0 B10R1.61 CC(=O)C1=CC=CC=C1O Amb2792764 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.61 O=C(O)C1=CC=CC=C1O Amb1912504 [0,0,0,0,0,0|0,0,0]=0 2 B10R1.61 O=C(O)C1=CC=NC=C1O Amb2609529 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.6 NC(=O)C1=CC=CN=C1 Amb2609940 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.6 O=C(O)C1=CC=CC=N1 Amb1227737 [1,0,0,0,0,0|1,0,0]=2 5 B9R1.6 O=C(O)C1=CC=NC=C1 Amb2609990 [1,0,0,0,0,0|1,0,0]=2 6 B9R1.15 OCC1=CC=CC=C1O Amb3940117 [1,0,0,0,0,0|0,0,1]=2 7 B11R1.53 COC1=C(C(=O)O)C=CC=N1 Amb1130324 [0,1,0,0,0,0|1,0,0]=2 8 B11R1.53 COC1=CC=CC=C1C(=O)O Amb2592793 [0,1,0,0,0,0|0,0,0]=1 9 B11R1.53 COC1=CN=CC=C1C(=O)O Amb16230607 [0,1,0,0,0,0|1,0,0]=2 10 B11R1.156 CC(=O)C1=C(O)C=CC=C1O Amb2609021 [0,1,0,0,0,0|1,0,0]=2 11 B11R1.166 CC(=O)C1=CC=C(O)C=C1O Amb1811488 [0,1,0,0,0,0|1,0,0]=2 12 B11R1.166 CC1=CC(=O)C(C(=O)O)=CN1 Amb19516671 [0,1,0,0,0,0|1,0,1]=3 13 B11R1.166 CC1=CC=C(C(=O)O)C(C)=C1 Amb3940029 [0,1,0,0,0,0|1,0,0]=2 14 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 Amb3939631 [0,1,0,0,0,0|2,0,1]=4 15 B11R1.166 O=C(O)C1=CC=C(O)C=C1O Amb1934138 [0,1,0,0,0,0|0,0,0]=1 16 B11R1.167 CC1=CC=C(O)C=C1C(=O)O Amb8384398 [0,1,0,0,0,0|1,0,0]=2 17 B11R1.167 O=C(O)C1=CC(O)=CC=C1O Amb6491145 [0,1,0,0,0,0|0,0,0]=1 18 B11R1.222 COC(=O)C1=C(C)N=CC=C1 Amb8396132 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.222 COC(=O)C1=CC=CC=C1O Amb1200750 [0,1,0,0,0,0|0,0,0]=1 20 B8R1.5 O=C1C=COC=C1O Amb19133754 [2,0,0,0,0,0|1,0,0]=3 21 B8R1.5 OC1=CC=CC=C1O Amb2609033 [2,0,0,0,0,0|0,0,0]=2 22 B10R1.13 CC1=CC=C(C(=O)O)C=C1 Amb2609016 [1,1,0,0,0,0|0,0,0]=2 23 B10R1.13 NC(=O)C1=CC=C(O)C=C1 Amb1240570 [1,1,0,0,0,0|1,0,0]=3 24 B10R1.15 CCC(=O)C1=CC=CC=C1 Amb4037285 [1,1,0,0,0,0|1,0,0]=3 25 B10R1.15 CNC(=O)C1=CC=CC=C1 Amb2591685 [1,1,0,0,0,0|1,0,0]=3 26 B10R1.113 CC(=O)C1=NC(C)=CC=C1 Amb10069245 [1,1,0,0,0,0|2,0,0]=4 27 B10R1.113 CC1=CC(C(=O)O)=CN=C1 Amb2694191 [1,1,0,0,0,0|1,0,0]=3 28 B10R1.113 CN1C=CC=C(C(=O)O)=C1 Amb2613156 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.113 CN1C=CC=C(C(=O)O)=C1 Amb2708577 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.25 O=CC1=CC=C(O)C=C1O Amb1934278 [1,1,0,0,0,0|0,0,0]=2 31 B12R1.127 O=C(O)CC1=CC(O)=CC=C1O Amb3499427 [0,1,0,0,0,1|0,0,0]=2 32 B12R1.233 O=C(O)CC1=C(O)C=C(O)C=C1 Amb18053954 [0,1,0,0,0,1|0,0,0]=2 33 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O Amb2792458 [0,2,0,0,0,0|0,0,1]=3 34 B12R1.437 COC1=CC=CC(O)=C1C(=O)O Amb2779960 [0,2,0,0,0,0|0,0,0]=2 35 B12R1.1000 CC(=O)C1=C(O)C=C(C)C=C1O Amb6298269 [0,2,0,0,0,0|1,0,0]=3 36 B12R1.1000 CC(=O)C1=C(O)C=C(C)OC1=O Amb18805778 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O Amb6356396 [0,2,0,0,0,0|1,0,0]=3 38 B12R1.1000 CC1=C(C(=O)O)C(O)=CC(O)=C1 Amb6296834 [0,2,0,0,0,0|0,0,0]=2 39 B12R1.452 COC1=CC=C(C(=O)O)C(O)=C1 Amb1802022 [0,2,0,0,0,0|0,0,0]=2 40 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 Amb6356942 [0,2,0,0,0,0|1,0,0]=3 41 B10R1.66 CC(=O)\C=C\C1=CC=CO1 Amb1153591 [0,0,1,1,0,0|1,0,0]=3 42 B10R1.8 O=CC1=CC(O)=CC(O)=C1 Amb3939820 [0,0,1,1,0,0|2,0,0]=4 43 B10R1.22 CC1=CC(O)=C(C)C(=O)O1 Amb18048438 [0,0,1,1,0,0|0,0,2]=4 44 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 Amb1802468 [0,0,0,1,0,1|2,0,0]=4 45 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 Amb18511466 [0,0,0,1,0,1|2,0,0]=4 46 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 Amb6358187 [0,0,0,1,0,1|2,0,0]=4 47 B12R2.203 O=C1CCC2=C1C(O)=CC=C2 Amb6296368 [0,1,0,1,0,0|1,0,0]=3 48 B12R2.612 O=C1CCC2=CC(O)=CC=C12 Amb2610677 [0,1,0,1,0,0|2,0,0]=4 49 B8R1.7 O=C(O)C1=CC=CO1 Amb6335264 [1,0,0,0,1,0|1,0,0]=3 50 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O Amb1935207 [0,0,0,0,0,2|0,0,0]=2