O.C15CC8C1.C4(=O)C9.C36=O.CC7.N35.C8F
|
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