0 B11R1.40 c1ccc(cc1)C[C@@H](CO)N ACT02363 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.40 c1ccc(cc1)C[C@H](CO)N ACT03137 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.17 C=CCOc1ccccc1 ACT11556 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.17 CCCCc1ccccn1 ACT09789 [1,0,0,0,0,0|2,0,0]=3 4 B10R1.17 CCCCc1cccnc1 ACT09823 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.17 CNCCc1ccccn1 ACT05580 [1,0,0,0,0,0|1,0,0]=2 6 B10R1.17 CNCCc1ccccn1 ACT05583 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.17 CNCCc1ccncc1 ACT01599 [1,0,0,0,0,0|1,0,0]=2 8 B10R1.18 CC(=O)Cc1ccncc1 ACT03946 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.18 C[C@H](Cc1ccccc1)N ACT09042 [1,0,0,0,0,0|0,0,0]=1 10 B10R1.18 c1ccc(cc1)CC(=O)N ACT04844 [1,0,0,0,0,0|1,0,1]=3 11 B12R1.32 CN(CCN)Cc1ccccc1 ACT08553 [0,1,0,0,0,0|2,0,0]=3 12 B12R1.34 COC(=O)C(c1ccccc1)N ACT07168 [0,1,0,0,0,0|2,0,1]=4 13 B12R1.34 COC(=O)[C@@H](c1ccccc1)N ACT07454 [0,1,0,0,0,0|2,0,1]=4 14 B12R1.43 c1ccc(cc1)CC(C(=O)O)N ACT07262 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)N ACT08578 [0,1,0,0,0,0|3,0,0]=4 16 B12R1.49 COC(=O)Cc1ccc(cc1)F ACT09576 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.49 c1cc(ccc1CC(=O)NN)F ACT09570 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.49 c1cc(ccc1C[C@@H](CO)N)O ACT04173 [0,1,0,0,0,0|3,0,0]=4 19 B12R2.18 c1ccc2c(c1)CC(C2=O)Br ACT04557 [0,0,0,1,0,0|3,0,0]=4 20 B10R1.15 C#CC(c1ccccc1)O ACT09707 [0,0,0,0,1,0|2,0,1]=4 21 B10R1.15 c1ccc(cc1)[C@@H](CO)N ACT03157 [0,0,0,0,1,0|3,0,0]=4 22 B10R1.15 c1ccc(cc1)[C@H](CO)N ACT02360 [0,0,0,0,1,0|3,0,0]=4 23 B9R0.45 CCCC\C=C\C=C\C=O ACT06049 [1,0,1,0,0,0|2,0,0]=4 24 B9R1.8 C=CCc1ccccc1 ACT11557 [2,0,0,0,0,0|0,0,2]=4 25 B9R1.8 CNCc1ccccc1 ACT05529 [2,0,0,0,0,0|0,0,0]=2 26 B9R1.8 CSSc1ccccc1 ACT06218 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.8 c1cc(cnc1)CCN ACT01355 [2,0,0,0,0,0|1,0,0]=3 28 B9R1.8 c1ccc(cc1)CCBr ACT03430 [2,0,0,0,0,0|1,0,0]=3 29 B9R1.8 c1ccc(cc1)CCCl ACT03431 [2,0,0,0,0,0|1,0,0]=3 30 B9R1.8 c1ccc(cc1)CCS ACT06273 [2,0,0,0,0,0|1,0,0]=3 31 B9R1.8 c1ccnc(c1)CCBr ACT10142 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.8 c1cnccc1CCN ACT01588 [2,0,0,0,0,0|1,0,0]=3 33 B9R1.8 c1cnccc1CCO ACT09815 [2,0,0,0,0,0|2,0,0]=4 34 B11R1.16 c1ccc(cc1)C(CCCl)O ACT09179 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.28 c1ccc(cc1)CCCCBr ACT04260 [1,1,0,0,0,0|1,0,0]=3 36 B11R1.28 c1ccc(cc1)CCCCO ACT04259 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.28 c1ccc(cc1)CNCCN ACT02818 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.28 c1ccc(cc1)COCCBr ACT08864 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.28 c1cnccc1CCCCCl ACT04426 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.20 CC(=O)Cc1ccc(cc1)Br ACT08474 [1,1,0,0,0,0|1,0,1]=4 41 B11R1.157 c1cc(cc(c1)Cl)CC(=O)N ACT09874 [1,1,0,0,0,0|1,0,1]=4 42 B11R1.509 C[N+](C)(C)Cc1ccccc1 ACT05641 [1,1,0,0,0,0|1,0,0]=3 43 B11R1.7 CC(C#C)(c1ccccc1)O ACT08085 [0,1,0,0,1,0|1,0,1]=4 44 B13R1.91 CC(Cc1ccccc1OC)NC ACT05748 [0,2,0,0,0,0|0,0,0]=2 45 B11R2.10 CC1Cc2ccccc2O1 ACT04628 [1,0,0,1,0,0|1,0,0]=3 46 B13R2.33 c1ccc2c(c1)CNC(=O)CN2 ACT09085 [0,0,0,1,0,1|1,0,1]=4 47 B13R2.31 c1ccc(cc1)CN2CC(C2)O ACT11096 [0,1,0,1,0,0|2,0,0]=4 48 B13R2.3028 CC1Cc2ccc(cc2C1=O)Br ACT04545 [0,1,0,1,0,0|2,0,0]=4 49 B13R2.3028 CC1Cc2ccc(cc2C1=O)F ACT04547 [0,1,0,1,0,0|2,0,0]=4 50 B13R2.4856 CC1Cc2cccc(c2C1=O)Br ACT04562 [0,1,0,1,0,0|2,0,0]=4 51 B13R2.4856 CC1Cc2cccc(c2C1=O)Cl ACT04546 [0,1,0,1,0,0|2,0,0]=4 52 B13R2.4856 CC1Cc2cccc(c2C1=O)F ACT04561 [0,1,0,1,0,0|2,0,0]=4 53 B13R2.5190 CC1Cc2cc(ccc2C1=O)Br ACT04552 [0,1,0,1,0,0|2,0,0]=4 54 B13R2.5190 CC1Cc2cc(ccc2C1=O)Cl ACT04551 [0,1,0,1,0,0|2,0,0]=4 55 B13R2.5190 CC1Cc2cc(ccc2C1=O)F ACT04548 [0,1,0,1,0,0|2,0,0]=4 56 B13R2.222 CC1(Nc2ccccc2CO1)C ACT09807 [0,1,0,1,0,0|2,0,0]=4 57 B13R2.4825 CC1Cc2c(cccc2Br)C1=O ACT04556 [0,1,0,1,0,0|2,0,0]=4 58 B13R2.4825 CC1Cc2c(cccc2Cl)C1=O ACT04554 [0,1,0,1,0,0|2,0,0]=4 59 B13R2.4825 CC1Cc2c(cccc2F)C1=O ACT04550 [0,1,0,1,0,0|2,0,0]=4 60 B9R1.12 CCCCc1ccsc1 ACT11573 [1,0,0,0,1,0|2,0,0]=4 61 B9R1.6 CN(C)c1ccncc1 ACT01613 [1,0,0,0,1,0|2,0,0]=4 62 B9R1.6 C[C@@H](c1ccccn1)N ACT09467 [1,0,0,0,1,0|1,0,0]=3 63 B9R1.6 C[C@H](c1ccccc1)N ACT09657 [1,0,0,0,1,0|0,0,0]=2