0 B10R1.66 CC(=O)\C=C\C1=CC=CO1 CS-0181800 [0,0,0,0,0,0|0,0,0]=0 1 B10R1.66 CC(C)SCC1=CC=CO1 CS-W017994 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.66 O=C(O)C#CC1=CC=CS1 CS-0122133 [0,0,0,0,0,0|1,1,2]=4 3 B10R1.66 O=C(O)\C=C\C1=CN=CN1 CS-0059340 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.66 O=C(O)\C=C\C1=CN=CN1 CS-0138454 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.66 O=C(O)\C=C\C1=CN=CS1 CS-0373319 [0,0,0,0,0,0|2,1,0]=3 6 B10R1.66 O=C(O)\C=C\C1=CNC=C1 CS-0996830 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.66 O=[N+]([O-])\C=C\C1=COC=C1 CS-0694757 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.66 OB(O)\C=C\C1=CC=CS1 CS-0684461 [0,0,0,0,0,0|2,1,1]=4 9 B11R1.35 [C@@H](N)(CC1=CC=CO1)C(=O)O CS-0043946 [0,1,0,0,0,0|1,0,2]=4 10 B11R1.75 CC1=CC=C(CCC(=O)O)O1 CS-0218022 [0,1,0,0,0,0|1,0,2]=4 11 B11R1.75 CC1=NC(\C=C\C(=O)O)=CS1 CS-0282247 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.75 CN1C=CC(\C=C\C(=O)O)=C1 CS-0345092 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.75 CN1C=CC(\C=C\C(=O)O)=N1 CS-0634435 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.75 O=C(O)\C=C\C1=CC(Br)=CO1 CS-0675362 [0,1,0,0,0,0|1,0,0]=2 15 B11R1.75 O=C(O)\C=C\C1=CSC(Br)=C1 CS-0867532 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.90 CN1C=NC=C1\C=C\C(=O)O CS-0489208 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.90 O=C(O)\C=C\C1=C(Br)C=CO1 CS-0675360 [0,1,0,0,0,0|1,0,0]=2 18 B11R2.36 BrC1=CN2C=CC=C2C=C1 CS-0498323 [0,0,0,1,0,0|2,0,1]=4 19 B11R2.36 NC1=CC=C2NC=CC2=N1 CS-0020107 [0,0,0,1,0,0|3,0,0]=4 20 B9R1.13 CC(=O)NC1=NNC=C1 CS-0206105 [0,0,0,0,1,0|3,0,0]=4 21 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 CS-0059288 [0,0,0,0,0,1|2,0,0]=3 22 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 CS-W018211 [0,0,0,0,0,1|2,0,0]=3 23 B11R1.91 O=C(O)\C=C\C1=CN=CN=C1 CS-0311604 [0,0,0,0,0,1|3,0,0]=4 24 B10R1.54 CC(=O)CC1=NC=C(C)O1 CS-0255939 [0,1,0,0,1,0|1,0,1]=4 25 B12R1.21 CC(=O)\C=C\C1=NC=C(C)C=C1 CS-0324353 [0,1,0,0,0,1|1,0,0]=3 26 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)N=C1 CS-0368791 [0,1,0,0,0,1|2,0,0]=4 27 B12R1.21 O=C(O)\C=C\C1=CN=C(Cl)C=C1 CS-0211692 [0,1,0,0,0,1|2,0,0]=4 28 B12R1.27 COC(=O)\C=C\C1=CN=CC=C1 CS-0150952 [0,1,0,0,0,1|1,0,0]=3 29 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 CS-0308399 [0,1,0,0,0,1|1,0,1]=4 30 B12R1.125 O=C(O)\C=C\C1=C(Cl)N=CC=C1 CS-0245779 [0,1,0,0,0,1|2,0,0]=4 31 B12R1.226 C(C(=O)O)=CC1=CC(Cl)=CC=C1 CS-W017081 [0,1,0,0,0,1|2,0,0]=4 32 B12R1.226 CC(=O)\C=C\C1=NC(Br)=CC=C1 CS-0272001 [0,1,0,0,0,1|1,0,0]=3 33 B12R1.226 CC1=CC(\C=C\C(=O)O)=CN=C1 CS-0867531 [0,1,0,0,0,1|2,0,0]=4 34 B12R1.226 CC1=NC=CC(\C=C\C(=O)O)=C1 CS-0368788 [0,1,0,0,0,1|2,0,0]=4 35 B12R1.226 O=C(O)\C=C\C1=CC(Br)=NC=C1 CS-0261473 [0,1,0,0,0,1|2,0,0]=4 36 B12R1.226 O=C(O)\C=C\C1=CC=NC(Cl)=C1 CS-0867535 [0,1,0,0,0,1|2,0,0]=4 37 B12R1.226 O=C(O)\C=C\C1=NC(Cl)=CC=C1 CS-0693862 [0,1,0,0,0,1|2,0,0]=4 38 B12R1.51 CCOC(=O)\C=C\C1=CSC=C1 CS-0159399 [0,2,0,0,0,0|2,0,0]=4 39 B10R1.61 CC(=O)C1=C(Br)C=CN=C1 CS-0634224 [0,0,1,1,0,0|2,0,0]=4 40 B10R1.61 CC(=O)C1=CC=NC=C1C CS-0238561 [0,0,1,1,0,0|1,0,1]=4 41 B10R1.61 CS(=O)C1=CC=CC=C1O CS-0213158 [0,0,1,1,0,0|1,0,0]=3 42 B10R1.61 O=C(O)C1=C(F)C=CC=C1 CS-0188334 [0,0,1,1,0,0|2,0,0]=4 43 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 CS-W018028 [0,0,1,1,0,0|1,0,0]=3 44 B10R1.113 CC(=O)C1=NC=CC(F)=C1 CS-0834797 [0,0,1,1,0,0|2,0,0]=4 45 B10R1.113 C[C@H](N)C1=CC(O)=CC=C1 CS-B0172 [0,0,1,1,0,0|1,0,1]=4 46 B10R2.7 C1=CC2=C(C=CO2)C=N1 CS-0084800 [1,0,0,1,0,0|1,0,1]=4 47 B10R2.7 C1=CC2=C(N=C1)OC=C2 CS-0209058 [1,0,0,1,0,0|1,0,1]=4 48 B12R2.44 OCC1=CC=C2OC=NC2=C1 CS-0311008 [0,1,0,1,0,0|2,0,0]=4 49 B12R2.606 FC1=CC=C2OC(Br)=CC2=C1 CS-0067182 [0,1,0,1,0,0|1,0,1]=4 50 B12R2.246 ClC1=C2OC=CC2=CC(Br)=C1 CS-0270973 [0,1,0,1,0,0|1,0,1]=4 51 B8R1.7 CC(=O)C1=CN=CO1 CS-0308800 [0,0,0,0,2,0|1,0,0]=3 52 B12R1.252 O=C(O)\C=C\CC1=CC=CC=C1 CS-0269761 [0,0,0,0,0,2|2,0,0]=4