0 B10R1.18 CC(=O)NC1=CC=CC=N1 433646 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.18 CN(C)CC1=CC=NC=C1 097893 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.8 COCC1=CC=NC=C1 097899 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.8 O=C=NC1=CC=CC=N1 035957 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.8 O=C=NC1=CC=NC=C1 098360 [1,0,0,0,0,0|2,0,1]=4 5 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 480957 [1,0,0,0,0,0|2,0,0]=3 6 B11R1.20 CC(=S)NC1=CC=C(F)C=C1 331457 [0,1,0,0,0,0|2,1,0]=4 7 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|1,0,1]=4 8 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|1,0,0]=3 9 B8R1.2 [15NH2]CC1=CC=CC=C1 105185 [2,0,0,0,0,0|1,0,0]=3 10 B10R1.1 CC1=CC=C(CON)C=C1 025883 [1,1,0,0,0,0|2,0,0]=4 11 B10R1.1 COCC1=CC=C(N)C=C1 098494 [1,1,0,0,0,0|2,0,0]=4 12 B10R1.4 ClC1=C(CCBr)C=CC=C1 020893 [1,1,0,0,0,0|1,0,1]=4 13 B10R1.10 C=CCC1=CC=CC(C)=C1 022306 [1,1,0,0,0,0|1,0,0]=3 14 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 064474 [0,1,0,0,1,0|2,0,0]=4 15 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 064485 [0,1,0,0,1,0|2,0,0]=4 16 B10R1.13 O=S([O-])C1=CC=C(Br)C=C1 097856 [0,1,0,0,1,0|1,0,1]=4 17 B10R1.61 CS(=O)C1=C(Cl)C=CC=C1 064490 [0,1,0,0,1,0|2,0,0]=4 18 B10R1.61 CS(=O)C1=C(F)C=CC=C1 064511 [0,1,0,0,1,0|2,0,0]=4 19 B10R1.61 NC(=O)C1=NC=CC=C1F 094552 [0,1,0,0,1,0|2,0,0]=4 20 B10R1.113 CC1=CC=CC(S(C)=O)=C1 064559 [0,1,0,0,1,0|2,0,0]=4 21 B10R1.113 CS(=O)C1=CC(Cl)=CC=C1 064493 [0,1,0,0,1,0|2,0,0]=4 22 B10R1.113 CS(=O)C1=CC(F)=CC=C1 064508 [0,1,0,0,1,0|2,0,0]=4 23 B10R1.113 CS(=O)C1=CC=CC(Br)=C1 064477 [0,1,0,0,1,0|2,0,0]=4 24 B12R1.27 COC(=O)\C=C\C1=CN=CC=C1 105399 [0,1,0,0,0,1|1,0,1]=4 25 B12R1.27 NCC(=O)NCC1=NC=CC=C1 086753 [0,1,0,0,0,1|2,0,0]=4 26 B12R1.125 O=C(O)CSC1=CC=CC=C1Br 033384 [0,1,0,0,0,1|0,0,0]=2 27 B12R1.125 O=C(O)CSC1=CC=CC=C1F 033385 [0,1,0,0,0,1|0,0,0]=2 28 B12R1.226 O=C(O)CSC1=CC=CC(Br)=C1 033383 [0,1,0,0,0,1|0,0,0]=2 29 B12R1.226 O=C(O)CSC1=CC=CC(F)=C1 033386 [0,1,0,0,0,1|0,0,0]=2 30 B12R1.19 NC1=CC=C(CC(=O)O)C=C1Br 038726 [0,2,0,0,0,0|0,0,0]=2 31 B12R1.19 O=C(O)CC1=CC=C(I)C(Br)=C1 038727 [0,2,0,0,0,0|0,0,0]=2 32 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 064722 [0,2,0,0,0,0|2,0,0]=4 33 B12R1.20 O=C(O)C(Br)C1=CC=C(F)C=C1 105203 [0,2,0,0,0,0|0,0,0]=2 34 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 026034 [0,2,0,0,0,0|2,0,0]=4 35 B12R1.49 CNC(=O)OC1=CC=C(I)C=C1 105082 [0,2,0,0,0,0|2,0,0]=4 36 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 039340 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 039175 [0,2,0,0,0,0|2,0,0]=4 38 B12R1.106 CS(=O)(=O)CC1=CC=C(F)C=C1 024346 [0,2,0,0,0,0|1,0,1]=4 39 B12R1.106 O=S(=O)(Cl)CC1=CC=C(F)C=C1 020883 [0,2,0,0,0,0|1,0,1]=4 40 B12R1.124 CC1=C(C(=O)C(=O)O)C=CC=C1 105348 [0,2,0,0,0,0|0,0,1]=3 41 B12R1.253 O=C(Cl)C(F)(F)C1=CC=CC=C1 246465 [0,2,0,0,0,0|1,0,0]=3 42 B12R1.50 O=C(CCl)NC1=CC(Br)=CC=C1 033307 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.371 O=C(CCl)NC1=CC=CC=C1F 039341 [0,2,0,0,0,0|2,0,0]=4 44 B12R1.127 CC(=O)NC1=CC(N)=CC=C1Cl 314916 [0,2,0,0,0,0|2,0,0]=4 45 B12R1.224 CC(=O)NC1=C(C)C(Cl)=CC=C1 095839 [0,2,0,0,0,0|2,0,0]=4 46 B12R1.101 O=C(Cl)CC1=CC(F)=CC(F)=C1 038316 [0,2,0,0,0,0|1,0,0]=3 47 B12R1.119 CS(=O)(=O)CC1=CC(F)=CC=C1 024344 [0,2,0,0,0,0|1,0,1]=4 48 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 033240 [0,1,0,1,0,0|2,0,0]=4 49 B12R2.95 O=S1(=O)OC2=C(C=CC=C2)O1 105084 [0,1,0,1,0,0|2,0,0]=4 50 B12R1.252 NC(=O)NOCC1=CC=CC=C1 324922 [0,0,0,0,0,2|1,0,0]=3