0 B11R1.4 CCCCCCC1=CSC=C1 8861 [0,0,0,1,0,0|2,0,1]=4 1 B11R1.17 CCCOC1=C(O)C=CC=C1 13203 [0,0,0,1,0,0|1,0,2]=4 2 B11R1.28 BrCCCOC1=CC=CC=C1 3826 [0,0,0,1,0,0|3,0,0]=4 3 B11R1.28 CCCCCC1=CC=CC=C1 16788 [0,0,0,1,0,0|1,0,0]=2 4 B11R1.28 CCCCOC1=CC=CC=C1 12529 [0,0,0,1,0,0|2,0,0]=3 5 B11R1.28 OCCCCC1=CC=CC=C1 3100 [0,0,0,1,0,0|2,0,0]=3 6 B11R1.28 OCCCCC1=CC=NC=C1 19155 [0,0,0,1,0,0|3,0,0]=4 7 B11R1.28 OCCNCC1=CC=CC=C1 12960 [0,0,0,1,0,0|3,0,0]=4 8 B11R1.28 OCCOCC1=CC=CC=C1 1939 [0,0,0,1,0,0|3,0,0]=4 9 B11R1.28 OCCSCC1=CC=CC=C1 10801 [0,0,0,1,0,0|3,0,0]=4 10 B11R1.41 CCOC1=C(C=O)C=CC=C1 9726 [0,0,0,1,0,0|1,0,2]=4 11 B11R1.41 O=CC1=C(CCBr)C=CC=C1 19638 [0,0,0,1,0,0|1,0,2]=4 12 B8R0.4 CCCCC\C=C\CO 18916 [2,0,0,0,0,0|0,0,2]=4 13 B10R1.4 CCCC1=C(N)C=CC=C1 13695 [1,0,0,1,0,0|1,0,1]=4 14 B10R1.17 BrCCCC1=CC=CC=C1 3832 [1,0,0,1,0,0|1,0,1]=4 15 B10R1.17 CCCCC1=CC=CC=C1 13571 [1,0,0,1,0,0|0,0,1]=3 16 B10R1.17 CCNCC1=NC=CC=C1 23918 [1,0,0,1,0,0|2,0,0]=4 17 B10R1.17 OCCCC1=CC=CC=C1 15023 [1,0,0,1,0,0|1,0,1]=4 18 B10R1.17 OCCCC1=NC=CC=C1 13082 [1,0,0,1,0,0|2,0,0]=4 19 B10R1.20 CCC1=C(C=O)C=CC=C1 3074 [1,0,0,1,0,0|0,0,2]=4 20 B10R1.21 CCCCCC1=CC=CO1 7059 [1,0,0,1,0,0|0,0,1]=3 21 B10R1.21 CCCCCC1=CNN=C1 21802 [1,0,0,1,0,0|2,0,0]=4 22 B10R1.21 CCCCCN1C=CN=C1 34819 [1,0,0,1,0,0|2,0,0]=4 23 B12R1.8 ClCCCCOC1=CC=CC=C1 13164 [0,1,0,1,0,0|2,0,0]=4 24 B12R1.8 NCCCCCC1=CC=CC=C1 12508 [0,1,0,1,0,0|1,0,0]=3 25 B12R1.8 OCCCCCC1=CC=CC=C1 34219 [0,1,0,1,0,0|1,0,0]=3 26 B12R1.8 OCCCOCC1=CC=CC=C1 20097 [0,1,0,1,0,0|2,0,0]=4 27 B12R1.121 CCCOC1=C(C=O)C=CC=C1 3160 [0,1,0,1,0,0|0,0,2]=4 28 B12R1.267 CCCCOC1=CC=CN=C1Br 5768 [0,1,0,1,0,0|2,0,0]=4 29 B12R1.267 CCCCOC1=CC=CN=C1Cl 6126 [0,1,0,1,0,0|2,0,0]=4 30 B12R1.69 CCCCC1=C(O)C=C(O)C=C1 34144 [0,1,0,1,0,0|0,0,2]=4 31 B12R1.1 CCCCCC1=CC=C(N)C=C1 20586 [0,1,0,1,0,0|1,0,0]=3 32 B12R1.1 CCCCCc1ccc(Br)cc1 10634 [0,1,0,1,0,0|1,0,0]=3 33 B12R1.1 