0 B14R2.8235 CC1CC(=O)C2=C(O1)C=CC(=C2)F F156698 [0,0,0,0,0,0|2,0,2]=4 1 B13R2.162 C1CNC2=C(C1=O)C=C(C=C2)Cl C345305 [1,0,0,0,0,0|1,0,2]=4 2 B13R2.162 CC1=CC2=C(C=C1)OCCC2=O M135498 [1,0,0,0,0,0|1,0,2]=4 3 B13R2.162 CC1=CC2=C(CCCC2=O)C=C1 M192100 [1,0,0,0,0,0|1,0,2]=4 4 B13R2.3683 C1CC(=O)NC2=C1C=C(C=C2)Br B176141 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.3683 C1CC(=O)NC2=C1C=C(C=C2)Cl C182436 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.3683 C1CC(=O)NC2=C1C=C(C=C2)N A182929 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.3683 C1CC(=O)NC2=C1C=C(C=C2)O D155349 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CS2 M169411 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.3683 CN1CCC2=C(C1)C=CC(=C2)Br B589613 [1,0,0,0,0,0|3,0,0]=4 10 B15R2.50278 CC1CC(NC2=C1C=C(C=C2)O)(C)C T171208 [0,1,0,0,0,0|2,0,0]=3 11 B13R1.141 B(C1=C(C=CC(=C1)C)OCC)(O)O E138118 [0,0,1,0,0,0|3,0,0]=4 12 B12R1.32 CN(CCO)CC1=CC=CC=C1 M134243 [1,0,1,0,0,0|2,0,0]=4 13 B12R1.233 CC1=CC(=C(C=C1)NC(=O)C)O A167031 [1,0,1,0,0,0|1,0,1]=4 14 B12R1.17 CNCC(C1=CC(=CC=C1)O)O P106007 [1,0,1,0,0,0|2,0,0]=4 15 B12R1.17 CNCC(C1=CC(=CC=C1)O)O S161304 [1,0,1,0,0,0|2,0,0]=4 16 B12R1.17 CNCC(O)C1=CC(=CC=C1)O P408457 [1,0,1,0,0,0|2,0,0]=4 17 B12R2.24 C1CC(=O)NC2=CC=CC=C21 D336131 [2,0,0,0,0,0|1,0,1]=4 18 B12R2.24 C1CC2=C(C=CC(=C2)Br)NC1 B192132 [2,0,0,0,0,0|1,0,0]=3 19 B12R2.24 C1CC2=C(C=CC(=C2)Br)NC1 B586250 [2,0,0,0,0,0|1,0,0]=3 20 B12R2.24 C1CC2=C(C=CC(=C2)Br)OC1 B184223 [2,0,0,0,0,0|2,0,0]=4 21 B12R2.24 C1CC2=C(C=CC(=C2)F)NC1 F194112 [2,0,0,0,0,0|1,0,0]=3 22 B12R2.24 C1CC2=C(C=CC(=C2)O)NC1 H192815 [2,0,0,0,0,0|1,0,0]=3 23 B12R2.24 C1CCC2=C(C1)C=CC(=C2)N W133739 [2,0,0,0,0,0|2,0,0]=4 24 B12R2.24 C1CCC2=C(C1)C=CC(=C2)O T162495 [2,0,0,0,0,0|2,0,0]=4 25 B12R2.24 C1COC2=C(N1)C=CC(=C2)Cl C179547 [2,0,0,0,0,0|2,0,0]=4 26 B12R2.24 CC1=CC2=C(C=C1)NCCC2 M158123 [2,0,0,0,0,0|0,0,0]=2 27 B12R2.24 CC1=CC2=C(CCNC2)C=C1 M168479 [2,0,0,0,0,0|2,0,0]=4 28 B12R2.24 CC1CCC2=CC=CC=C2N1 T162315 [2,0,0,0,0,0|0,0,0]=2 29 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T102999 [2,0,0,0,0,0|2,0,0]=4 30 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T113718 [2,0,0,0,0,0|2,0,0]=4 31 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T113722 [2,0,0,0,0,0|2,0,0]=4 32 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T401554 [2,0,0,0,0,0|2,0,0]=4 33 B12R2.1081 C1CC(C2=CC=CC=C2C1)O R160835 [2,0,0,0,0,0|1,0,0]=3 34 B12R2.1081 C1CC(C2=CC=CC=C2C1)O S161373 [2,0,0,0,0,0|1,0,0]=3 35 B12R2.1081 C1CC(C2=CC=CC=C2C1)O T161537 [2,0,0,0,0,0|1,0,0]=3 36 B12R2.1081 C1CNC2=CC=CC=C2C1=O D303708 [2,0,0,0,0,0|0,0,2]=4 37 B12R2.1081 C1CNC2=CC=CC=C2C1=O D589973 [2,0,0,0,0,0|0,0,2]=4 38 B14R1.6074 B(C1=C(C=CC(=C1)C)OC(C)C)(O)O B301256 [0,1,1,0,0,0|2,0,0]=4 39 B14R2.142 COC1=CC2=C(CCCC2N)C=C1 S489461 [1,1,0,0,0,0|2,0,0]=4 40 B12R1.57 CC1=CC(=C(C=C1)C(C)C)OC I157471 [0,0,1,0,1,0|2,0,0]=4 41 B12R1.225 CC(C(C1=CC(=CC=C1)O)O)N M335883 [0,0,1,0,1,0|1,0,0]=3 42 B12R1.225 CC(C(C1=CC(=CC=C1)O)O)N M423442 [0,0,1,0,1,0|1,0,0]=3 43 B12R2.132 CC1=CC2=C(CCC2=O)C=C1 M123330 [1,0,0,0,1,0|0,0,2]=4 44 B12R2.18 C1C(C(C2=CC=CC=C21)O)Br B152972 [1,0,0,0,1,0|2,0,0]=4 45 B12R2.18 C1C(C(C2=CC=CC=C21)O)O D155713 [1,0,0,0,1,0|2,0,0]=4 46 B12R2.2028 CC1CC(=O)C2=CC=CC=C12 M123327 [1,0,0,0,1,0|0,0,2]=4 47 B12R2.606 CC1=CC2=C(C=C1)NC(=C2)C D119112 [1,0,0,0,1,0|0,0,2]=4 48 B12R2.612 C1CC2=C(C1N)C=CC(=C2)Cl C489567 [1,0,0,0,1,0|2,0,0]=4 49 B12R2.612 C1CC2=C(C1N)C=CC(=C2)Cl R489596 [1,0,0,0,1,0|2,0,0]=4 50 B12R2.612 C1CC2=C(C1N)C=CC(=C2)Cl S489584 [1,0,0,0,1,0|2,0,0]=4 51 B12R2.612 C1CC2=C(C1O)C=CC(=C2)Br B588810 [1,0,0,0,1,0|2,0,0]=4 52 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 M123329 [1,0,0,0,1,0|1,0,1]=4 53 B12R2.612 CC1CCC2=C(C1)OC=C2C M341736 [1,0,0,0,1,0|2,0,0]=4 54 B12R2.612 CN1CCC2=C1C=CC(=C2)Br B344088 [1,0,0,0,1,0|2,0,0]=4