0 B11R1.28 c1ccc(cc1)CCCCO LS10545 [1,0,0,0,0,0|2,0,1]=4 1 B11R1.28 c1ccc(cc1)COCCO LS10494 [1,0,0,0,0,0|1,0,1]=3 2 B11R1.91 CC(=O)CCc1ccccc1 LS10597 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.91 CC(CCc1ccccc1)N LS10632 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.91 c1ccc(cc1)COC(=O)N LS40379 [1,0,0,0,0,0|1,0,0]=2 5 B11R1.91 c1ccc(cc1)CSC(=N)N LS11866 [1,0,0,0,0,0|2,1,0]=4 6 B11R1.91 c1ccc(cc1)\C=C\C(=O)O LS00072 [1,0,0,0,0,0|2,0,1]=4 7 B13R1.11 COC(=O)C[C@@H](c1ccccc1)N LS30298 [0,1,0,0,0,0|2,0,0]=3 8 B13R1.14 COC(=O)\C=C\c1ccc(cc1)Cl LS10204 [0,1,0,0,0,0|2,0,1]=4 9 B13R1.351 CC(=C)C(=O)OCc1ccccc1 LS11727 [0,1,0,0,0,0|0,0,1]=2 10 B10R1.17 c1ccc(cc1)C#CC=O LS11729 [2,0,0,0,0,0|1,0,1]=4 11 B12R1.8 c1ccc(cc1)COCCCBr LS10750 [1,1,0,0,0,0|0,0,1]=3 12 B12R1.8 c1ccc(cc1)COCCCO LS10749 [1,1,0,0,0,0|0,0,1]=3 13 B12R1.252 C[C@@H](COCc1ccccc1)O LS30228 [1,1,0,0,0,0|0,0,1]=3 14 B12R1.252 C[C@H](COCc1ccccc1)O LS30229 [1,1,0,0,0,0|0,0,1]=3 15 B12R1.21 CC(=O)CCc1ccc(cc1)O LS40102 [1,1,0,0,0,0|1,0,0]=3 16 B12R1.107 c1ccc(cc1)C(CC(=O)O)N LS11551 [1,1,0,0,0,0|2,0,0]=4 17 B12R1.107 c1ccc(cc1)C(CC(=O)O)O LS11565 [1,1,0,0,0,0|2,0,0]=4 18 B12R1.107 c1ccc(cc1)[C@@H](CC(=O)O)N LS30112 [1,1,0,0,0,0|2,0,0]=4 19 B12R1.107 c1ccc(cc1)[C@H](CC(=O)O)N LS30295 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.107 c1ccc(cc1)[C@H](CC(=O)O)N LS30296 [1,1,0,0,0,0|2,0,0]=4 21 B12R1.34 COC(=O)C(c1ccccc1)Br LS11730 [0,1,0,0,1,0|1,0,0]=3 22 B12R1.371 COC(=O)Cc1ccccc1O LS10128 [0,1,0,0,1,0|1,0,0]=3 23 B14R1.520 CCOC(=O)CNCc1ccccc1 LS40795 [0,1,0,0,0,1|1,0,0]=3 24 B14R1.520 CCOC(=O)COCc1ccccc1 LS10748 [0,1,0,0,0,1|0,0,0]=2 25 B14R1.743 COC(=O)CC(Cc1ccccc1)N LS10603 [0,1,0,0,0,1|2,0,0]=4 26 B14R1.29 CCOC(=O)C[C@@H](c1ccccc1)N LS30297 [0,2,0,0,0,0|1,0,0]=3 27 B14R1.502 CCOC(=O)C#Cc1ccc(cc1)Cl LS10147 [0,2,0,0,0,0|1,0,1]=4 28 B14R1.502 CCOC(=O)\C=C\c1ccc(cc1)Cl LS10205 [0,2,0,0,0,0|1,0,1]=4 29 B12R2.2 c1ccc(cc1)[C@H]2CCNC2 LS30147 [1,0,0,1,0,0|2,0,0]=4 30 B12R2.1081 CC1c2ccccc2CCN1 LS21138 [1,0,0,1,0,0|2,0,0]=4 31 B12R2.24 c1ccc2c(c1)CCC(=O)C2 LS41173 [1,0,0,1,0,0|1,0,0]=3 32 B14R2.19 c1ccc(cc1)CN2CCC(=O)C2 LS40626 [0,0,0,1,0,1|1,0,0]=3 33 B14R2.19 c1ccc(cc1)C[C@@H]2COC(=O)N2 LS30287 [0,0,0,1,0,1|2,0,0]=4 34 B14R2.19 c1ccc(cc1)C[C@H]2COC(=O)N2 LS30092 [0,0,0,1,0,1|2,0,0]=4 35 B10R1.18 CC(=O)Cc1ccncc1 LS00130 [1,0,0,0,1,0|1,0,0]=3 36 B10R1.18 c1ccc(cc1)CC(=O)N LS11701 [1,0,0,0,1,0|1,0,0]=3 37 B10R1.15 CC[C@@H](c1ccccc1)N LS30125 [0,0,0,0,2,0|1,0,1]=4 38 B10R1.15 CC[C@H](c1ccccc1)N LS30175 [0,0,0,0,2,0|1,0,1]=4 39 B10R1.15 COC(=O)c1cccnc1 LS20584 [0,0,0,0,2,0|2,0,0]=4 40 B10R1.15 c1ccc(cc1)C(=O)CBr LS11352 [0,0,0,0,2,0|1,0,0]=3 41 B10R1.15 c1ccc(cc1)C(=O)CCl LS11677 [0,0,0,0,2,0|1,0,0]=3 42 B10R1.15 c1ccc(cc1)C(=O)CO LS10613 [0,0,0,0,2,0|1,0,0]=3