CCCCOC1=CC=C(O)C=C1 13206 [0,1,0,1,0,0|2,0,0]=4 34 B12R1.1 CCCCOC1=NC=C(Br)C=C1 22137 [0,1,0,1,0,0|2,0,0]=4 35 B12R1.30 CCCCC(=O)C1=CC=CC=C1 25461 [0,1,0,1,0,0|1,0,1]=4 36 B12R1.30 CNCCC(Cl)C1=CC=CC=C1 24609 [0,1,0,1,0,0|2,0,0]=4 37 B12R1.30 CNCCC(O)C1=CC=CC=C1 27334 [0,1,0,1,0,0|2,0,0]=4 38 B12R1.30 CNCC[C@@H](O)C1=CC=CC=C1 23266 [0,1,0,1,0,0|2,0,0]=4 39 B12R1.30 CNCC[C@H](O)C1=CC=CC=C1 23246 [0,1,0,1,0,0|2,0,0]=4 40 B12R1.252 CC(=O)CCCC1=CC=CC=C1 23541 [0,1,0,1,0,0|1,0,1]=4 41 B12R2.2 C1=CC=C(C2CCNC2)C=C1 22374 [0,0,0,2,0,0|2,0,0]=4 42 B12R2.2 C1=CC=C(C2CCNC2)C=C1 30375 [0,0,0,2,0,0|2,0,0]=4 43 B12R2.2 C1=CC=C(N2CCCC2)C=C1 9192 [0,0,0,2,0,0|2,0,0]=4 44 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 15596 [0,0,0,2,0,0|2,0,0]=4 45 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 23243 [0,0,0,2,0,0|2,0,0]=4 46 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 15595 [0,0,0,2,0,0|2,0,0]=4 47 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 23242 [0,0,0,2,0,0|2,0,0]=4 48 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 18577 [0,0,0,2,0,0|2,0,0]=4 49 B12R2.41 C1=CC2=C(C=C1)CCNCC2 17660 [0,0,0,2,0,0|2,0,0]=4 50 B12R2.41 C1=CC2=C(C=C1)CCNCC2 27339 [0,0,0,2,0,0|2,0,0]=4 51 B12R2.24 CC1CCC2=CC=CC=C2N1 7515 [0,0,0,2,0,0|1,0,1]=4 52 B12R2.1081 CC1NCCC2=CC=CC=C21 13018 [0,0,0,2,0,0|2,0,0]=4 53 B12R2.1081 NC1CCCC2=CC=CC=C21 14041 [0,0,0,2,0,0|2,0,0]=4 54 B12R2.1081 N[C@@H]1CCCC2=CC=CC=C21 13011 [0,0,0,2,0,0|2,0,0]=4 55 B12R2.1081 N[C@H]1CCCc2ccccc21 11534 [0,0,0,2,0,0|2,0,0]=4 56 B12R2.1081 O=C1C=CC=C2NCCCN12 27713 [0,0,0,2,0,0|2,0,0]=4 57 B12R2.1081 O=C1CCCC2=C1C=CC=N2 22315 [0,0,0,2,0,0|1,0,1]=4 58 B12R2.1081 O=C1CCCC2=CC=CC=C12 13786 [0,0,0,2,0,0|0,0,2]=4 59 B12R2.1081 OC1=CC=CC2=C1CCCC2 22497 [0,0,0,2,0,0|0,0,2]=4 60 B12R2.44 O=CC1=CC=C2CCCC2=C1 21537 [0,0,0,2,0,0|0,0,2]=4 61 B12R2.18 CC1CC2=CC=CC=C2C1=O 2387 [0,0,0,2,0,0|0,0,2]=4