0 B10R1.18 c1cc(cnc1)CC(=N)N ZERO/010345 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.18 c1ccnc(c1)CC(=N)N ZERO/010094 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.8 c1cc(cnc1)CC#N ZERO/010412 [1,0,0,0,0,0|2,0,1]=4 3 B9R1.8 c1ccnc(c1)CCBr ZERO/009228 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.8 c1ccnc(c1)CCCl ZERO/009177 [1,0,0,0,0,0|2,0,1]=4 5 B9R1.8 c1cnccc1CCN ZERO/008451 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.20 c1cc(ncc1CC(=O)O)Cl ZERO/010378 [0,1,0,0,0,0|1,0,0]=2 7 B11R1.36 c1ccc(cc1)C(C(=N)N)O ZERO/009752 [0,1,0,0,0,0|2,0,0]=3 8 B11R1.86 CC(=O)Nc1ccncc1Br ZERO/009982 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.86 c1cc(=O)n(nc1)CC(=O)O ZERO/008198 [0,1,0,0,0,0|2,0,0]=3 10 B9R1.6 c1ccnc(c1)C(=S)N ZERO/009751 [0,0,0,0,1,0|2,1,0]=4 11 B9R1.6 c1cncnc1C(=O)O ZERO/009348 [0,0,0,0,1,0|2,0,0]=3 12 B9R1.13 CC(=O)Cn1cccn1 ZERO/008142 [0,0,0,0,1,0|3,0,0]=4 13 B9R1.13 c1c(ncs1)CC(=O)O ZERO/009769 [0,0,0,0,1,0|2,0,0]=3 14 B9R1.13 c1cn(nn1)CC(=O)O ZERO/010633 [0,0,0,0,1,0|3,0,0]=4 15 B11R1.91 c1ccc(cc1)SCC(=O)O ZERO/001476 [0,0,0,0,0,1|0,0,0]=1 16 B11R1.91 c1ccnc(c1)CCC(=O)O ZERO/009473 [0,0,0,0,0,1|1,0,0]=2 17 B11R1.91 c1ccnc(c1)CCC(=S)N ZERO/010002 [0,0,0,0,0,1|2,1,0]=4 18 B11R1.91 c1cnccc1CCC(=O)O ZERO/004673 [0,0,0,0,0,1|1,0,0]=2 19 B10R1.17 c1ccc(cc1)CN=C=S ZERO/008132 [1,1,0,0,0,0|0,1,1]=4 20 B10R1.13 c1cc(=O)[nH]nc1C(=O)O ZERO/006478 [0,1,0,0,1,0|2,0,0]=4 21 B10R1.13 c1cc(ncc1C(=O)O)O ZERO/005644 [0,1,0,0,1,0|1,0,0]=3 22 B10R1.61 Cc1ccncc1C(=O)O ZERO/009371 [0,1,0,0,1,0|1,0,0]=3 23 B10R1.61 c1c(c(ncn1)N)C(=O)O ZERO/008490 [0,1,0,0,1,0|2,0,0]=4 24 B10R1.61 c1cnc(c(n1)C(=O)O)O ZERO/010099 [0,1,0,0,1,0|2,0,0]=4 25 B10R1.61 c1cncc(c1C(=O)O)Br ZERO/008524 [0,1,0,0,1,0|1,0,0]=3 26 B10R1.61 c1cncc(c1N)C(=O)O ZERO/010694 [0,1,0,0,1,0|1,0,0]=3 27 B10R1.113 c1cnc(cc1N)C(=O)O ZERO/010331 [0,1,0,0,1,0|1,0,0]=3 28 B10R1.23 CC(C(=O)O)n1cccc1 ZERO/005063 [0,1,0,0,1,0|1,0,0]=3 29 B10R1.27 CCC(=O)Cc1ccco1 ZERO/009248 [0,1,0,0,1,0|2,0,0]=4 30 B10R1.54 Cc1cc(n[nH]1)CC(=O)O ZERO/008195 [0,1,0,0,1,0|2,0,0]=4 31 B10R1.54 Cc1nc(co1)CC(=O)O ZERO/009768 [0,1,0,0,1,0|2,0,0]=4 32 B10R1.54 Cc1nc(cs1)CC(=O)O ZERO/009784 [0,1,0,0,1,0|2,0,0]=4 33 B10R1.54 c1c([nH][nH]c1=O)CC(=O)O ZERO/008912 [0,1,0,0,1,0|2,0,0]=4 34 B12R1.21 c1cc(ccc1CCC(=O)O)Cl ZERO/008485 [0,1,0,0,0,1|0,0,0]=2 35 B12R1.21 c1cc(ccc1CCC(=O)O)N ZERO/005990 [0,1,0,0,0,1|0,0,0]=2 36 