0 B10R1.61 Cc1ccncc1C(=O)O ZERO/009371 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 c1c(c(ncn1)N)C(=O)O ZERO/008490 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.61 c1cc(c(=O)[nH]c1)[N+](=O)[O-] ZERO/002863 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.61 c1cc(c(nc1)O)[N+](=O)[O-] ZERO/008538 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])Br ZERO/008660 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.61 c1cnc(c(n1)C(=O)O)O ZERO/010099 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.61 c1cncc(c1C(=O)O)Br ZERO/008524 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.61 c1cncc(c1N)C(=O)O ZERO/010694 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.61 c1cncc(c1N)[N+](=O)[O-] ZERO/008536 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.6 CC(c1ccccn1)N ZERO/009554 [1,0,0,0,0,0|2,0,1]=4 10 B9R1.6 c1ccnc(c1)C(=S)N ZERO/009751 [1,0,0,0,0,0|1,1,0]=3 11 B9R1.6 c1cncnc1C(=O)O ZERO/009348 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.15 c1cc(c(nc1)N)C=O ZERO/004822 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.15 c1ccc(c(c1)NN)F ZERO/001817 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.15 c1cncc(c1N)C=O ZERO/008579 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.53 COc1ccncc1[N+](=O)[O-] ZERO/004611 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.53 c1ccc(c(c1)CN)C(=O)O ZERO/005960 [0,1,0,0,0,0|2,0,0]=3 17 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)N ZERO/001505 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.159 Cc1c(cccc1N)C(=O)N ZERO/009099 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.159 c1cc(c(c(c1)N)N)C(=O)O ZERO/008679 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.159 c1cc(c(c(c1)N)O)C(=O)O ZERO/001787 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])N ZERO/009745 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.167 c1c[n+](cc(c1O)[N+](=O)[O-])[O-] ZERO/006159 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.167 c1cc(c(cc1I)C(=O)N)Cl ZERO/010045 [0,1,0,0,0,0|1,0,0]=2 24 B11R1.222 c1cc(c(nc1)Cl)\C(=N\O)\N ZERO/008560 [0,1,0,0,0,0|2,0,1]=4 25 B11R2.1 c1cc2c(n[nH]c2nc1)N ZERO/005964 [0,0,0,1,0,0|3,0,0]=4 26 B11R2.1 c1ccc2c(c1)c(sn2)N ZERO/009690 [0,0,0,1,0,0|1,1,0]=3 27 B11R2.1 c1ccn2c(c1)nnc2N ZERO/009932 [0,0,0,1,0,0|3,0,0]=4 28 B9R1.41 c1c(c([nH]n1)C(=O)N)N ZERO/003108 [0,0,0,0,1,0|3,0,0]=4 29 B9R1.41 c1c(c(n[nH]1)N)C(=O)N ZERO/009193 [0,0,0,0,1,0|3,0,0]=4 30 B9R1.41 