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ClC1=CC=CC(Cl)=C1NC1=NCC[NH2+]1.[Cl-] 100197
ClC1=C(C(C2=CC=CC=C2)(C2=CC=CC=C2)N2C=CN=C2)C=CC=C1 100201
O=C1CN(/N=C/C2=CC=C(C3=CC=C([N+](=O)[O-])C=C3)O2)C(=O)N1 100212
ClC1=CC2=C(C=C1)C(=C1CCNCC1)C1=C(C=CC=N1)CC2 100219
[H][C@@]12C[C@@]([H])(C)[C@H](C(=O)CO)[C@@]1(C)C[C@H](O)[C@]1(F)[C@@]3(C)C=CC(=O)C=C3CC[C@@]21[H] 100222
[H][C@@]12C[C@H](O)[C@@]3(C)C(=O)[C@H](O)C4=C(C)[C@@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C5=CC=CC=C5)C[C@@](O)([C@@H](OC(=O)C5=CC=CC=C5)[C@]3([H])[C@]1(OC(C)=O)CO2)C4(C)C 100245
COC1=C(OC)C=C2C(=O)C(CC3CCN(CC4=CC=CC=C4)CC3)CC2=C1 100248
CNC(=O)CN(CCN(CCN(CC(=O)[O-])CC(=O)NC)CC(=O)[O-])CC(=O)[O-].[Gd][Gd][Gd+] 100348
COC1=C(OCCCN2CCOCC2)C=C2C(=C1)N=CN=C2NC1=CC(Cl)=C(F)C=C1 100356
CC1=CC=CC(C)=C1OCC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](O)C[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C(C)C)N1CCCNC1=O 100437
CN(CC1=NC2=C(N)N=C(N)N=C2N=C1)C1=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C1 100465
[H][C@@]12C[C@]3([H])CC4=C(C(O)=CC=C4N(C)C)C(O)=C3C(=O)[C@]1(O)C(=O)/C(=C(/N)O)C(=O)C2N(C)C 100482
O=C(NCCN1CCOCC1)C1=CC=C(Cl)C=C1 100489
CC1=CC2=C(NC3=C(C=CC=C3)N=C2N2CCN(C)CC2)S1 100537
CC1=NC=C(C2=NC=C(Cl)C=C2C2=CC=C(S(C)(=O)=O)C=C2)C=C1 100556
O=C(O)CCN1C2=C(C=CC=C2)C2=C1CC[C@@H](NS(=O)(=O)C1=CC=C(F)C=C1)C2 100608
CC1=C(C)C(=O)C(C(CCCCCC(=O)O)C2=CC=CC=C2)=C(C)C1=O 100636
CC(C)C1=C(/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-])C(C2=CC=C(F)C=C2)=NC(N(C)S(C)(=O)=O)=N1.CC(C)C1=C(/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-])C(C2=CC=C(F)C=C2)=NC(N(C)S(C)(=O)=O)=N1.[Ca+2] 100753
NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(=O)O)C(=O)N1CCC[C@H]1C(=O)O.O.O 100769
CC1=C(CN2CCC3=C(C2=O)C2=CC=CC=C2N3C)NC=N1.Cl 100772
COC1=C(OCC2CCN(C)CC2)C=C2N=CN=C(NC3=C(F)C=C(Br)C=C3)C2=C1 100787
CC1=CC=C(S(=O)(=O)[O-])C=C1.CCOCC(O)COC1=CC=C(NC(=O)CC[S+](C)C)C=C1 100811
O=C1C[C@H](O)CN1 100824
[H][C@@]12CC[C@@]3([H])NC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](C(=O)NC(C)(C)C)CC[C@@]21[H] 100841
[H][C@@]12CC[C@]3([H])C[C@H](O)CC[C@]3(C)C1C[C@H](O)[C@@]1(C)C2CC[C@@H]1[C@H](C)CCC(=O)[O-].[Na+] 100869
Cl.O=C(C1=CC=C(OCCN2CCCCC2)C=C1)C1=C(C2=CC=C(O)C=C2)SC2=C1C=CC(O)=C2 100879
[H][C@@]12C[C@H](O)CC[C@]1(C)C1C[C@H](O)[C@]3(C)C([C@H](C)CCC(=O)O)CCC3[C@]1([H])[C@H](O)C2 100882
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]1CCC2=O 100968
COC1=CC=CC([C@]2(O)CCCCC2C[NH+](C)C)=C1.[Cl-] 100970
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSC3=NC(=O)C(=O)NN3C)CS[C@H]12)C1=CSC(N)=N1 100972
CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C 100974
CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C 100975
[H][C@@]12CC[C@H](OC(=O)CCCCCC)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CCC(=O)C=C3CC[C@@]21[H] 100977
CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)[C@H](N)C3=CC=C(O)C=C3)[C@H]2SC1.O 100978
CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC=C(C(C)=O)[C@@]4(C)CC[C@@H]32)C1 100979
CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)C3=CC=CC=C3)C(=O)N2[C@H]1C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C.CC1=CC=C(S(=O)(=O)O)C=C1 100980
CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 100981
CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]32)C1 100982
CC1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C 100983
CC(=O)C1=CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 100984
CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C 100986
CC1=C(Br)C(O)=C(C(C)C)C=C1C1(C2=C(C)C(Br)=C(O)C(C(C)C)=C2)OS(=O)(=O)C2=CC=CC=C21 100987
[H][C@]12[C@@H](O)C[C@@]3(C)[C@@H](CC[C@]3(OC(=O)CCCC)C(=O)CO)[C@@H]1CCC1=CC(=O)CC[C@@]12C 100989
CCN1CCN(C(=O)N[C@@H](C(=O)N[C@@H]2C(=O)N3C(C(=O)[O-])=C(CSC4=NN=NN4C)CS[C@H]23)C2=CC=C(O)C=C2)C(=O)C1=O.[Na+] 100993
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSC3=NC(=O)C(=O)NN3C)CS[C@H]12)C1=CSC(N)=N1.[Na+] 100995
CC1(C)S[C@@H]2[C@H](NC(=O)CC3=CC=CC=C3)C(=O)N2[C@H]1C(=O)O 100997
C[C@]12CC[C@H]3[C@@H](C(=O)C=C4C[C@@H](O)CC[C@@]43C)[C@@H]1CCC2=O 100998
CC(=O)O[C@H]1CC[C@@]2(C)C(=CC(=O)[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]32)C1 100999
O=C1CCC(N2C(=O)C3=CC=CC=C3C2=O)C(=O)N1 101000
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)C1=CSC(N)=N1 101001
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(COC(N)=O)CS[C@H]12)C1=CC=CO1.[Na+] 101003
CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)C[C@H](CCl)[C@]4(C)[C@H]3CC[C@@]21C 101004
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@@]43C)[C@@H]1CCC2=O 101005
CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C 101006
CC(C)CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C 101007
[H][C@]12[C@@H](O)C[C@@]3(C)[C@@H](CC[C@]3(O)C(=O)COC(C)=O)[C@@H]1CCC1=CC(=O)CC[C@@]12C 101009
CCCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C 101010
COC1=CC=C(COC(=O)C2N3C(=O)C(NC(=O)CC4=CC=CC=C4)C3S(=O)C2(C)C)C=C1 101012
CC(=O)[C@@]12O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]12C 101013
CC1(C)SC2[C@H](NC(=O)C(C(=O)O)C3=CC=CC=C3)C(=O)N2[C@H]1C(=O)O 101017
O=[N+]([O-])C1=C(Cl)N=C(Cl)C(CCl)=C1 200215
CC1=NC=C(Cl)C(Cl)=C1Cl 201005
CC1=NC=CC(N)=C1 201006
CC1=[N+]([O-])C=CC([N+](=O)[O-])=C1 201007
CC1=C2N=C(Cl)SC2=CC=C1 201043
CC1=C2N=C(Br)SC2=CC=C1 201044
CC1=CC=C2N=C(Cl)SC2=C1 201045
CC1=CC=C2N=C(Br)SC2=C1 201046
