0 B10R1.15 C=C(CC)C1=CC=CC=C1 319906 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.15 N#CN(N)C1=CC=CC=C1 184597 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.6 CC(N)C1=CC=CC=N1 300972 [1,0,0,0,0,0|2,0,1]=4 3 B9R1.8 COCC1=CC=NC=C1 097899 [1,0,0,0,0,0|1,0,1]=3 4 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 480957 [1,0,0,0,0,0|1,0,2]=4 5 B11R2.1 IC1=NNC2=C1C=CC=C2 076340 [0,0,0,1,0,0|3,0,0]=4 6 B9R1.11 CNC(=O)N1C=CN=C1 051233 [0,0,0,0,1,0|3,0,0]=4 7 B9R1.11 COC(=O)N1C=CC=C1 066140 [0,0,0,0,1,0|1,0,0]=2 8 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|0,0,0]=2 9 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|1,0,1]=4 10 B8R1.2 [15NH2]CC1=CC=CC=C1 105185 [2,0,0,0,0,0|1,0,1]=4 11 B10R1.13 CN(C)C1=CC=C(N)C=C1 106160 [1,1,0,0,0,0|2,0,0]=4 12 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 064474 [1,1,0,0,0,0|1,0,0]=3 13 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 064485 [1,1,0,0,0,0|1,0,0]=3 14 B10R1.13 O=S([O-])C1=CC=C(Br)C=C1 097856 [1,1,0,0,0,0|1,0,1]=4 15 B10R1.61 CC(F)C1=C(Br)C=CC=C1 035830 [1,1,0,0,0,0|1,0,1]=4 16 B10R1.61 CS(=O)C1=C(Cl)C=CC=C1 064490 [1,1,0,0,0,0|1,0,0]=3 17 B10R1.61 CS(=O)C1=C(F)C=CC=C1 064511 [1,1,0,0,0,0|1,0,0]=3 18 B10R1.61 NC(=O)C1=NC=CC=C1F 094552 [1,1,0,0,0,0|2,0,0]=4 19 B10R1.113 CC1=CC=CC(C(C)N)=C1 094296 [1,1,0,0,0,0|1,0,1]=4 20 B10R1.113 CC1=CC=CC(S(C)=O)=C1 064559 [1,1,0,0,0,0|1,0,0]=3 21 B10R1.113 CS(=O)C1=CC(Cl)=CC=C1 064493 [1,1,0,0,0,0|1,0,0]=3 22 B10R1.113 CS(=O)C1=CC(F)=CC=C1 064508 [1,1,0,0,0,0|1,0,0]=3 23 B10R1.113 CS(=O)C1=CC=CC(Br)=C1 064477 [1,1,0,0,0,0|1,0,0]=3 24 B10R1.1 CC1=CC=C(CON)C=C1 025883 [1,1,0,0,0,0|1,0,1]=4 25 B10R1.1 CCOC1=CC=C(S)C=C1 038427 [1,1,0,0,0,0|2,0,0]=4 26 B10R1.1 CCSC1=CC=C(S)C=C1 023079 [1,1,0,0,0,0|2,0,0]=4 27 B10R1.1 COCC1=CC=C(N)C=C1 098494 [1,1,0,0,0,0|0,0,1]=3 28 B10R1.4 CCOC1=C(I)C=CC=C1 038700 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.10 CCOC1=CC(F)=CC=C1 013375 [1,1,0,0,0,0|2,0,0]=4 30 B10R1.17 CCOCC1=CC=NC=C1 097898 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.14 COC(=O)C1=CC=C(Br)N1 092635 [0,1,0,0,1,0|1,0,0]=3 32 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 026034 [0,1,0,0,0,1|2,0,0]=4 33 B12R1.49 CNC(=O)OC1=CC=C(I)C=C1 105082 [0,1,0,0,0,1|1,0,0]=3 34 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 039340 [0,1,0,0,0,1|2,0,0]=4 35 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 039175 [0,1,0,0,0,1|2,0,0]=4 36 B12R1.50 O=C(CCl)NC1=CC(Br)=CC=C1 033307 [0,1,0,0,0,1|2,0,0]=4 37 B12R1.371 O=C(CCl)NC1=CC=CC=C1F 039341 [0,1,0,0,0,1|2,0,0]=4 38 B12R1.475 COC(C)(CN)C1=CC=CC=C1 214332 [0,2,0,0,0,0|1,0,1]=4 39 B12R1.16 N#CCC(=O)C1=CC=C(I)C=C1 225905 [0,2,0,0,0,0|1,0,1]=4 40 B12R1.17 CCNC(=O)C1=CC=CC(N)=C1 310925 [0,2,0,0,0,0|1,0,0]=3 41 B12R1.1703 COC(=O)C1=CC=C(I)C=C1C 234140 [0,2,0,0,0,0|0,0,0]=2 42 B12R1.1703 O=C(CBr)C1=C(F)C=C(Cl)C=C1 095249 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.24 COC(=O)C1=CC=CC(Br)=C1Cl 363369 [0,2,0,0,0,0|0,0,0]=2 44 B12R1.24 COC(=O)C1=CC=CC(N)=C1F 232768 [0,2,0,0,0,0|0,0,0]=2 45 B12R1.225 CC(C)C(=O)C1=CC(Cl)=CC=C1 400548 [0,2,0,0,0,0|1,0,0]=3 46 B12R1.358 COC(=O)C1=CC(N)=NC(Cl)=C1 105309 [0,2,0,0,0,0|1,0,0]=3 47 B12R1.358 COC(=O)C1=CC(O)=CC(F)=C1 318132 [0,2,0,0,0,0|0,0,0]=2 48 B12R1.124 CC1=C(C(=O)C(=O)O)C=CC=C1 105348 [0,2,0,0,0,0|2,0,0]=4 49 B12R1.3441 COC(=O)C1=C(C)C=CC=C1Br 077316 [0,2,0,0,0,0|0,0,0]=2 50 B12R1.27 COC(=O)\C=C\C1=CN=CC=C1 105399 [0,0,0,0,0,2|1,0,0]=3