0 B9R1.12 c1cc([nH]c1)\C=C\C=O A2Z00094927 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.12 c1cc(oc1)\C=C\C=O A2Z00094719 [0,0,0,0,0,0|0,0,0]=0 2 B9R1.12 c1cc(sc1)\C=C\C#N A2Z00094589 [0,0,0,0,0,0|1,1,1]=3 3 B8R1.8 c1cc(sc1)N=C=O A2Z00096018 [1,0,0,0,0,0|1,1,1]=4 4 B10R1.21 C=CCNCc1ccco1 A2Z00048061 [0,1,0,0,0,0|1,0,2]=4 5 B10R1.66 c1cc([nH]c1)CCC(=O)O A2Z00094982 [0,1,0,0,0,0|1,0,2]=4 6 B10R1.66 c1cc([nH]c1)\C=C\C(=O)O A2Z00094929 [0,1,0,0,0,0|1,0,0]=2 7 B10R1.66 c1cc(oc1)CCC(=O)O A2Z00095303 [0,1,0,0,0,0|0,0,2]=3 8 B10R1.66 c1cc(oc1)\C=C\C(=O)Cl A2Z00095952 [0,1,0,0,0,0|0,0,0]=1 9 B10R1.66 c1cc(oc1)\C=C\C(=O)O A2Z00085545 [0,1,0,0,0,0|0,0,0]=1 10 B10R1.66 c1cc(sc1)CCC(=O)O A2Z00095188 [0,1,0,0,0,0|0,1,2]=4 11 B10R1.66 c1cc(sc1)\C=C\C(=O)O A2Z00096656 [0,1,0,0,0,0|0,1,0]=2 12 B10R1.66 c1cscc1\C=C\C(=O)O A2Z00096366 [0,1,0,0,0,0|2,0,0]=3 13 B10R2.7 c1c[nH]c2c1cncc2 A2Z00096240 [0,0,0,1,0,0|3,0,0]=4 14 B10R2.7 c1cc2c(cc[nH]2)nc1 A2Z00096241 [0,0,0,1,0,0|2,0,0]=3 15 B10R2.7 c1cc2cc[nH]c2nc1 A2Z00096086 [0,0,0,1,0,0|3,0,0]=4 16 B10R1.17 c1ccc(cc1)\C=C\C=O A2Z00038623 [0,0,0,0,0,1|1,0,0]=2 17 B7R1.1 c1cscc1C=O A2Z00050189 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.11 c1cc(oc1)C(=O)NN A2Z00053062 [1,1,0,0,0,0|2,0,0]=4 19 B9R1.13 c1cc(oc1)CC(=O)O A2Z00061737 [1,1,0,0,0,0|0,0,1]=3 20 B9R1.13 c1cc(sc1)CC(=O)Cl A2Z00094074 [1,1,0,0,0,0|0,1,1]=4 21 B9R1.13 c1cc(sc1)CC(=O)N A2Z00095950 [1,1,0,0,0,0|0,1,1]=4 22 B9R1.13 c1cc(sc1)CC(=O)O A2Z00095935 [1,1,0,0,0,0|0,1,1]=4 23 B11R1.40 C\C(=C/c1ccccc1)\C=O A2Z00038627 [0,1,0,0,0,1|1,0,0]=3 24 B11R1.91 c1cc(cnc1)\C=C\[N+](=O)[O-] A2Z00049852 [0,1,0,0,0,1|2,0,0]=4 25 B11R1.91 c1cnccc1\C=C\C(=O)O A2Z00094281 [0,1,0,0,0,1|1,0,0]=3 26 B11R1.91 c1cnccc1\C=C\[N+](=O)[O-] A2Z00095132 [0,1,0,0,0,1|2,0,0]=4 27 B11R1.25 COC(=O)\C=C\c1cccs1 A2Z00096369 [0,2,0,0,0,0|0,1,0]=3 28 B11R1.25 COC(=O)\C=C\c1ccsc1 A2Z00050484 [0,2,0,0,0,0|2,0,0]=4 29 B11R1.25 c1cc(oc1)CNC(=O)CCl A2Z00056809 [0,2,0,0,0,0|1,0,1]=4 30 B11R1.35 C\C(=C/c1cccs1)\C(=O)O A2Z00046433 [0,2,0,0,0,0|0,1,0]=3 31 B9R1.2 CCc1cccc(c1)O A2Z00038644 [0,0,1,1,0,0|1,0,1]=4 32 B9R1.2 CNc1cccc(c1)O A2Z00057021 [0,0,1,1,0,0|2,0,0]=4 33 B9R1.2 COc1cccc(c1)O A2Z00093458 [0,0,1,1,0,0|2,0,0]=4 34 B9R1.2 c1cc(cc(c1)O)C=O A2Z00093516 [0,0,1,1,0,0|0,0,0]=2 35 B9R1.15 c1ccc(c(c1)C=O)O A2Z00038632 [0,0,1,1,0,0|2,0,0]=4 36 B9R1.69 Cc1cc(ccc1N)O A2Z00093480 [0,0,1,1,0,0|1,0,1]=4 37 B9R1.69 c1cc(c(cc1O)O)Cl A2Z00038651 [0,0,1,1,0,0|2,0,0]=4 38 B9R1.1 COc1ccc(cc1)O A2Z00093524 [0,0,1,1,0,0|0,0,2]=4 39 B11R2.2 c1cc(oc1)c2cc[nH]n2 A2Z00087207 [0,1,0,1,0,0|1,0,0]=3 40 B11R2.106 C[n+]1cccc2c1cc[nH]2 A2Z00096715 [0,1,0,1,0,0|2,0,0]=4 41 B11R2.106 c1cc2c(cco2)c(c1)Br A2Z00050270 [0,1,0,1,0,0|1,0,0]=3 42 B11R2.10 Cc1cc2ccccc2s1 A2Z00094894 [0,1,0,1,0,0|1,1,0]=4 43 B11R2.10 Cc1cc2ccccn2c1 A2Z00050436 [0,1,0,1,0,0|2,0,0]=4 44 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 A2Z00069818 [0,1,0,1,0,0|2,0,0]=4 45 B11R2.191 c1csc2n1c(cn2)C=O A2Z00069923 [0,1,0,1,0,0|1,1,0]=4 46 B11R2.36 Cc1ccc2ccoc2c1 A2Z00096336 [0,1,0,1,0,0|1,0,0]=3 47 B11R2.36 c1cc(cc2c1cc[nH]2)Cl A2Z00095941 [0,1,0,1,0,0|2,0,0]=4 48 B11R2.36 c1cc(cc2c1cco2)Br A2Z00096386 [0,1,0,1,0,0|1,0,0]=3 49 B11R2.36 c1cc2c(cc1O)nco2 A2Z00070114 [0,1,0,1,0,0|1,0,1]=4 50 B11R2.36 c1cc2c(cc[nH]2)cc1Br A2Z00097905 [0,1,0,1,0,0|2,0,0]=4 51 B11R2.36 c1cc2c(cc[nH]2)cc1N A2Z00096013 [0,1,0,1,0,0|2,0,0]=4