CC1=CC=C2N=C(O)SC2=C1 201047
ClC1=NC2=C(Cl)C=CC=C2S1 201048
ClC1=C2N=C(Br)SC2=CC=C1 201049
OC1=NC2=C(Cl)C=CC=C2S1 201050
ClC1=CC=C2N=C(Cl)SC2=C1 201051
ClC1=CC=C2N=C(Br)SC2=C1 201052
OC1=NC2=CC=C(Cl)C=C2S1 201053
ClC1=NC2=C(Br)C=CC=C2S1 201054
BrC1=NC2=C(Br)C=CC=C2S1 201055
OC1=NC2=C(Br)C=CC=C2S1 201056
ClC1=NC2=CC=C(Br)C=C2S1 201057
BrC1=CC=C2N=C(Br)SC2=C1 201058
OC1=NC2=CC=C(Br)C=C2S1 201059
FC1=C2N=C(Cl)SC2=CC=C1 201061
FC1=C2N=C(Br)SC2=CC=C1 201062
OC1=NC2=C(F)C=CC=C2S1 201063
FC1=CC=C2N=C(Cl)SC2=C1 201064
FC1=CC=C2N=C(Br)SC2=C1 201065
OC1=NC2=CC=C(F)C=C2S1 201066
FC(F)(F)C1=C2N=C(Cl)SC2=CC=C1 201068
FC(F)(F)C1=C2N=C(Br)SC2=CC=C1 201069
OC1=NC2=C(C(F)(F)F)C=CC=C2S1 201070
NC1=NC2=C(C(F)(F)F)C=CC=C2S1 201071
FC(F)(F)C1=CC=C2N=C(Cl)SC2=C1 201072
FC(F)(F)C1=CC=C2N=C(Br)SC2=C1 201073
OC1=NC2=CC=C(C(F)(F)F)C=C2S1 201074
NC1=NC2=CC=C(C(F)(F)F)C=C2S1 201075
O=[N+]([O-])C1=CC=C2N=C(Cl)SC2=C1 201077
O=[N+]([O-])C1=CC=C2N=C(Br)SC2=C1 201078
COC1=C2N=C(Cl)SC2=CC=C1 201079
COC1=C2N=C(O)SC2=CC=C1 201080
COC1=CC=C2N=C(Cl)SC2=C1 201081
COC1=CC=C2N=C(Br)SC2=C1 201082
COC1=CC=C2N=C(O)SC2=C1 201083
CCOC1=CC=C2N=C(Cl)SC2=C1 201084
CCOC1=CC=C2N=C(Br)SC2=C1 201085
CCOC1=CC=C2N=C(O)SC2=C1 201086
CC(C)(C)C1=CC=C2N=C(Cl)SC2=C1 201088
CC(C)(C)C1=CC=C2N=C(Br)SC2=C1 201089
CC(C)(C)C1=CC=C2N=C(O)SC2=C1 201090
NC1=NC2=CC(Br)=CC=C2S1 201101
ClC1=NC2=CC(Br)=CC=C2S1 201102
NC1=NC2=CC=CC(Br)=C2S1 201103
BrC1=NC2=CC=CC(Br)=C2S1 201104
NC1=NC2=CC(Cl)=CC=C2S1 201105
ClC1=CC=C2SC(Cl)=NC2=C1 201106
ClC1=CC=C2SC(Br)=NC2=C1 201107
NC1=NC2=CC=CC(Cl)=C2S1 201108
ClC1=NC2=CC=CC(Cl)=C2S1 201109
ClC1=C2SC(Br)=NC2=CC=C1 201110
NC1=NC2=CC(F)=CC=C2S1 201111
NC1=NC2=CC=CC(F)=C2S1 201112
CC1=CC(C)=C2N=C(Cl)SC2=C1 201116
CC1=CC(C)=C2N=C(Br)SC2=C1 201117
CC1=C2N=C(Cl)SC2=C(C)C=C1 201118
CC1=C2N=C(Br)SC2=C(C)C=C1 201119
ClC1=CC=C2SC(Cl)=NC2=C1Cl 201120
ClC1=CC=C2SC(Br)=NC2=C1Cl 201121
ClC1=CC(Cl)=C2N=C(Cl)SC2=C1 201122
ClC1=CC(Cl)=C2SC(Cl)=NC2=C1 201123
ClC1=CC(Cl)=C2SC(Br)=NC2=C1 201124
NC1=NC2=C(F)C=C(F)C=C2S1 201125
FC1=CC(F)=C2N=C(Cl)SC2=C1 201126
NC1=NC2=CC(F)=CC(F)=C2S1 201127
FC1=CC(F)=C2SC(Br)=NC2=C1 201128
CC1=NC=CC(N)=C1Cl 201142
CC1=NC=C(Br)C(N)=C1Br 201143
CC1=[N+]([O-])C=C(Cl)C([N+](=O)[O-])=C1 201144
CC1=NC=C(N)C=C1 201145
CC1=NC=C(Cl)C=C1 201146
CC1=NC=C(Cl)C(N)=C1 201147
CC1=NC=C(Cl)C(Cl)=C1 201150
CC1=NC=C(Cl)C(N)=C1Cl 201151
CC1=NC=CC(Cl)=C1Cl 201152
CC1=NC=CC(N)=C1Br 201153
NC1=NC2=C(C=CN2)C(=O)N1 201164
C=CCCC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201167
[N-]=[N+]=NC1=NC2=C(N=CN=C2N)N1[C@@H]1O[C@H](CO)[C@H](O)C1O 201183
NC1=NC=NC2=C1N=C(Br)N2[C@@H]1O[C@H](CO)[C@H](O)C1O 201184
O=C1C=CN([C@H]2CC[C@@H](CO)O2)C(=O)N1 201284
[N-]=[N+]=NC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=CC(=O)NC1=O 201288
COC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=NC2=C1N=CN=C2N 201289
NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](CCl)[C@H](O)C1O 201290
CC1=CN([C@H]2C[C@@H](O)[C@@H](CO)O2)C(=S)NC1=O 201294
O=C1C=CN([C@H]2C=C[C@@H](CO)O2)C(=O)N1 201297
COCCOC1[C@@H](O)[C@@H](COC(C2=CC=CC=C2)(C2=CC=C(OC)C=C2)C2=CC=C(OC)C=C2)O[C@H]1N1C=C(C)C(=O)NC1=O 201300
C=CC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201306
C=CC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201307
C=CCCC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201308
C=CCCCCCC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201309
C=CCCCCCC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201310
C=CCCCC(CCCC=C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201311
COCCOC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=C(C)C(=O)NC1=O 201314
COCCOC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=NC2=C1N=CN=C2N 201315
NC1=NC2=C(Cl)C=CC=C2S1 201326
NC1=NC2=C(Br)C=CC=C2S1 201327
CC1=CC(CO)=NO1 201328
O=C(O)C1=NOC(C2=CC=CC=C2)=C1 201329
OCC1=NOC(C2=CC=CC=C2)=C1 201330
NC1=NC2=C(F)C=CC=C2S1 201331
C=CCC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 201333
CC1=CC=C2N=C(N)SC2=C1 201334
CC1=NC=C(Br)C=C1 201345
BrC1=CC=C2SC(Br)=NC2=C1 201346
ClC1=NC2=CC=CC(Br)=C2S1 201347
CC1=[N+]([O-])C=C(Br)C([N+](=O)[O-])=C1 201369
CC1=CC=C([NH3+])C(S)=C1.[Cl-] 203554
NC1=CC=C(Cl)C=C1S 203555
[Cl-].[NH3+]C1=CC=C(Cl)C=C1S 203556
NC1=CC=C(Br)C=C1S 203557
[Cl-].[NH3+]C1=CC=C(Br)C=C1S 203558
NC1=CC=C(F)C=C1S 203559
[Cl-].[NH3+]C1=CC=C(F)C=C1S 203560
COC1=CC=C(N)C(S)=C1 203561
COC1=CC=C([NH3+])C(S)=C1.[Cl-] 203562
CCOC1=CC=C(N)C(S)=C1 203563
CCOC1=CC=C([NH3+])C(S)=C1.[Cl-] 203564
CC(C)(C)C1=CC=C(N)C(S)=C1 203567
CC(C)(C)C1=CC=C([NH3+])C(S)=C1.[Cl-] 203568
NC1=CC=CC(Cl)=C1S 203571
FC1=C2N=C(CCl)SC2=CC=C1 203587
[Cl-].[NH3+]C1=C(Cl)C=CC=C1S 203588
ClCC1=NC2=C(Br)C=CC=C2S1 203589
ClCC1=NC2=CC=CC=C2S1 203590
CC1=C2N=C(CCl)SC2=CC=C1 203591
FC(F)(F)C1=C2N=C(CCl)SC2=CC=C1 203592
COC1=C2N=C(CCl)SC2=CC=C1 203593
CCOC1=C2N=C(CCl)SC2=CC=C1 203594
CC1=CC=C2SC(CCl)=NC2=C1 203597
ClCC1=NC2=CC(Br)=CC=C2S1 203598
FC1=CC=C2SC(CCl)=NC2=C1 203599
COC1=CC=C2SC(CCl)=NC2=C1 203600
CCOC1=CC=C2SC(CCl)=NC2=C1 203601
[H][C@@]12CC(C)(C)CC[C@]1(C(=O)OC)CC[C@]1(C)C2=CCC2[C@@]3(C)CC/C(=N\O)C(C)(C)C3CC[C@]21C 202169
CC1=NC=C(Br)C(N)=C1 202272
CC1=NC=C(Br)C(Br)=C1 202274
CC1=NC=CC(Cl)=C1Br 202277
CCOC(=O)C1=C(C)N=C(C2=CC=CC=C2)C=C1 202300
CCOC(=O)C1=C(CC)N=C(C2=CC=CC=C2)C=C1 202301
CC1=NC(C)=C(C(=O)O)C=C1 202335
CC1=C(CBr)C=CC(C2=CC=CC=C2)=N1 202387
CC1=NC=C(Cl)C(Br)=C1Cl 202825
