0 B12R1.8 CCCCCOc1ccccc1 AS01110 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.8 c1ccc(cc1)COCCC=O AS05243 [0,0,0,0,0,0|1,0,2]=3 2 B12R1.8 c1ccc(cc1)COCCCO AS03951 [0,0,0,0,0,0|1,0,0]=1 3 B12R1.8 c1ccc(cc1)OCCCCBr AS03450 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.8 c1ccc(cc1)OCCCCI AS02285 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.28 CCCCOc1ccccc1 AS01104 [1,0,0,0,0,0|1,0,0]=2 6 B11R1.28 c1ccc(cc1)CCN=C=O AS04375 [1,0,0,0,0,0|1,0,2]=4 7 B11R1.28 c1ccc(cc1)CNCC#N AS06325 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.28 c1ccc(cc1)OCCCBr AS03455 [1,0,0,0,0,0|2,0,0]=3 9 B13R1.6 CCCCCOc1cccc(c1)F AS00938 [0,1,0,0,0,0|2,0,0]=3 10 B13R1.6 c1cc(cc(c1)Br)OCCCCBr AS03104 [0,1,0,0,0,0|2,0,0]=3 11 B13R1.9 c1cc(ccc1OCCCCBr)F AS03326 [0,1,0,0,0,0|2,0,0]=3 12 B13R1.28 CCCCCCOc1ccccc1 AS01108 [0,1,0,0,0,0|1,0,0]=2 13 B13R1.28 c1ccc(cc1)OCCCCCBr AS03454 [0,1,0,0,0,0|1,0,0]=2 14 B13R1.28 c1ccc(cc1)OCCCCCI AS02287 [0,1,0,0,0,0|1,0,0]=2 15 B13R1.555 CCCCCOc1ccccc1F AS00937 [0,1,0,0,0,0|2,0,0]=3 16 B13R2.3 c1ccc(cc1)[C@@H]2CCCNC2 AS06813 [0,0,0,1,0,0|2,0,0]=3 17 B13R2.3 c1ccc(cc1)[C@H]2CCCNC2 AS06812 [0,0,0,1,0,0|2,0,0]=3 18 B13R2.5252 c1ccc2c(c1)C(=O)CCCN2 AS06635 [0,0,0,1,0,0|1,0,2]=4 19 B10R1.17 CCCOc1ccccc1 AS01111 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.17 c1ccc(cc1)CCCBr AS03468 [2,0,0,0,0,0|1,0,0]=3 21 B10R1.17 c1ccc(cc1)NCCO AS00460 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.17 c1ccc(cc1)OCCBr AS03452 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.1 CCCCCc1ccc(cc1)Br AS00629 [1,1,0,0,0,0|0,0,0]=2 24 B12R1.1 c1cc(ccc1OCCCBr)F AS03330 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.27 COC(=O)CCc1ccccc1 AS06125 [1,1,0,0,0,0|1,0,1]=4 26 B12R1.28 CCCCOc1cccc(c1)F AS02640 [1,1,0,0,0,0|1,0,0]=3 27 B12R1.28 c1cc(cc(c1)Br)OCCCBr AS03108 [1,1,0,0,0,0|2,0,0]=4 28 B12R1.252 CC(=O)OCCc1ccccc1 AS02439 [1,1,0,0,0,0|1,0,1]=4 29 B12R1.252 c1ccc(cc1)COCC(=O)O AS06202 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.267 CCCCOc1ccccc1F AS02639 [1,1,0,0,0,0|1,0,0]=3 31 B14R1.26 CCCCCCOc1cccc(c1)F AS00933 [0,2,0,0,0,0|1,0,0]=3 32 B14R1.26 c1cc(cc(c1)Br)OCCCCCBr AS03107 [0,2,0,0,0,0|1,0,0]=3 33 B14R1.232 c1cc(c(cc1OCCCCBr)Cl)Cl AS03191 [0,2,0,0,0,0|2,0,0]=4 34 B14R1.14 c1cc(ccc1OCCCCCBr)F AS03329 [0,2,0,0,0,0|1,0,0]=3 35 B14R1.776 CCCCCOc1ccc(cc1)C#N AS03764 [0,2,0,0,0,0|2,0,0]=4 36 B14R1.776 CCCCCOc1ccc(cc1)C=O AS03943 [0,2,0,0,0,0|2,0,0]=4 37 B14R1.776 CCCCCOc1ccc(cc1)CO AS03999 [0,2,0,0,0,0|2,0,0]=4 38 B14R1.123 CCCCCCCOc1ccccc1 AS01107 [0,2,0,0,0,0|1,0,0]=3 39 B14R1.123 c1ccc(cc1)OCCCCCCBr AS03453 [0,2,0,0,0,0|1,0,0]=3 40 B14R1.123 c1ccc(cc1)OCCCCCCI AS02286 [0,2,0,0,0,0|1,0,0]=3 41 B14R1.156 c1ccc(cc1)COC(=O)CCCBr AS01126 [0,2,0,0,0,0|1,0,1]=4 42 B14R1.882 CCCCCCOc1ccccc1F AS00932 [0,2,0,0,0,0|1,0,0]=3 43 B12R2.2 c1ccc(cc1)[C@H]2CCNC2 AS06821 [1,0,0,1,0,0|1,0,0]=3 44 B12R2.41 c1ccc2c(c1)CCNCC2 AS06230 [1,0,0,1,0,0|1,0,0]=3 45 B14R2.21 c1cc(cc(c1)Cl)C2CCNCC2 AS06811 [0,1,0,1,0,0|2,0,0]=4 46 B14R2.68 c1cc(ccc1C2CCCCC2)O AS00204 [0,1,0,1,0,0|1,0,0]=3 47 B14R2.68 c1cc(ccc1C2CCNCC2)Br AS06715 [0,1,0,1,0,0|2,0,0]=4 48 B14R2.5540 c1ccc(cc1)C2(CCCNC2)O AS06543 [0,1,0,1,0,0|2,0,0]=4 49 B14R2.6 c1ccc(cc1)CN2CCNCC2 AS04451 [0,1,0,1,0,0|2,0,0]=4 50 B14R2.6 c1ccc(cc1)CN2CCNCC2 AS04452 [0,1,0,1,0,0|2,0,0]=4 51 B14R2.101 c1ccc(cc1)CO[C@@H]2CCNC2 AS06609 [0,1,0,1,0,0|2,0,0]=4 52 B14R2.19 c1ccc(cc1)CN2CCC(C2)O AS06595 [0,1,0,1,0,0|1,0,0]=3 53 B14R2.19 c1ccc(cc1)CN2CC[C@@H](C2)O AS06666 [0,1,0,1,0,0|1,0,0]=3 54 B14R2.19 c1ccc(cc1)CN2CC[C@H](C2)O AS06596 [0,1,0,1,0,0|1,0,0]=3