0 B10R1.17 c1cc(cnc1)CCCBr ZERO/009226 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.17 c1ccc(cc1)CN=C=S ZERO/008132 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.17 c1ccnc(c1)CCC#N ZERO/009426 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.17 c1ccnc(c1)CCCN ZERO/004569 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.8 CNCc1cnccn1 ZERO/008678 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.8 c1cc(cnc1)CC#N ZERO/010412 [1,0,0,0,0,0|1,0,2]=4 6 B9R1.8 c1ccnc(c1)CCBr ZERO/009228 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.8 c1ccnc(c1)CCCl ZERO/009177 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.8 c1cnccc1CCN ZERO/008451 [1,0,0,0,0,0|1,0,0]=2 9 B11R1.1 Cc1ccc(cc1)OCCN ZERO/006445 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.1 c1cc(ccc1CCCN)Cl ZERO/005983 [0,1,0,0,0,0|2,0,0]=3 11 B11R1.1 c1cc(ccc1OCCN)F ZERO/006457 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.16 c1ccc(cc1)C(C#CBr)O ZERO/005372 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.17 Cc1ccccc1OCCN ZERO/006356 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.17 c1ccc(c(c1)CCCN)Cl ZERO/004980 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.24 Cc1cccc(c1)OCCN ZERO/006355 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.28 c1ccc(cc1)CCN=C=S ZERO/008133 [0,1,0,0,0,0|0,0,2]=3 17 B11R1.28 c1ccnc(c1)CCCC#N ZERO/009392 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.28 c1ccnc(c1)CCCCN ZERO/009720 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.91 c1ccc(cc1)SCC(=O)O ZERO/001476 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.91 c1ccnc(c1)CCC(=O)O ZERO/009473 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.91 c1ccnc(c1)CCC(=S)N ZERO/010002 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.91 c1cnccc1CCC(=O)O ZERO/004673 [0,1,0,0,0,0|3,0,0]=4 23 B9R1.12 c1cc(oc1)CCCN ZERO/010516 [0,0,0,0,1,0|3,0,0]=4 24 B8R1.2 CNc1cnccn1 ZERO/009603 [2,0,0,0,0,0|2,0,0]=4 25 B8R1.2 c1cnc(cn1)CN ZERO/008859 [2,0,0,0,0,0|2,0,0]=4 26 B8R1.2 c1cnccc1NN ZERO/009850 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.4 CCOc1cccnc1N ZERO/009270 [1,1,0,0,0,0|2,0,0]=4 28 B10R1.18 c1cc(cnc1)CC(=N)N ZERO/010345 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.18 c1ccnc(c1)CC(=N)N ZERO/010094 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.66 CC(CCc1ccco1)N ZERO/005387 [0,1,0,0,1,0|2,0,0]=4 31 B12R1.16 CCCC(=O)c1ccc(cc1)O ZERO/000922 [0,2,0,0,0,0|1,0,1]=4 32 B12R1.16 CNCC(=O)c1ccc(cc1)O ZERO/006246 [0,2,0,0,0,0|0,0,1]=3 33 B12R1.21 c1cc(ccc1CCC(=O)O)Cl ZERO/008485 [0,2,0,0,0,0|2,0,0]=4 34 B12R1.21 c1cc(ccc1CCC(=O)O)N ZERO/005990 [0,2,0,0,0,0|2,0,0]=4 35 B12R1.71 COc1ccc(cc1)CCCN ZERO/005927 [0,2,0,0,0,0|2,0,0]=4 36 B12R1.107 c1ccc(cc1)C(CC(=O)O)N ZERO/001726 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.107 c1ccc(cc1)C(C[N+](=O)[O-])O ZERO/001773 [0,2,0,0,0,0|1,0,1]=4 38 B12R1.121 CCCOc1ccccc1C=O ZERO/001040 [0,2,0,0,0,0|2,0,0]=4 39 B12R1.267 CCCCOc1ccccc1N ZERO/000893 [0,2,0,0,0,0|1,0,0]=3 40 B12R1.226 c1cc(cc(c1)F)CCC(=O)O ZERO/004851 [0,2,0,0,0,0|2,0,0]=4 41 B12R1.382 COc1cccc(c1)CCCN ZERO/005929 [0,2,0,0,0,0|2,0,0]=4 42 B12R1.252 CC(=O)CCCc1ccccn1 ZERO/009547 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.43 CC(=O)C(Cc1ccccc1)N ZERO/008833 [0,2,0,0,0,0|1,0,0]=3 44 B12R1.194 CC(Cc1ccccc1)(C#C)O ZERO/005514 [0,2,0,0,0,0|1,0,1]=4 45 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl ZERO/009900 [0,2,0,0,0,0|2,0,0]=4 46 B12R2.24 c1cc2c(cc1Br)CCCN2 ZERO/006244 [0,1,0,1,0,0|2,0,0]=4 47 B12R2.24 c1cc2c(cc1Br)CCCN2 ZERO/010322 [0,1,0,1,0,0|2,0,0]=4 48 B12R2.24 c1cc2c(cc1N)CCCC2 ZERO/005484 [0,1,0,1,0,0|1,0,0]=3 49 B12R2.2302 c1cc(ccc1C2CCN2)F ZERO/010389 [0,1,0,1,0,0|2,0,0]=4 50 B12R2.2 c1ccc(cc1)C2CCNC2 ZERO/010603 [0,1,0,1,0,0|0,0,0]=2 51 B12R2.1081 c1cc2c(c(c1)N)CCCC2 ZERO/005904 [0,1,0,1,0,0|1,0,0]=3 52 B12R2.1081 c1cc2c(c(c1)O)NCCC2 ZERO/008525 [0,1,0,1,0,0|2,0,0]=4 53 B12R2.32 c1ccc2c(c1)CC(O2)CN ZERO/005839 [0,1,0,1,0,0|2,0,0]=4 54 B12R2.18 Cn1c2ccccc2[nH]c1=S ZERO/006462 [0,1,0,1,0,0|1,0,1]=4 55 B8R1.8 c1c(cn[nH]1)CCN ZERO/009643 [1,0,0,0,1,0|2,0,0]=4 56 B8R1.8 c1c(nc[nH]1)CCN ZERO/004089 [1,0,0,0,1,0|2,0,0]=4 57 B8R1.8 c1cc(oc1)CCN ZERO/005328 [1,0,0,0,1,0|1,0,0]=3 58 B8R1.8 c1cc(sc1)CCN ZERO/005227 [1,0,0,0,1,0|1,0,0]=3 59 B8R1.8 c1cc(sc1)CCN ZERO/005760 [1,0,0,0,1,0|1,0,0]=3 60 B8R1.8 c1cnn(c1)CCN ZERO/008893 [1,0,0,0,1,0|2,0,0]=4