CC1=NC=CC(Br)=C1Br 202826
CC1=NC=C(Cl)C(N)=C1Br 202827
CC1=NC=C(Cl)C(Cl)=C1Br 202829
CCOC(=O)C1=C(C)N=C(C(C)(C)C)C=C1 202831
O=[N+]([O-])C1=C(Cl)C=[N+]([O-])C=C1 202834
FC1=CC=C2N=C(Br)SC2=C1F 203689
FC1=CC=C2N=C(Cl)SC2=C1F 203690
OC1=NC2=CC=C(F)C(F)=C2S1 203691
FC1=CC=C2N=CSC2=C1F 203692
FC1=CC=C2N=C(CCl)SC2=C1F 203693
NC1=CC=C(F)C(F)=C1S 203694
ClC1=C2N=CSC2=C(Cl)C=C1 203695
NC1=CC(Cl)=CC=C1SSC1=C(N)C=C(Cl)C=C1 203696
NC1=CC=CC(Cl)=C1SSC1=C(N)C=CC=C1Cl 203697
Cl.NC1=C(S)C=CC([N+](=O)[O-])=C1 203698
FC1=C(F)C=C2SC=NC2=C1 203701
FC(F)(F)C1=C2SC=NC2=CC=C1 203705
CC1=C([NH3+])C(S)=C(C)C=C1.[Cl-] 203706
ClC1=C(Cl)C=C2SC=NC2=C1 203708
ClC1=CC=C2N=CSC2=C1Cl 203710
ClCC1=NC2=C(Cl)C=CC=C2S1 203726
FC1=CC(F)=C2N=C(CCl)SC2=C1 203727
FC1=C2N=CSC2=C(F)C=C1 203728
FC1=C2N=C(CCl)SC2=C(F)C=C1 203729
FC1=C(F)C=C2SC(CCl)=NC2=C1 203730
FC1=CC(F)=C2SC(CCl)=NC2=C1 203731
ClCC1=NC2=C(Cl)C(Cl)=CC=C2S1 203732
ClCC1=NC2=C(Cl)C=C(Cl)C=C2S1 203733
ClCC1=NC2=C(Cl)C=CC(Cl)=C2S1 203734
ClCC1=NC2=CC(Cl)=C(Cl)C=C2S1 203735
ClCC1=NC2=CC(Cl)=CC(Cl)=C2S1 203736
CCOC(=O)C1=C(C2=CC=CC=C2)N=C(C)C=C1 202836
FC1=CC=C2SC(Cl)=NC2=C1 203132
FC1=CC=C2SC(Br)=NC2=C1 203133
OC1=NC2=CC(F)=CC=C2S1 203134
[Cl-].[NH3+]C1=CC=CC(Cl)=C1S 203141
COC1=CC=C2N=C(Cl)SC2=C1Cl 203143
OC1=NC2=CC(Br)=CC=C2S1 203144
CC1=C2N=C(O)SC2=CC=C1 203146
CC1=CC=C2SC(N)=NC2=C1 203148
CC1=CC=C2SC(Cl)=NC2=C1 203149
CC1=CC=C2SC(Br)=NC2=C1 203150
CC1=CC=C2SC(O)=NC2=C1 203151
NC1=NC2=CC(C(F)(F)F)=CC=C2S1 203154
FC(F)(F)C1=CC=C2SC(Cl)=NC2=C1 203155
FC(F)(F)C1=CC=C2SC(Br)=NC2=C1 203156
OC1=NC2=CC(C(F)(F)F)=CC=C2S1 203157
COC1=C2N=C(Br)SC2=CC=C1 203161
COC1=CC=C2SC(Cl)=NC2=C1 203162
COC1=CC=C2SC(Br)=NC2=C1 203163
COC1=CC=C2SC(O)=NC2=C1 203164
COC1=CC=C2N=C(N)SC2=C1 203166
COC1=CC=C2N=C(NN)SC2=C1 203167
CCOC1=C2N=C(N)SC2=CC=C1 203168
CCOC1=C2N=C(Cl)SC2=CC=C1 203169
CCOC1=C2N=C(Br)SC2=CC=C1 203170
CCOC1=C2N=C(O)SC2=CC=C1 203171
O=[N+]([O-])C1=CC=C2SC(Cl)=NC2=C1 203184
O=[N+]([O-])C1=CC=C2N=C(O)SC2=C1 203189
NC1=CC=C2N=C(N)SC2=C1 203201
NC1=CC=C2N=C(Cl)SC2=C1 203202
NC1=CC=C2N=C(Br)SC2=C1 203203
NC1=CC=C2N=C(O)SC2=C1 203204
FC1=CC(F)=C2N=C(Br)SC2=C1 203222
OC1=NC2=C(F)C=C(F)C=C2S1 203223
NC1=NC2=C(F)C=CC(F)=C2S1 203225
FC1=C2N=C(Cl)SC2=C(F)C=C1 203226
FC1=C2N=C(Br)SC2=C(F)C=C1 203227
OC1=NC2=C(F)C=CC(F)=C2S1 203228
NC1=NC2=CC(F)=C(F)C=C2S1 203230
FC1=C(F)C=C2SC(Cl)=NC2=C1 203231
FC1=C(F)C=C2SC(Br)=NC2=C1 203232
OC1=NC2=CC(F)=C(F)C=C2S1 203233
FC1=CC(F)=C2SC(Cl)=NC2=C1 203235
OC1=NC2=CC(F)=CC(F)=C2S1 203236
NC1=NC2=C(C=CC(Cl)=C2Cl)S1 203238
OC1=NC2=C(C=CC(Cl)=C2Cl)S1 203239
NC1=NC2=C(C=C(Cl)C=C2Cl)S1 203241
ClC1=CC2=C(N=C(Br)S2)C(Cl)=C1 203242
OC1=NC2=C(C=C(Cl)C=C2Cl)S1 203243
NC1=NC2=C(S1)C(Cl)=CC=C2Cl 203245
ClC1=CC=C(Cl)C2=C1N=C(Cl)S2 203246
ClC1=CC=C(Cl)C2=C1N=C(Br)S2 203247
OC1=NC2=C(S1)C(Cl)=CC=C2Cl 203248
NC1=NC2=C(C=C(Cl)C(Cl)=C2)S1 203250
ClC1=CC2=C(C=C1Cl)SC(Cl)=N2 203251
ClC1=CC2=C(C=C1Cl)SC(Br)=N2 203252
OC1=NC2=C(C=C(Cl)C(Cl)=C2)S1 203253
NC1=NC2=C(S1)C(Cl)=CC(Cl)=C2 203255
OC1=NC2=C(S1)C(Cl)=CC(Cl)=C2 203256
NC1=NC2=C(C=C(Br)C=C2Br)S1 203259
ClC1=NC2=C(C=C(Br)C=C2Br)S1 203260
BrC1=CC2=C(N=C(Br)S2)C(Br)=C1 203261
OC1=NC2=C(C=C(Br)C=C2Br)S1 203262
NC1=NC2=C(S1)C(Br)=CC=C2Br 203264
ClC1=NC2=C(S1)C(Br)=CC=C2Br 203265
BrC1=CC=C(Br)C2=C1N=C(Br)S2 203266
OC1=NC2=C(S1)C(Br)=CC=C2Br 203267
NC1=NC2=C(C=C(Br)C(Br)=C2)S1 203269
ClC1=NC2=C(C=C(Br)C(Br)=C2)S1 203270
BrC1=CC2=C(C=C1Br)SC(Br)=N2 203271
OC1=NC2=C(C=C(Br)C(Br)=C2)S1 203272
NC1=NC2=C(S1)C(Br)=CC(Br)=C2 203274
ClC1=NC2=C(S1)C(Br)=CC(Br)=C2 203275
BrC1=CC2=C(SC(Br)=N2)C(Br)=C1 203276
OC1=NC2=C(S1)C(Br)=CC(Br)=C2 203277
CC1=C(C)C2=C(C=C1)SC(N)=N2 203279
CC1=C(C)C2=C(C=C1)SC(Cl)=N2 203280
CC1=C(C)C2=C(C=C1)SC(Br)=N2 203281
CC1=C(C)C2=C(C=C1)SC(O)=N2 203282
CC1=CC2=C(N=C(O)S2)C(C)=C1 203284
CC1=CC=C(C)C2=C1N=C(N)S2 203286
CC1=CC=C(C)C2=C1N=C(O)S2 203287
CC1=CC2=C(C=C1C)SC(Cl)=N2 203290
CC1=CC2=C(C=C1C)SC(Br)=N2 203291
CC1=CC2=C(C=C1C)SC(O)=N2 203292
CC1=CC2=C(SC(N)=N2)C(C)=C1 203294
CC1=CC2=C(SC(Cl)=N2)C(C)=C1 203295
CC1=CC2=C(SC(Br)=N2)C(C)=C1 203296
CC1=CC2=C(SC(O)=N2)C(C)=C1 203297
CC1=C(C)C2=C(C=C1)N=C(N)S2 203299
CC1=C(C)C2=C(C=C1)N=C(Cl)S2 203300
CC1=C(C)C2=C(C=C1)N=C(Br)S2 203301
CC1=C(C)C2=C(C=C1)N=C(O)S2 203302
COC1=CC(Cl)=C(OC)C2=C1N=C(N)S2 203304
COC1=CC(Cl)=C(OC)C2=C1N=C(Br)S2 203305
COC1=CC(Cl)=C(OC)C2=C1N=C(O)S2 203306
ClC1=CC(Cl)=C(Cl)C2=C1N=C(Cl)S2 203308
ClC1=CC(Cl)=C(Cl)C2=C1N=C(Br)S2 203309
OC1=NC2=C(S1)C(Cl)=C(Cl)C=C2Cl 203310
ClC1=NC2=C(Br)C(Br)=CC=C2S1 203319
OC1=NC2=C(Br)C(Br)=CC=C2S1 203321
SC1=NC2=CC=CC(Cl)=C2S1 203323
ClC1=CC=C2SC=NC2=C1 203378
C#CC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204483
[H][C@@](N)(CCCN/C(=N/C)NC)C(=O)O 204484
[H][C@](CCCNC(=N)N(C)C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204486
CN(C)CCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204487
CC(C)CC(NCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O)=C1C(=O)CC(C)(C)CC1=O 204488
CN(C)C1=CC=CC2=C(S(=O)(=O)NCCCC[C@H](NC(=O)OCC3C4=C(C=CC=C4)C4=C3C=CC=C4)C(=O)O)C=CC=C12 204489
CN(C)C1=CC=C(/N=N/C2=CC=C(C(=O)NCCCC[C@H](NC(=O)OCC3C4=C(C=CC=C4)C4=C3C=CC=C4)C(=O)O)C=C2)C=C1 204492
[H][C@]12NC(=O)N[C@@]1([H])CS[C@H]2CCCCC(=O)NCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204493
CC1=CN(C2OC(CO)C(O)C2N=[N+]=[N-])C(=O)NC1=O 204495
ClCC1=NC2=CC(Cl)=CC=C2S1 203379
ClCC1=NC2=CC=CC(Cl)=C2S1 203381
ClC1=C2SC=NC2=CC=C1 203383