B12R1.21 c1cc(ccc1N)OCC(=O)O ZERO/001282 [0,1,0,0,0,1|0,0,0]=2 37 B12R1.43 CC(=O)C(Cc1ccccc1)N ZERO/008833 [0,1,0,0,0,1|1,0,0]=3 38 B12R1.107 CC(c1ccccc1)NC(=N)N ZERO/010619 [0,1,0,0,0,1|2,0,0]=4 39 B12R1.107 c1ccc(cc1)C(CC(=O)O)N ZERO/001726 [0,1,0,0,0,1|0,0,0]=2 40 B12R1.107 c1ccc(cc1)C(C[N+](=O)[O-])O ZERO/001773 [0,1,0,0,0,1|1,0,1]=4 41 B12R1.226 Cc1cccc(n1)\C=C\C(=O)O ZERO/010638 [0,1,0,0,0,1|1,0,1]=4 42 B12R1.226 c1cc(cc(c1)F)CCC(=O)O ZERO/004851 [0,1,0,0,0,1|0,0,0]=2 43 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl ZERO/009900 [0,1,0,0,0,1|1,0,1]=4 44 B12R1.49 c1cc(ccc1C\C(=N\O)\N)Cl ZERO/011170 [0,2,0,0,0,0|1,0,0]=3 45 B12R1.106 c1cc(ccc1CS(=O)(=O)Cl)F ZERO/009567 [0,2,0,0,0,0|1,0,1]=4 46 B12R1.233 Cc1ncc(c(n1)O)CC(=O)O ZERO/011047 [0,2,0,0,0,0|2,0,0]=4 47 B12R1.233 c1c(c(=O)[nH]c(=O)[nH]1)CC(=O)O ZERO/010256 [0,2,0,0,0,0|2,0,0]=4 48 B12R1.233 c1c(c(nc(n1)N)O)CC(=O)O ZERO/009942 [0,2,0,0,0,0|2,0,0]=4 49 B12R1.253 CC(=O)C(C)(c1cccnc1)O ZERO/005612 [0,2,0,0,0,0|2,0,0]=4 50 B12R1.478 CC(=O)C(C#N)c1ccccc1 ZERO/001697 [0,2,0,0,0,0|1,0,0]=3 51 B12R1.194 CC(Cc1ccccc1)(C#C)O ZERO/005514 [0,2,0,0,0,0|1,0,1]=4 52 B12R1.75 CC(=O)Oc1ccccc1CN ZERO/010687 [0,2,0,0,0,0|2,0,0]=4 53 B12R1.127 c1c(c(=O)[nH][nH]c1=O)CC(=O)O ZERO/008575 [0,2,0,0,0,0|2,0,0]=4 54 B12R1.119 c1cc(cc(c1)Cl)CS(=O)(=O)Cl ZERO/009514 [0,2,0,0,0,0|1,0,1]=4 55 B12R2.606 Cc1cc2cc(ccc2o1)N ZERO/006154 [0,1,0,1,0,0|1,0,1]=4 56 B12R2.606 Cc1nc2ccc(cc2o1)N ZERO/004904 [0,1,0,1,0,0|2,0,0]=4 57 B12R2.606 c1cc2c(cc1Cl)nc(o2)Cl ZERO/009677 [0,1,0,1,0,0|2,0,0]=4 58 B12R2.606 c1cc2c(cc1F)CC(=O)N2 ZERO/009566 [0,1,0,1,0,0|1,0,0]=3 59 B12R2.606 c1cc2c(cc1N)[nH]c(=O)[nH]2 ZERO/004605 [0,1,0,1,0,0|2,0,0]=4 60 B12R2.606 c1cc2c(cc1O)sc(=O)o2 ZERO/004613 [0,1,0,1,0,0|1,0,0]=3 61 B12R2.32 c1ccc2c(c1)CC(O2)CN ZERO/005839 [0,1,0,1,0,0|1,0,1]=4 62 B12R2.32 c1ccc2c(c1)[nH]c(n2)CO ZERO/006134 [0,1,0,1,0,0|2,0,0]=4 63 B12R2.32 c1ccc2c(c1)nc(o2)CN ZERO/009676 [0,1,0,1,0,0|2,0,0]=4 64 B12R2.202 Cc1cc2cccc(c2o1)N ZERO/006178 [0,1,0,1,0,0|1,0,1]=4 65 B12R2.202 c1cc2c(c(c1)Cl)oc(n2)N ZERO/010817 [0,1,0,1,0,0|2,0,0]=4 66 B8R1.7 c1c[nH]nc1C(=O)O ZERO/001694 [0,0,0,0,2,0|2,0,0]=4 67 B8R1.7 c1cnsc1C(=O)O ZERO/004967 [0,0,0,0,2,0|2,0,0]=4 68 B12R1.252 CC(=O)CCCc1ccccn1 ZERO/009547 [0,0,0,0,0,2|2,0,0]=4 69 B12R1.252 c1ccnc(c1)CCCC(=O)O ZERO/008945 [0,0,0,0,0,2|1,0,0]=3 70 B12R1.252 c1cnccc1CCCC(=O)O ZERO/008953 [0,0,0,0,0,2|1,0,0]=3