c1c(c(ns1)C(=O)N)N ZERO/008403 [0,0,0,0,1,0|3,0,0]=4 31 B11R1.86 CC(=O)Nc1ccncc1Br ZERO/009982 [0,0,0,0,0,1|3,0,0]=4 32 B8R1.2 c1cnccc1NN ZERO/009850 [2,0,0,0,0,0|2,0,0]=4 33 B8R1.5 Cc1cnccc1N ZERO/010466 [2,0,0,0,0,0|2,0,0]=4 34 B8R1.5 c1cc(c(=O)[nH]c1)N ZERO/001732 [2,0,0,0,0,0|1,0,1]=4 35 B8R1.5 c1cc(c(nc1)N)Br ZERO/006197 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.5 c1cncc(c1N)Br ZERO/009934 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.13 c1cc(ncc1C(=O)O)O ZERO/005644 [1,1,0,0,0,0|2,0,0]=4 38 B10R1.15 C#CC(=O)c1ccccc1 ZERO/004572 [1,1,0,0,0,0|1,0,0]=3 39 B10R1.113 c1cnc(cc1N)C(=O)O ZERO/010331 [1,1,0,0,0,0|2,0,0]=4 40 B10R1.20 COc1ccccc1NN ZERO/000909 [1,1,0,0,0,0|1,0,0]=3 41 B10R1.25 c1cc(c(cc1F)F)NN ZERO/001579 [1,1,0,0,0,0|2,0,0]=4 42 B10R1.245 Cc1cccc(c1NN)C ZERO/001580 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.75 CC(=O)Oc1ccccc1CN ZERO/010687 [0,1,0,0,0,1|2,0,0]=4 44 B12R1.46 CC(=O)c1cc(ccc1OC)Cl ZERO/009339 [0,2,0,0,0,0|1,0,0]=3 45 B12R1.46 CC(=O)c1cc(ccc1OC)F ZERO/010225 [0,2,0,0,0,0|1,0,0]=3 46 B12R1.77 CCC(=O)c1ccccc1OC ZERO/010353 [0,2,0,0,0,0|1,0,0]=3 47 B12R1.87 CC(=O)c1cccc(c1OC)Cl ZERO/009338 [0,2,0,0,0,0|1,0,0]=3 48 B12R1.283 c1ccc(c(c1)CC#N)C(=O)O ZERO/005274 [0,2,0,0,0,0|2,0,0]=4 49 B12R1.894 Cc1ccc(c(c1Br)C(=O)O)N ZERO/001458 [0,2,0,0,0,0|2,0,0]=4 50 B12R1.1000 c1c(cc(c(c1N)C(=O)O)Cl)Cl ZERO/005668 [0,2,0,0,0,0|2,0,0]=4 51 B12R1.511 c1c(cc(c(c1C(=O)O)O)N)Cl ZERO/011103 [0,2,0,0,0,0|1,0,0]=3 52 B12R1.232 Cn1cc(c(cc1=O)O)C(=O)O ZERO/010858 [0,2,0,0,0,0|2,0,0]=4 53 B12R1.232 c1c(c(cc(c1N)Cl)Cl)C(=O)O ZERO/004577 [0,2,0,0,0,0|2,0,0]=4 54 B12R1.354 COC(=O)c1cc(ccc1Cl)N ZERO/004981 [0,2,0,0,0,0|2,0,0]=4 55 B12R1.308 c1ccc(c(c1)C(=O)CC#N)Br ZERO/010169 [0,2,0,0,0,0|1,0,1]=4 56 B12R1.308 c1ccc(c(c1)C(=O)CC#N)Cl ZERO/010012 [0,2,0,0,0,0|1,0,1]=4 57 B10R1.66 c1cc(oc1)\C=C\[N+](=O)[O-] ZERO/008042 [0,0,1,1,0,0|2,0,0]=4 58 B12R2.202 Cc1[nH]c2cccc(c2n1)N ZERO/005139 [0,0,0,1,0,1|2,0,0]=4 59 B12R2.202 c1cc2c(c(c1)Br)nc(s2)N ZERO/010390 [0,0,0,1,0,1|1,1,0]=4 60 B12R2.202 c1cc2c(c(c1)Cl)oc(n2)N ZERO/010817 [0,0,0,1,0,1|2,0,0]=4 61 B12R2.202 c1cc2c(c(c1)Cl)sc(n2)N ZERO/009412 [0,0,0,1,0,1|2,0,0]=4 62 B12R2.1081 c1ccc2c(c1)c(ccn2)N ZERO/009678 [0,1,0,1,0,0|2,0,0]=4 63 B12R2.1081 c1ccc2c(c1)c(ncn2)N ZERO/010375 [0,1,0,1,0,0|2,0,0]=4 64 B12R2.612 c1cc2c(cc1N)COC2=O ZERO/009021 [0,1,0,1,0,0|2,0,0]=4 65 B12R2.132 c1cc2c(cc1N)C(=O)CO2 ZERO/010877 [0,1,0,1,0,0|1,0,0]=3