CC1=C(Br)C=C2SC(Br)=NC2=C1 203386
CC1=CC=C2SC(Br)=NC2=C1Br 203387
FC(F)(F)C1=C2SC(Br)=NC2=CC=C1 203388
FC1=CC(F)=C2SC=NC2=C1 203389
FC1=C2SC(Br)=NC2=CC=C1 203390
CCOC1=C2N=C(Br)SC2=C(Cl)C=C1 203392
CCOC1=NC2=C(C)C=CC=C2S1 203394
CCOC1=NC2=C(Br)C=CC=C2S1 203395
CCOC1=NC2=CC=C(C)C=C2S1 203396
COC1=CC=C2N=C(Cl)SC2=C1Br 203397
COC1=C2N=C(Br)SC2=C(Br)C=C1 203398
COC1=C2N=C(Cl)SC2=C(Br)C=C1 203399
NC1=NC2=CC=C(Cl)C(Cl)=C2S1 203400
COC1=C(Br)C=C2N=C(Cl)SC2=C1 203401
CCC1=CC=C2N=C(N)SC2=C1 203834
CC(C)(C)C1=CC=C2N=C(N)SC2=C1 203465
FC1=C2N=CSC2=CC=C1 203474
ClC1=C2N=CSC2=CC=C1 203475
BrC1=C2N=CSC2=CC=C1 203476
CC1=C2N=CSC2=CC=C1 203477
FC(F)(F)C1=C2N=CSC2=CC=C1 203478
COC1=C2N=CSC2=CC=C1 203479
CCOC1=C2N=CSC2=CC=C1 203480
CC(C)(C)C1=C2N=CSC2=CC=C1 203483
FC1=CC=C2SC=NC2=C1 203484
OC1=NC2=CC=CC(Cl)=C2S1 203485
BrC1=CC=C2SC=NC2=C1 203486
CC1=CC=C2SC=NC2=C1 203487
FC(F)(F)C1=CC=C2SC=NC2=C1 203488
COC1=CC=C2SC=NC2=C1 203489
CCOC1=CC=C2SC=NC2=C1 203490
CCC1=CC=C2SC=NC2=C1 203496
C=CC1=CC=C2SC=NC2=C1 203497
FC1=CC=C2N=CSC2=C1 203498
ClC1=CC=C2N=CSC2=C1 203499
CC1=CC=C2N=CSC2=C1 203501
FC(F)(F)C1=CC=C2N=CSC2=C1 203502
COC1=CC=C2N=CSC2=C1 203503
CCOC1=CC=C2N=CSC2=C1 203504
CCC1=CC=C2N=CSC2=C1 203505
COC(=O)C1=CC=C2N=CSC2=C1 203506
ClC1=CC=C2SC=NC2=C1Cl 203508
NC1=NC2=CC=CC(C(F)(F)F)=C2S1 203509
CC(C)(C)C1=CC=C2N=CSC2=C1 203511
BrC1=C2SC=NC2=CC=C1 203514
CC1=C(N)C(S)=CC=C1 203524
NC1=C(Cl)C=CC=C1S 203525
NC1=C(Br)C=CC=C1S 203526
NC1=C(F)C=CC=C1S 203527
COC1=C(N)C(S)=CC=C1 203528
CCOC1=C(N)C(S)=CC=C1 203529
CCOC1=C(NCl)C(S)=CC=C1 203530
COC1=C(NCl)C(S)=CC=C1 203531
NC1=C(C(F)(F)F)C=CC=C1S 203533
CC(C)(C)C1=C(N)C(S)=CC=C1 203534
CC1=CC=C(S)C(N)=C1 203537
CC1=CC=C(S)C([NH3+])=C1.[Cl-] 203538
[Cl-].[NH3+]C1=CC(Cl)=CC=C1S 203539
[Cl-].[NH3+]C1=CC(Br)=CC=C1S 203541
NC1=CC(Br)=CC=C1S 203542
[Cl-].[NH3+]C1=CC(F)=CC=C1S 203543
NC1=CC(F)=CC=C1S 203544
COC1=CC=C(S)C(N)=C1 203545
COC1=CC=C(S)C([NH3+])=C1.[Cl-] 203546
CCOC1=CC=C(S)C(N)=C1 203547
CCOC1=CC=C(S)C([NH3+])=C1.[Cl-] 203548
[Cl-].[NH3+]C1=CC(C(F)(F)F)=CC=C1S 203551
NC1=CC(C(F)(F)F)=CC=C1S 203552
CC1=CC=C(N)C(S)=C1 203553
COC1=CC=C2N=C(CCl)SC2=C1 203605
CCOC1=CC=C2N=C(CCl)SC2=C1 203606
ClCC1=NC2=CC=C(Br)C=C2S1 203608
FC1=CC=C2N=C(CCl)SC2=C1 203609
FC(F)(F)C1=CC=C2N=C(CCl)SC2=C1 203610
FC(F)(F)C1=C2SC(CCl)=NC2=CC=C1 203611
ClCC1=NC2=CC=CC(Br)=C2S1 203612
FC1=C2SC(CCl)=NC2=CC=C1 203613
CC1=C2SC(CCl)=NC2=CC=C1 203614
COC1=C2SC(CCl)=NC2=CC=C1 203615
CCOC1=C2SC(CCl)=NC2=CC=C1 203616
CC1=C2SC(N)=NC2=CC=C1 203669
ClCC1=NC2=CC=C(Cl)C=C2S1 203671
ClC1=CC=C2N=C(Cl)SC2=C1Cl 203672
O=C(O)C1=NOC(C2=CC=C(Br)C=C2)=C1 203673
CCOC(=O)C1=NOC(C2=CC=C(Br)C=C2)=C1 203674
OC1=NC2=CC=CC(Br)=C2S1 203676
COC1=CC=C2N=C(Br)SC2=C1Br 203677
CCC1=CC=C([NH3+])C(S)=C1.[Cl-] 203684
ClC1=CC(Cl)=C2N=CSC2=C1 203685
ClC1=CC(Cl)=C2SC=NC2=C1 203686
[Cl-].[NH3+]C1=C(F)C=CC=C1S 203687
NC1=NC2=CC=C(F)C(F)=C2S1 203688
OC1=NC2=CC=C(Cl)C(Cl)=C2S1 203737
ClCC1=NC2=CC=C(Cl)C(Cl)=C2S1 203738
CC1=CC=C2SC=NC2=C1C 203739
CC1=CC=C2SC(CCl)=NC2=C1C 203740
CC1=CC(C)=C2N=CSC2=C1 203741
CC1=CC(C)=C2N=C(CCl)SC2=C1 203742
CC1=C2N=CSC2=C(C)C=C1 203743
CC1=C2N=C(CCl)SC2=C(C)C=C1 203744
ClC1=CC=C2N=C(Br)SC2=C1Cl 203745
CC1=C2SC(Cl)=NC2=CC=C1 203746
CC1=C2SC(Br)=NC2=CC=C1 203747
CC1=C2SC(O)=NC2=CC=C1 203748
CC1=C2SC=NC2=CC=C1 203750
COC1=C2SC(N)=NC2=CC=C1 203751
COC1=C2SC(Cl)=NC2=CC=C1 203752
COC1=C2SC(Br)=NC2=CC=C1 203753
COC1=C2SC(O)=NC2=CC=C1 203754
COC1=C2SC=NC2=CC=C1 203756
CC(C)C[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)[C@@H](O)CC(=O)O 204648
CNC(=O)[C@@H](N)C(C)(C)C 204649
C[C@](N)(CC1=CC=CC=C1)C(=O)O 204651
C[C@@](N)(CC1=CC=CC=C1)C(=O)O 204652
C[C@@](CC1=CC=CC=C1)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204653
C[C@](CC1=CC=CC=C1)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204654
CC(C)(C)OC(=O)N[C@@](C)(CC1=CC=CC=C1)C(=O)O 204655
CC(C)(C)OC(=O)N[C@](C)(CC1=CC=CC=C1)C(=O)O 204656
CCCCCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204657
O=C(N[C@@H](CC1=CSC2=C1C=CC=C2)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204658
CC(C)C[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204659
CC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204660
CC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204661
CC[C@](C)(NC(=O)OC(C)(C)C)C(=O)O 204662
CC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)O 204663
CC[C@](C)(N)C(=O)O 204664
CC[C@@](C)(N)C(=O)O 204665
CC(C)(C)OC(=O)C[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204666
CC(C)(C)OC(=O)C[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204667
CC(C)(C)OC(=O)C[C@](C)(N)C(=O)O 204668
CC(C)(C)OC(=O)C[C@@](C)(N)C(=O)O 204669
C[C@@](CC(=O)O)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204670
C[C@](CC(N)=O)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204671
CC(C)(C)OC(=O)NCCCC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204672
CC(C)(C)OC(=O)NCCCC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204673
C[C@@](CC1=CC=CC=C1F)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204674
C[C@](CC1=CC=CC=C1F)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204675
C[C@](N)(CC1=CC=CC(F)=C1)C(=O)O 204676
C[C@@](N)(CC1=CC=CC(F)=C1)C(=O)O 204677
C[C@](N)(CC1=CC=C(F)C=C1)C(=O)O 204678
C[C@@](N)(CC1=CC=C(F)C=C1)C(=O)O 204679
C[C@](N)(CC1=CC=C(OC(F)(F)F)C=C1)C(=O)O 204680
C[C@@](N)(CC1=CC=C(OC(F)(F)F)C=C1)C(=O)O 204681
