0 B12R2.1081 c1ccc2c(c1)cccc2Cl AS02472 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 c1ccc2c(c1)cccc2F AS02917 [0,0,0,0,0,0|3,0,0]=3 2 B12R2.1081 c1ccc2c(c1)cccc2I AS06208 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.1081 c1ccc2c(c1)cccc2N AS02473 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.1613 c1ccc2c(c1)cccc2CBr AS02445 [0,1,0,0,0,0|2,0,0]=3 5 B11R1.605 Cc1cccc(c1N=C=O)C AS04127 [0,0,1,0,0,0|2,0,1]=4 6 B11R1.605 Cc1cccc(c1N=C=S)C AS00367 [0,0,1,0,0,0|2,0,1]=4 7 B11R2.106 Cc1cccc2c1ccs2 AS06380 [0,0,0,0,1,0|1,0,0]=2 8 B11R2.106 Cc1cccc2c1occ2 AS06434 [0,0,0,0,1,0|1,0,0]=2 9 B11R2.106 c1cc(c2c(c1)ocn2)N AS06338 [0,0,0,0,1,0|2,0,0]=3 10 B11R2.106 c1cc(c2ccoc2c1)O AS06427 [0,0,0,0,1,0|2,0,0]=3 11 B11R2.106 c1cc(c2ccsc2c1)F AS06415 [0,0,0,0,1,0|2,0,0]=3 12 B11R2.106 c1cc2c(cc[nH]2)c(c1)F AS02112 [0,0,0,0,1,0|1,0,1]=3 13 B11R2.106 c1cc2c(ccs2)c(c1)Br AS06414 [0,0,0,0,1,0|2,0,0]=3 14 B11R2.106 c1cc2cc[nH]c2c(c1)F AS02114 [0,0,0,0,1,0|1,0,1]=3 15 B11R2.106 c1cc2ccoc2c(c1)Br AS06376 [0,0,0,0,1,0|2,0,0]=3 16 B11R2.106 c1cc2ccoc2c(c1)Cl AS06439 [0,0,0,0,1,0|2,0,0]=3 17 B11R2.106 c1cc2ccoc2c(c1)F AS06440 [0,0,0,0,1,0|2,0,0]=3 18 B10R1.2 Cc1cccc(c1C)C=O AS01456 [1,0,1,0,0,0|2,0,0]=4 19 B10R1.2 Cc1cccc(c1Cl)C=O AS05562 [1,0,1,0,0,0|2,0,0]=4 20 B10R1.2 Cc1cccc(c1F)C=O AS01465 [1,0,1,0,0,0|2,0,0]=4 21 B10R1.2 Cc1cccc(c1O)C=O AS02880 [1,0,1,0,0,0|2,0,0]=4 22 B10R1.245 Cc1cccc(c1C=O)C AS02875 [1,0,1,0,0,0|2,0,0]=4 23 B10R1.245 Cc1cccc(c1C=O)Cl AS04631 [1,0,1,0,0,0|2,0,0]=4 24 B10R1.245 Cc1cccc(c1C=O)F AS04975 [1,0,1,0,0,0|2,0,0]=4 25 B10R1.245 Cc1cccc(c1C=O)O AS06354 [1,0,1,0,0,0|2,0,0]=4 26 B12R1.125 Cc1ccccc1C=CC(=O)O AS00517 [0,1,1,0,0,0|2,0,0]=4 27 B12R2.24 Cc1nc2ccccc2nn1 AS06650 [1,1,0,0,0,0|1,0,0]=3 28 B12R2.24 c1cc2cc(ccc2nc1)I AS06220 [1,1,0,0,0,0|1,0,0]=3 29 B12R2.24 c1ccc2cc(ccc2c1)Br AS02431 [1,1,0,0,0,0|2,0,0]=4 30 B12R2.82 c1cc(c(c2c1[nH]cc2)F)F AS02110 [0,1,0,0,1,0|1,0,1]=4 31 B12R2.82 c1cc(c(c2c1cco2)Br)F AS06424 [0,1,0,0,1,0|2,0,0]=4 32 B12R2.202 c1cc(c2c(c1)sc(n2)N)O AS06683 [0,1,0,0,1,0|2,0,0]=4 33 B12R2.202 c1cc2c(c(c1)F)sc(n2)N AS06200 [0,1,0,0,1,0|2,0,0]=4 34 B12R2.221 c1cc(c2c(c1F)cco2)Br AS06421 [0,1,0,0,1,0|2,0,0]=4 35 B12R2.221 c1cc(c2ccoc2c1F)Br AS06449 [0,1,0,0,1,0|2,0,0]=4 36 B12R2.246 Cc1cc(cc2c1occ2)Br AS06426 [0,1,0,0,1,0|1,0,0]=3 37 B12R2.246 Cc1cc2ccoc2c(c1)Br AS06431 [0,1,0,0,1,0|2,0,0]=4 38 B12R2.246 c1c[nH]c2c1c(cc(c2)F)F AS06052 [0,1,0,0,1,0|1,0,1]=4 39 B12R2.246 c1c[nH]c2c1cc(cc2F)Br AS06862 [0,1,0,0,1,0|1,0,1]=4 40 B12R2.246 c1c[nH]c2c1cc(cc2F)F AS02111 [0,1,0,0,1,0|1,0,1]=4 41 B12R2.246 c1coc2c1cc(cc2Br)Br AS06435 [0,1,0,0,1,0|2,0,0]=4 42 B12R2.246 c1coc2c1cc(cc2Br)Cl AS06425 [0,1,0,0,1,0|2,0,0]=4 43 B12R2.246 c1coc2c1cc(cc2Br)F AS06419 [0,1,0,0,1,0|2,0,0]=4 44 B12R2.246 c1coc2c1cc(cc2Br)O AS06452 [0,1,0,0,1,0|2,0,0]=4 45 B12R2.246 c1coc2c1cc(cc2F)Br AS06423 [0,1,0,0,1,0|2,0,0]=4 46 B12R2.246 c1csc2c1c(cc(c2)Br)F AS06417 [0,1,0,0,1,0|2,0,0]=4 47 B12R2.315 c1cc(c2ccoc2c1)C#N AS06446 [0,1,0,0,1,0|1,0,1]=4 48 B12R2.315 c1cc(c2ccoc2c1)C=O AS06447 [0,1,0,0,1,0|1,0,1]=4 49 B10R2.7 c1cc2cc[nH]c2nc1 AS07114 [1,0,0,0,1,0|1,0,1]=4