C[C@](N)(CC1=CC=CC=C1Br)C(=O)O 204682
C[C@@](N)(CC1=CC=CC=C1Br)C(=O)O 204683
C[C@](N)(CC1=CC=CC(Br)=C1)C(=O)O 204684
C[C@@](N)(CC1=CC=CC(Br)=C1)C(=O)O 204685
C[C@](N)(CC1=CC=C(Br)C=C1)C(=O)O 204686
C[C@@](N)(CC1=CC=C(Br)C=C1)C(=O)O 204687
C[C@](N)(CC1=CC=CC(I)=C1)C(=O)O 204688
C[C@@](N)(CC1=CC=CC(I)=C1)C(=O)O 204689
CC(C)(C)C1=CC=C2N=C(CCl)SC2=C1 203772
CCOC1=C2SC(N)=NC2=CC=C1 203780
CCOC1=C2SC(Cl)=NC2=CC=C1 203781
CCOC1=C2SC(Br)=NC2=CC=C1 203782
CCOC1=C2SC(O)=NC2=CC=C1 203783
FC1=CC=C2SC(CCl)=NC2=C1F 203786
BrC1=CC(Br)=C2N=CSC2=C1 203791
BrC1=CC(Br)=C2SC=NC2=C1 203797
NC1=NC2=CC=C(Br)C(Br)=C2S1 203799
CC1=C(C)C=C2SC=NC2=C1 203806
CC1=CC(C)=C2SC=NC2=C1 203808
CCC1=CC=C(N)C(S)=C1 203812
NC1=CC(Cl)=CC(Cl)=C1S 203813
NC1=C(Cl)C=C(Cl)C=C1S 203814
NC1=CC=C(Cl)C(Cl)=C1S 203815
NC1=CC(Cl)=C(Cl)C=C1S 203816
NC1=C(Cl)C(Cl)=CC=C1S 203817
NC1=C(Cl)C=CC(Cl)=C1S 203818
[Cl-].[NH3+]C1=C(Cl)C=CC(Cl)=C1S 203820
CC1=CC=CC2=C1N=C(N)S2 203821
CCOC(=O)CSC1=NC2=CC=CC(Cl)=C2S1 203822
CC1=CC=C2N=C(CCl)SC2=C1 203824
CC1=C2SC(S)=NC2=CC=C1 203825
CCC1=CC=C2N=C(CCl)SC2=C1 203828
CCOC(=O)C1=NOC(C2=CC(Br)=CC=C2)=C1 204003
O=C(O)C1=NOC(C2=CC=CC=C2Cl)=C1 204083
CCOC(=O)C1=NOC(C2=CC=C(Cl)C=C2)=C1 204094
CC1=CC=CC=C1C1=CC(CO)=NO1 204184
O=C(O)C1=NOC(C2=CC=C(Cl)C=C2Cl)=C1 204393
CN(CCCC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O)C(=O)OC(C)(C)C 204396
C[N+](C)(C)CCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O.[Cl-] 204397
C/N=C(\NC)NCCC[C@H](N)C(=O)O 204398
C/N=C(\NC)NCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204399
CN(C)C(=N)NCCC[C@H](N)C(=O)O 204400
CN(C)C(=N)NCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204401
NC(=O)[C@@H](CCC(=O)O)NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204404
C=CCCC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204406
C=CCCCCC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204407
CN/C(=N\CCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O)NS(=O)(=O)C1=C(C)C2=C(OC(C)(C)C2)C(C)=C1C 204409
CC(C)(C)OC(=O)CCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204410
CC(C)(C)OC(=O)CCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204411
[N-]=[N+]=NCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204413
C[C@@](CCCCN=[N+]=[N-])(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204415
C[C@@](CCCCCN=[N+]=[N-])(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204416
C[C@@](CCCCCCN=[N+]=[N-])(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204417
C#CC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204418
COC1=CC=C2C(CC(=O)NCCCC[C@H](NC(=O)OCC3C4=C(C=CC=C4)C4=C3C=CC=C4)C(=O)O)=CC(=O)OC2=C1 204419
CC1(C)OC2=C(C=C(C[C@H](NC(=O)OCC3C4=C(C=CC=C4)C4=C3C=CC=C4)C(=O)O)C=C2)O1 204420
COCCOC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=CC(=O)NC1=O 204421
COCCOC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=CC(N)=NC1=O 204422
COCCOC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=C(C)C(N)=NC1=O 204423
COCCOC1[C@@H](O)[C@@H](CO)O[C@H]1N1C=NC2=C1N=C(N)NC2=O 204424
COCCOC1[C@@H](O)[C@@H](COC(C2=CC=CC=C2)(C2=CC=C(OC)C=C2)C2=CC=C(OC)C=C2)O[C@H]1N1C=NC2=C1N=CN=C2NC(=O)C1=CC=CC=C1 204425
O=C1C=CN([C@@H]2O[C@@]3(CO)COC2[C@H]3O)C(=O)N1 204427
NC1=NC2=C(C=CN2)C(Cl)=N1 204431
C=CCC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204433
COC1=CC(OC)=C(CS)C(OC)=C1 204434
CSC1=CC(N)=NC=C1 204435
CCOC(=O)CC1=CC2=CC=CN=C2C=C1 204438
CCOC(=O)C(C)C1=CC2=CC=CN=C2C=C1 204439
CCOC(=O)CC1=CC2=CC(Br)=CN=C2C=C1 204440
O=C(O)CC1=CC2=CC(Br)=CN=C2C=C1 204441
OC1=CC=NC2=CC=C(Br)C=C12 204444
CNC1=CC=NC2=CC=C(Br)C=C21 204445
COC1=CC=NC2=CC=C(Br)C=C21 204446
O=C(O)C1=CC=C2C(=O)OC3(C4=CC=C(O)C=C4OC4=C3C=CC(O)=C4)C2=C1 204456
O=C1C=CC2=C(C3=CC=C(C(=O)ON4C(=O)CCC4=O)C=C3C(=O)O)C3=CC=C(O)C=C3OC2=C1 204458
O=C1C=CC2=C(C3=CC(C(=O)ON4C(=O)CCC4=O)=CC=C3C(=O)O)C3=CC=C(O)C=C3OC2=C1 204459
O=C1C=CC2=C(C3=CC=C(N=C=S)C=C3C(=O)O)C3=CC=C(O)C=C3OC2=C1 204460
C=CCCCC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204463
C=CCCCC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204464
C=CCCCCC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204465
C=CC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204467
C=CC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204468
C=CCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204469
C=CCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204470
C=CCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204471
C=CCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204472
C=CCCCC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204473
C=CCCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204474
C=CCCCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204475
C=CCCCCCC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204476
C=CCC(CC=C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204477
C=CCCC(CCC=C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204478
[N-]=[N+]=NCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204479
[N-]=[N+]=NCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204480
C#CC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204482
CCOC1=NC(=O)C(C)=CN1[C@H]1C[C@@H](O)[C@@H](CO)O1 204498
COC1=NC(=O)C(C)=CN1[C@H]1C[C@@H](O)[C@@H](CO)O1 204499
O=C1NC=NC2=C1N=C(Br)N2[C@@H]1O[C@H](CO)[C@H](O)C1O 204503
NC1=NC=NC2=C1N=CN2[C@@H]1CO[C@@H]2CO[C@@H](C3=CC=CC=C3)O[C@H]2[C@H]1O 204505
NC1=NC2=C(N=CN2[C@@H]2CO[C@@H]3CO[C@@H](C4=CC=CC=C4)O[C@H]3[C@H]2O)C(=O)N1 204506
O=C1C=CN([C@@H]2CO[C@@H]3CO[C@@H](C4=CC=CC=C4)O[C@H]3[C@H]2O)C(=O)N1 204507
NC1=NC(=O)N([C@@H]2CO[C@@H]3CO[C@@H](C4=CC=CC=C4)O[C@H]3[C@H]2O)C=C1 204508
NC1=NC2=C(N=CN2[C@@H]2CO[C@@H]3CO[C@@H](C4=CC=CC=C4)O[C@H]3[C@H]2O)C(Cl)=N1 204509
CC1=CN([C@@H]2CO[C@@H]3CO[C@@H](C4=CC=CC=C4)O[C@H]3[C@H]2O)C(=O)N=C1N 204510
COCCOC1[C@@H](O)[C@@H](COC(C2=CC=CC=C2)(C2=CC=C(OC)C=C2)C2=CC=C(OC)C=C2)O[C@H]1N1C=C(C)C(NC(=O)C2=CC=CC=C2)=NC1=O 204511
CC1=CN([C@H]2C[C@@H](O)[C@@H](CN=[N+]=[N-])O2)C(=O)NC1=O 204512
C=CCCCCCCC(CCCC=C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204513
C=CC[C@](C)(N)C(=O)O 204514
C=CC[C@@](C)(N)C(=O)O 204515
C=CCC[C@](C)(N)C(=O)O 204516
C=CCC[C@@](C)(N)C(=O)O 204517
C=CCCC[C@](C)(N)C(=O)O 204518
C=CCCC[C@@](C)(N)C(=O)O 204519
C=CCCCCCC[C@](C)(N)C(=O)O 204520
C=CCCCCCC[C@@](C)(N)C(=O)O 204521
C=CCC[C@H](N)C(=O)O 204522
C=CCC[C@@H](N)C(=O)O 204523
O=CNCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204524
CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204526
CC(C)N(CCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O)C(=O)OC(C)(C)C 204528
CCCCC(=O)NCCCC[C@H](N)C(=O)O 204530
C/C=C/C(=O)NCCCC[C@H](N)C(=O)O 204531
N[C@@H](CCCCNC(=O)CCC(=O)O)C(=O)O 204532
CN(C(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)O 204533
O=C(N[C@@H](CCCCNC(=O)C1=CC2=C(C=C1)C(=O)OC21C2=CC=C(O)C=C2OC2=CC(O)=CC=C21)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204534
O=C(N[C@@H](CCCCNC(=O)C1=CC2=C(C=C1)C1(OC2=O)C2=CC=C(O)C=C2OC2=CC(O)=CC=C21)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204535
O=C(N[C@@H](CCCCNC(=O)C1=CC2=C(C=C1)C1(OC2=O)C2=CC=C(O)C=C2OC2=CC(O)=CC=C21)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204536
CN(C)C1=CC=C(C(=C2C=CC(=[N+](C)C)C=C2)C2=C3C=CC=CC3=C(NC3=CC=CC=C3)C=C2)C=C1.[Cl-] 50P579594
O=S(=O)([O-])C1=CC(S(=O)(=O)[O-])=C2C(=C1)C=CC(O)=C2N=NC1=CC=CC=C1.[Na+] 50P588931
O=[N+]([O-])C1=CC=C(N=NC2=CC=C(O)C3=CC=CC=C23)C=C1 50P593866
NC1=CC=C(N=NC2=CC(N=NC3=C(N)C=C(N)C=C3)=CC=C2)C(N)=C1 50P594040
O=C1C2=CC=CN=C2C2=C1C=CC=N2 50P594418
O=S1(=O)OC(C2=CC=C(O)C=C2)(C2=CC=C(O)C=C2)C2=CC=CC=C21 50P600238
OC1=CC=C2C=CC=CC2=C1/N=N/C1=CC=CC=C1 50P608534
CC(NCCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O)=C1C(=O)CC(C)(C)CC1=O 204537
COCCO[C@@H]1[C@H](O)[C@@H](COC(C2=CC=CC=C2)(C2=CC=C(OC)C=C2)C2=CC=C(OC)C=C2)O[C@H]1N1C=CC(NC(=O)C2=CC=CC=C2)=NC1=O 204538
COCCO[C@@H]1[C@H](O)[C@@H](COC(C2=CC=CC=C2)(C2=CC=C(OC)C=C2)C2=CC=C(OC)C=C2)O[C@H]1N1C=CC(=O)NC1=O 204539
OC[C@H]1O[C@@H](N2C=CC3=C2N=CN=C3Cl)C(O)[C@H]1O 204540
NC1=NC=NC2=C1C=CN2[C@@H]1O[C@H](CO)[C@H](O)C1O 204541
NC1=NC=NC2=C1C=CN2[C@H]1C[C@@H](O)[C@@H](CO)O1 204542
NC1=NC2=C(C=CN2[C@H]2C[C@@H](O)[C@@H](CO)O2)C(=O)N1 204543
O=C1C=CN([C@H]2CNC[C@@H](CO)O2)C(=O)N1 204544
CC1=CN([C@H]2CNC[C@@H](CO)O2)C(=O)NC1=O 204545
O=C(NC1=NC(=O)N([C@H]2CNC[C@@H](CO)O2)C=C1)C1=CC=CC=C1 204546
O=C(NC1=NC=NC2=C1N=CN2[C@H]1CNC[C@@H](CO)O1)C1=CC=CC=C1 204547
CC(C)C(=O)NC1=NC2=C(N=CN2[C@H]2CNC[C@@H](CO)O2)C(=O)N1 204548
NC1=NC=NC2=C1N=C(I)N2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O 204550
NC1=NC=NC2=C1N=C(S)N2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O 204551
NC1=NC(S)=C2N=CN(C3O[C@H](CO)[C@@H](O)[C@H]3O)C2=N1 204552
ClC1=C2C=CNC2=NC=N1 204554
NC1=C2C=CNC2=NC=N1 204555
NC1=NC2=C(C=CN2)C(N)=N1 204556
O=C1NC(=O)C2=C(NC=C2)N1 204558
C1=CC2=CN=CN=C2N1 204559
NC1=NC2=C(C=CN2)C=N1 204560
NC1=NC(=O)NC2=C1C=CN2 204561
COC1=C2C=CNC2=NC=N1 204562
ClC1=NC2=C(C=CN2)C(Cl)=N1 204563
COC1=NC(N)=NC2=C1C=CN2 204564
CCCCCCCCCNC1=C2C=CNC2=NC=N1 204565
CN1C=NC(=O)C2=C1NC=N2 204566
CN1C=NC(=S)C2=C1NC=N2 204567
C1=CC=C([C@@H]2OC[C@H]3OC[C@@H]4O[C@@H]4[C@@H]3O2)C=C1 204568
OC[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O 204571
O=C1OC2(C3=CC=C(O)C=C3OC3=C2C=CC(O)=C3)C2=CC=CC(N=C=S)=C12 204576
CN(C)C1=CC2=[O+]C3=C(C=CC(N(C)C)=C3)C(C3=CC=C(C(=O)O)C=C3C(=O)[O-])=C2C=C1 204577
CN(C)C1=CC2=[O+]C3=C(C=CC(N(C)C)=C3)C(C3=CC=C(C(=O)O)C=C3C(=O)[O-])=C2C=C1 204578
CN(C)C1=CC2=[O+]C3=C(C=CC(N(C)C)=C3)C(C3=CC=C(C(=O)ON4C(=O)CCC4=O)C=C3C(=O)[O-])=C2C=C1 204579
CN(C)C1=CC2=[O+]C3=C(C=CC(N(C)C)=C3)C(C3=C(Cl)C(C(=O)O)=CC(Cl)=C3C(=O)[O-])=C2C=C1 204580
O=S(=O)([O-])C1=CC(S(=O)(=O)O)=CC=C1C1=C2C=C3CCCN4CCCC(=C34)C2=[O+]C2=C1C=C1CCCN3CCCC2=C13 204581
O=C([O-])C1=CC(C(=O)O)=CC=C1C1=C2C=C3CCCN4CCCC(=C34)C2=[O+]C2=C1C=C1CCCN3CCCC2=C13 204582
O=C([O-])C1=CC=C(C(=O)O)C=C1C1=C2C=C3CCCN4CCCC(=C34)C2=[O+]C2=C1C=C1CCCN3CCCC2=C13 204583
O=C([O-])C1=CC(C(=O)O)=CC=C1C1=C2C=C3CCCN4CCCC(=C34)C2=[O+]C2=C1C=C1CCCN3CCCC2=C13 204584
O=C([O-])C1=C(Cl)C=C(C(=O)O)C(Cl)=C1C1=C2C=C3CCCN4CCCC(=C34)C2=[O+]C2=C1C=C1CCCN3CCCC2=C13 204585
O=C([O-])C1=C(Cl)C(C(=O)O)=CC(Cl)=C1C1=C2C=C3CCCN4CCCC(=C34)C2=[O+]C2=C1C=C1CCCN3CCCC2=C13 204586
O=C(O)C1=CC=CC=C1C1=C2C=C3CCCN4CCCC(=C34)C2=[O+]C2=C1C=C1CCCN3CCCC2=C13.[Cl-] 204587
CC[N+]1=C(/C=C/C=C2\N(CCCCCC(=O)O)C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)[O-])=C2 204588
CC[N+]1=C(/C=C/C=C2\N(CCCCCC(=O)ON3C(=O)CCC3=O)C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)[O-])=C2 204589
CC[N+]1=C(/C=C/C=C\C=C2/N(CCCCCC(=O)O)C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)[O-])=C2 204590
CC[N+]1=C(/C=C/C=C\C=C2/N(CCCCCC(=O)ON3C(=O)CCC3=O)C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)[O-])=C2 204591
CCN1C(=CC=CC=CC=CC2=[N+](CCCCCC(=O)O)C3=CC=C(S(=O)(=O)[O-])C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)O)=C2 204592
CC[N+]1=C(/C=C/C=C/C=C\C=C2/N(CCCCCC(=O)ON3C(=O)CCC3=O)C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)[O-])=C2 204593
C#CCNC(=O)CCCCCN1C2=CC=C(S(=O)(=O)O)C=C2C(C)(C)/C1=C/C=C/C1=[N+](CC)C2=C(C=C(S(=O)(=O)[O-])C=C2)C1(C)C 204594
CC[N+]1=C(/C=C/C=C2\N(CCCCCC(=O)NCCCN=[N+]=[N-])C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)[O-])=C2 204595
CC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)NCCCCCCN)C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=CC(S(=O)(=O)[O-])=CC=C21 204711
C#CCNC(=O)CCCCCN1C2=CC=C(S(=O)(=O)O)C=C2C(C)(C)/C1=C/C=C\C=C\C1=[N+](CC)C2=C(C=C(S(=O)(=O)[O-])C=C2)C1(C)C 204596
CC[N+]1=C(/C=C/C=C\C=C2/N(CCCCCC(=O)NCCCN=[N+]=[N-])C3=CC=C(S(=O)(=O)O)C=C3C2(C)C)C(C)(C)C2=C1C=CC(S(=O)(=O)[O-])=C2 204597
CCN1C2=C(C=C(S(=O)(=O)O)C=C2)C(C)(C)/C1=C/C=C/C1=[N+](CCCCCC(=O)NCCCCCCN=[N+]=[N-])C2=CC=C(S(=O)(=O)[O-])C=C2C1(C)C 204598
C#CCNC(=O)CCCCC[N+]1=C(/C=C/C=C/C=C\C=C2/N(CC)C3=C(C=C(S(=O)(=O)O)C=C3)C2(C)C)C(C)(C)C2=CC(S(=O)(=O)[O-])=CC=C21 204599
CCN1C2=C(C=C(S(=O)(=O)[O-])C=C2)C(C)(C)/C1=C/C=C\C=C\C=C\C1=[N+](CCCCCC(=O)NCCCN=[N+]=[N-])C2=CC=C(S(=O)(=O)O)C=C2C1(C)C 204600
CC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)C3=CC=C4C(S(=O)(=O)O)=CC(S(=O)(=O)O)=CC4=C3C2(C)C)C(C)(C)C2=C1C=CC1=C2C=C(S(=O)(=O)O)C=C1S(=O)(=O)[O-] 204601
CC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)ON3C(=O)CCC3=O)C3=CC=C4C(S(=O)(=O)O)=CC(S(=O)(=O)O)=CC4=C3C2(C)C)C(C)(C)C2=C1C=CC1=C2C=C(S(=O)(=O)O)C=C1S(=O)(=O)[O-] 204602
CC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)O)C3=CC=C4C(S(=O)(=O)O)=CC(S(=O)(=O)O)=CC4=C3C2(C)C)C(C)(C)C2=C1C=CC1=C2C=C(S(=O)(=O)O)C=C1S(=O)(=O)[O-] 204603
CC[N+]1=C(/C=C/C=C\C=C2/N(CCCCCC(=O)ON3C(=O)CCC3=O)C3=CC=C4C(S(=O)(=O)O)=CC(S(=O)(=O)O)=CC4=C3C2(C)C)C(C)(C)C2=C1C=CC1=C2C=C(S(=O)(=O)O)C=C1S(=O)(=O)[O-] 204604
CCN1C2=C(C3=C(C=C2)C(S(=O)(=O)[O-])=CC(S(=O)(=O)O)=C3)C(C)(C)/C1=C/C=C/C=C/C=C/C1=[N+](CCCCCC(=O)O)C2=CC=C3C(S(=O)(=O)O)=CC(S(=O)(=O)O)=CC3=C2C1(C)C 204605
O=C(O)CN(CC(=O)O)CC1=C(O)C=CC2=C1OC1=C(CN(CC(=O)O)CC(=O)O)C(O)=CC=C1C21OC(=O)C2=CC=CC=C21 204606
CCOC(=O)CN(CC(=O)OCC)CC1=C2OC3=C(CN(CC(=O)OCC)CC(=O)OCC)C(O)=CC=C3C3(OC(=O)C4=CC=CC=C43)C2=CC=C1O 204607
NC1=CC=C2C(=C1)[O+]=C1C=C(N)C=CC1=C2C1=C(Cl)C=C(C(=O)O)C(Cl)=C1C(=O)[O-] 204608
CCNC1=CC2=[O+]C3=CC(NCC)=C(C)C=C3C(C3=C(Cl)C=C(C(=O)O)C(Cl)=C3C(=O)[O-])=C2C=C1C 204609
CN(C)C1=CC=C(/N=N\C2=CC=C(C(=O)ON3C(=O)CCC3=O)C=C2)C=C1 204612
O=C(O)CCCCCNC1=C([N+](=O)[O-])C=C([N+](=O)[O-])C=C1 204613
O=C(CCCCCNC1=C([N+](=O)[O-])C=C([N+](=O)[O-])C=C1)ON1C(=O)CCC1=O 204614
OC1=C2CCCN3CCCC(=C23)C=C1 204615
O=C(O)C1=C(Cl)C(C(=O)O)=C(C(=O)O)C(Cl)=C1 204616
O=C(O)C1=C(Cl)C2=C(C(=O)OC2=O)C(Cl)=C1 204617
C=CCCCCC[C@@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204625
CN(C)C(=N)NCCC[C@@H](N)C(=O)O 204627
C/N=C(\NC)NCCC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204628
CC1=C(C)C(S(=O)(=O)NC(=N)NCCCC[C@H](NC(=O)OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)C(=O)O)=C(C)C2=C1OC(C)(C)C2 204630
CC1=C(C)C(S(=O)(=O)NC(=N)NCCCC[C@H](NC(=O)OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)C(=O)O)=C(C)C2=C1OC(C)(C)CC2 204631
O=C(N[C@@H](CC1=CC2=C(C=CC=C2)C=C1)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204636
O=C(N[C@H](CC1=CC2=C(C=CC=C2)C=C1)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204637
O=C(N[C@@H](CC1=CC=NC=C1)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204638
O=C(N[C@H](CC1=CC=NC=C1)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204639
O=C(N[C@@H](CC1=CSC=C1)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204640
O=C(N[C@@H](CC1=CSC=N1)C(=O)O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2 204641
CC(C)(C)OC(=O)CC1=CC=C(C[C@H](NC(=O)OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)C(=O)O)C=C1 204642
CC(C)(C)OC(=O)CCCC[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204644
CN(C(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)[C@@H](CCC(=O)OC(C)(C)C)C(=O)O 204647
C[C@](N)(CC1=CC=C(I)C=C1)C(=O)O 204690
C[C@@](N)(CC1=CC=C(I)C=C1)C(=O)O 204691
C[C@](N)(CC1=CC=C(O)C=C1)C(=O)O 204692
C[C@@](N)(CC1=CC=C(O)C=C1)C(=O)O 204693
CC(C)(C)OC(=O)N1C(C[C@](C)(NC(=O)OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)C(=O)O)=CC2=C1C=CC=C2 204696
CC(C)(C)OC(=O)N1C(C[C@@](C)(NC(=O)OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)C(=O)O)=CC2=C1C=CC=C2 204697
CC(C)(C)C1=CC(C(C)(C)C)=C2NC(C(C)(C)C)=C(C[C@H](N)C(=O)O)C2=C1 204698
C#CC[C@](C)(NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(=O)O 204700
NC(N)=NCCC[C@H](N)C(=O)O.NC(N)=NCCC[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O RT-Diaog
CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)C3=CC=C(O)C=C3)C(=O)N2[C@H]1C(=O)O RT-2050315
CC1(C)C(=O)NC2=C1C=C(O)C=C2 RT-BD-026
COC1=C(OC)C=C(CC#N)C=C1 RT-BN-037
Cl.Cl.NC1=CC(N)=C(OCCO)C=C1 RT-BS-001
O=S(=O)([O-])C1=CC(O)=C2C=C(O)C=CC2=C1.[Na+] RT-BS-003
O=S(=O)([O-])C1=CC2=CC(S(=O)(=O)[O-])=C(O)C=C2C=C1O.[Na+].[Na+] RT-BS-004
OC1=CC2=C(C=C1)C=CC(O)=C2 RT-BS-011
OC1=CC2=C(C=C1)C=C(O)C=C2 RT-BS-012
OC1=CC2=CC=CC=C2C=C1O RT-BS-013
OC1=CC2=C(C=C1)C(O)=CC=C2 RT-BS-014
COC1=CC2=C(C=C1)CCCC2=O RT-BS-022
CC1(C)CC(C)(C2=CC=C(O)C=C2)C2=C1C=CC(O)=C2 RT-BS-024
O=[N+]([O-])C1=C(NC2=C(Cl)C=C(C(F)(F)F)C=N2)C([N+](=O)[O-])=C(Cl)C(C(F)(F)F)=C1 RT-BS-026
CC1=C(NC2=NC=CC(C3=CN=CC=C3)=N2)C=C(NC(=O)C2=CC=CC=C2)C=C1 RT-BS-027
O=C(O)C1CCNCC1 RT-GA-004
COC1=CC2=C(C=C1)NC=C2C=O RT-GA-009
O=C1N[C@@H](CC2=CC=C([N+](=O)[O-])C=C2)CO1 RT-GA-011
NC1=CC=C(C[C@H]2COC(O)=N2)C=C1 RT-GA-012
O=C1NC=C(F)C(=O)N1 RT-H96-010
CC(C)(C)[C@H](N)CO RT-LU-014
Cl.N[C@H](CO)CC1CCCCC1 RT-M03-010
NC(=O)C1=CC(Br)=CC=C1 RT-M98-011
Cl.N=C(N)C1=CC=C([N+](=O)[O-])C=C1 RT-PE-001
N=C(N)C1=CC=NC=C1 RT-PE-002
Cl.N=C(N)C1=CC=CC=N1 RT-PE-003
Cl.N=C(N)C1=CN=CC=C1 RT-PE-004
CC(C)(C)OC(=O)N1CCC(C(=O)O)CC1 RT-PE-005
CC(C)C1NC(=O)CNC1=O RT-PE-006
O=C1C2=CC=CC=C2C(=O)N1CC1CO1 RT-R04-010
N[C@H](C(=O)O)[C@H](O)C1=CC(O)=C(O)C=C1 RT-R04-029
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(N)=O)CS[C@H]12)C1=CC=CO1 RT-R04-040
N#CCC1=CC2=CC=CC=C2C=C1 RT-R04-071
BrC1=CSC=C1 RT-R04-083
O=C(O)C1=CC=C(O)C=C1 RT-R05-056
CCN(CC)C1=CC=C(C)C=C1 RT-R05-063*
CCN(CCNS(C)(=O)=O)C1=CC(C)=C(N)C=C1.CCN(CCNS(C)(=O)=O)C1=CC(C)=C(N)C=C1.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O RT-R05-064
NC1=CC=C(N(CCO)CCO)C=C1.O=S(=O)(O)O RT-R05-065
Cl.Cl.NC1=CC(N)=C(O)C=C1 RT-R05-066
N#CCC1=CC(C(=O)O)=CC=C1 RT-R06-009
O=P(O)(O)C(O)(CN1C=CN=C1)P(=O)(O)O RT-R06-017
S=C1N[C@H](CC2=CC=CC=C2)CO1 RT-R06-160
OC[C@H](O)C(O)[C@H](O)CO RT-R06-219
COC(=O)[C@@H]1C[C@H](F)CN1.Cl RT-R06-362
[H][C@]12[C@@H](O)C[C@@]3(C)[C@@H](C[C@@H](O)[C@]3(O)C(=O)CO)[C@@H]1CCC1=CC(=O)C=C[C@@]12C RT-R06-403/R07-410
NC(=O)N1C2=CC=CC=C2CC(=O)C2=CC=CC=C21 RT-R06-413
CCOC(=O)C1=CN(C2=C(F)C=C(F)C=C2)C2=NC(Cl)=C(F)C=C2C1=O RT-R06-451
C1=CC2=C(C=N1)NC=C2 RT-R06-499
O=C1NC2=C(C=C(C(=O)O)C=C2)C(=O)O1 RT-R06-652
COC1=C(OC)C=C2C(=O)OC(=O)NC2=C1 RT-R06-656
COC1=CC2=C(C=C1)NC(=O)OC2=O RT-R06-660
ClC1=CC=CC(C2CCNCC2)=C1 RT-R06-686
N#CC1=C(N)SC(C=O)=C1Cl RT-R07-076
CCOC(=O)C(F)(F)C(O)C1COC(C)(C)O1 RT-R07-142
C1=CSC(C2=CC=CS2)=C1 RT-R07-404
NC1=CC=CC=C1NC(=O)C1=CC=C(CNC(=O)OCC2=CN=CC=C2)C=C1 RT-R07-422
CN1CC[C@H](C2=C(O)C=C(O)C3=C2OC(C2=CC=CC=C2Cl)=CC3=O)[C@H](O)C1 RT-R09-149
O=C1C2=CC=CC=C2CCC1Br RT-R09-150
NC1=CC=CC2=C1CN(C1CCC(=O)NC1=O)C2=O RT-R09-153
O.O.O.[H][C@]12[C@H](OC(=O)C3=CC=CC=C3)[C@]3(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C4=CC=CC=C4)C(C)=C([C@@H](O)C(=O)[C@]1(C)[C@@H](O)C[C@H]1OC[C@]12OC(C)=O)C3(C)C RT-R09-154
O=C1CC(C(=O)O)NC(=O)N1 RT-R1-155
O=C1C[C@@H](C(=O)O)NC(=O)N1 RT-R1-168
CC(C)(C)OC(=O)NC1=CC=NC=C1 RT-R2-093
CN(CCC1=CC=C(C2=CC=CC=C2)C=C1)CC1CCCC2=C1C=CC(O)=C2 RT-R2-188
NCCC1CC2=CC=CC=C2C(C2=CC=CC=C2)=N1.O=C(O)C(=O)O RT-R3-022
O=C(NCCC1=CC=CC=C1)C1=CC=CC=C1 RT-R3-025
CC1=CC=C(C(=O)NCCC2=CC=CC=C2)C=C1 RT-R3-026
COC1=CC=CC=C1C(=O)NCCC1=CC=CC=C1 RT-R3-027
COC1=CC=C(C(=O)NCCC2=CC=CC=C2)C=C1 RT-R3-028
O=C(NCCC1=CC=CC=C1)C1CCCCC1 RT-R3-030
C1=CC=C(C2NCCC3=CC=CC=C32)C=C1 RT-R3-031
C1=CC=C2C(=C1)CCNC2C1CCCCC1 RT-R3-040
CC1=CC=C(C2NCCC3=C2C=CC=C3)C=C1 RT-R3-041
FC1=C(C2NCCC3=C2C=CC=C3)C=CC=C1 RT-R3-044
COC1=C(C2=CC=CC=C2)C=C([N+](=O)[O-])C=C1 RT-R3-067
COC1=C(C(C)C)C=C([I+]C2=CC(C(C)C)=C(OC)C=C2)C=C1.F[B-](F)(F)F RT-R3-102
O/N=C/C1=CC=NC2=CC=CC=C12 RT-R3-160
O=C(C1=CC=C(F)C=C1)/C(=N/O)C1=CC=NC=C1 RT-R96-030
NC(N)=NC1=CC([N+](=O)[O-])=CC=C1 RT-R97-011A
BrCC(CBr)(CBr)CBr RT-RC-001
SCC(CS)(CS)CS RT-RC-002
O=C(O)C1=CC=CC2=C1CCC2=O RT-S0-222
COC(=O)CC[C@H](NC(=O)C1=CC=C([N+](=O)[O-])C=C1)C(=O)OC RT-S1-010L
O=C(NC(O)C(=O)O)OCC1=CC=CC=C1 RT-S1-080
CC1=CC=C(S(=O)(=O)N2CCC[C@@H]2C(=O)N[C@H](CO)CC2C=CC=CC2)C=C1 RT-S1-150
O=C(O)C1=CC=CC2=C1CCCC2=O RT-S1-190
O=C(O)C1=CC2=C(C=C1)CCCC2=O RT-S1-200
O=C1CCC2=C1C=C(Br)C=C2 RT-S1-220
O=C1CCCC2=C1C=C(Br)C=C2 RT-S1-230
O=C1CCCC2=C1C=CC=C2Br RT-S1-250
N#CC1=CC2=C(C=C1)C(=O)CCC2 RT-S1-260
O=C1CCC2=C1C=CC=C2Br RT-S1-270
CC(C)SC(NC(=O)OCC1=CC=CC=C1)C(=O)O RT-S1-330
O=C(O)C1=CC2=C(C=C1)CCC2=O RT-S1-340
COC(=O)CN1C(=O)CN=C(C2=CC=CC=C2)C2=C1C=CC(Cl)=C2 RT-S1-420
COC(=O)CC[C@@H](NC(=O)C1=CC=C([N+](=O)[O-])C=C1)C(=O)OC RT-S1-440
CC(C)(C)C1=CC=CC=C1N RT-TM-005
O=C1C=C(CO)OC=C1O RT-WH-001
Br.BrCC1=CC=CC=N1 RT-WZ-001
BrCCC1=CC=CC=N1 RT-WZ-001A
Br.BrCCN1CCCCC1 RT-WZ-002A
NC1=CC=C(CCBr)C=C1 RT-WZ-004
CC(C)(C)OC(=O)NC1=CC=C(CCBr)C=C1 RT-WZ-005
O=S(=O)([O-])C1=CC2=CC=C(O)C(/N=N/C3=C4C=CC=CC4=C(S(=O)(=O)[O-])C=C3)=C2C(S(=O)(=O)[O-])=C1.[Na+].[Na+].[Na+] WJ0912
O=NC1=C(O)C(S(=O)(=O)[O-])=CC2=C1C=CC(S(=O)(=O)O)=C2.[Na+].[NaH] 50P101228
CCN(CC)C1=CC=C(/N=N/C2=CC=C(S(=O)(=O)[O-])C=C2)C=C1.[Na+] 50P101369
CC1=CC(=O)C(C(C)C)=C/C1=C(/C1=C(C)C=C(O)C(C(C)C)=C1)C1=C(S(=O)(=O)O)C=CC=C1 50P142126
CN(C)C1=CC=C(/N=N/C2=CC=C(C(=O)O)C=C2)C=C1 50P122186
O=C1C2=C(C=CC=C2)C(=O)C1(O)O 50P122337
CC1=C(N)C=C2NC3=CC(=[N+](C)C)C=CC3=NC2=C1.[Cl-] 50P124667
O=S(=O)([O-])C1=CC=C(/N=N\C2=CC=C(NC3=CC=CC=C3)C=C2)C=C1.[Na+] 50P124966
CN(C)C1=CC=C(C(=N)C2=CC=C(N(C)C)C=C2)C=C1.Cl 50P129426
O=C1C2=CC=CC=C2C(=O)C1C1=NC2=C(S(=O)(=O)[O-])C=C(S(=O)(=O)[O-])C=C2C=C1.[Na+].[Na+] 50P130096
CC1=NC2=C(C=CC=C2)S1 50P132072
COC1=C(N=NC2=C3C=CC(S(=O)(=O)[O-])=CC3=CC=C2O)C=C(C)C(S(=O)(=O)[O-])=C1.[Na+].[Na+] 50P152016
O=C1OC(C2=CC=C(O)C=C2)(C2=CC=C(O)C=C2)C2=C1C=CC=C2 50P152721
ClC1=CC(C2=CC=CC=N2)=NC(C2=NC=CC=C2)=C1 50P153712
BrC1=CC=C(Br)S1 50P156205
CC(=O)NC1=CC=C(/N=N/C2=C(O)C=CC(C)=C2)C=C1 50P174044
BrC1=CC=CC(C2=NC(Br)=CC=C2)=N1 50P174135
C[NH+]=C1C=CC(=C(C2=CC=C(N(C)C)C=C2)C2=CC=C(N(C)C)C=C2)C=C1.[Cl-] 50P179784
CC1=CC=C(NC2=CC=C(NC3=CC=C(C)C=C3)C3=C2C(=O)C2=CC=CC=C2C3=O)C=C1 50P187191
CC1=CC=C(C2=NC=C(C)C=C2)N=C1 50P199007
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