0 B8R1.8 CNCc1[nH]ccn1 WX609046 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 CNCc1cncs1 WX609042 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.8 c1c(nc[nH]1)CC#N WX683075 [0,0,0,0,0,0|0,0,4]=4 3 B8R1.8 c1cc([nH]c1)\C=N\O WX690085 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.8 c1cc(oc1)CCO WX640320 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.8 c1cc(sc1)CCN WX600201 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.8 c1cnn(c1)CCBr WX630022 [0,0,0,0,0,0|3,0,1]=4 7 B8R1.8 c1nnc(o1)CC=O WX620028 [0,0,0,0,0,0|3,0,1]=4 8 B7R1.1 CCc1c[nH]nc1 WX690051 [1,0,0,0,0,0|2,0,0]=3 9 B7R1.1 CNc1nncs1 WX607061 [1,0,0,0,0,0|3,0,0]=4 10 B7R1.1 CSc1c[nH]nc1 WXC00643 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.1 c1c([nH]cn1)C#N WXC03632 [1,0,0,0,0,0|0,0,2]=3 12 B7R1.1 c1c([nH]cn1)CO WX640062 [1,0,0,0,0,0|1,0,0]=2 13 B7R1.1 c1c(cn[nH]1)CO WX640336 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.1 c1c(nc[nH]1)CN WX603089 [1,0,0,0,0,0|0,0,2]=3 15 B7R1.1 c1c(nc[nH]1)CO WX640292 [1,0,0,0,0,0|1,0,2]=4 16 B7R1.1 c1c(nco1)CO WX640327 [1,0,0,0,0,0|2,0,1]=4 17 B7R1.1 c1c(ncs1)CN WX603101 [1,0,0,0,0,0|1,0,1]=3 18 B7R1.1 c1c(ocn1)CO WX640330 [1,0,0,0,0,0|2,0,0]=3 19 B7R1.1 c1c(scn1)C=O WX624055 [1,0,0,0,0,0|2,0,1]=4 20 B7R1.1 c1c(scn1)CCl WXC04167 [1,0,0,0,0,0|2,0,0]=3 21 B7R1.1 c1c(scn1)CN WX609040 [1,0,0,0,0,0|1,0,0]=2 22 B7R1.1 c1c[nH]nc1CN WX603026 [1,0,0,0,0,0|2,0,1]=4 23 B7R1.1 c1c[nH]nc1CN WXC04668 [1,0,0,0,0,0|2,0,1]=4 24 B7R1.1 c1cc(sc1)CO WX640288 [1,0,0,0,0,0|3,0,0]=4 25 B7R1.1 c1cnc([nH]1)CN WX609045 [1,0,0,0,0,0|2,0,0]=3 26 B7R1.1 c1cnc([nH]1)CO WXC03352 [1,0,0,0,0,0|3,0,0]=4 27 B7R1.1 c1cnoc1CBr WX630186 [1,0,0,0,0,0|3,0,0]=4 28 B7R1.1 c1cnoc1CN WX603009 [1,0,0,0,0,0|2,0,0]=3 29 B7R1.1 c1conc1CN WX603172 [1,0,0,0,0,0|2,0,1]=4 30 B7R1.1 c1nc(no1)CN WX607091 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.7 CNCc1cnc(s1)Cl WX600141 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.7 Cc1nc(no1)CCN WX607104 [0,1,0,0,0,0|2,0,1]=4 33 B9R1.7 Cn1cc(cn1)CNN WX684057 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.7 Cn1cc(nc1)CCN WX600156 [0,1,0,0,0,0|0,0,2]=3 35 B9R1.11 CCC(=O)c1ccc[nH]1 WX626090 [0,1,0,0,0,0|2,0,1]=4 36 B9R1.11 c1cc(oc1)C(CN)O WX600098 [0,1,0,0,0,0|2,0,0]=3 37 B9R1.13 c1cc([nH]c1)CC(=O)N WX619054 [0,1,0,0,0,0|1,0,1]=3 38 B9R1.33 Cn1ccnc1CNN WX684056 [0,1,0,0,0,0|3,0,0]=4 39 B9R2.2 c1cnc([nH]1)C2CC2 WX690116 [0,0,0,1,0,0|3,0,0]=4 40 B9R1.8 CNCc1cccnc1 WX609032 [0,0,0,0,0,1|3,0,0]=4 41 B9R1.8 CNCc1ccncc1 WX603083 [0,0,0,0,0,1|3,0,0]=4 42 B9R1.8 c1cc(cnc1)CC#N WX683086 [0,0,0,0,0,1|1,0,2]=4 43 B9R1.8 c1cc(cnc1)CNN WX684003 [0,0,0,0,0,1|2,0,0]=3 44 B9R1.8 c1ccnc(c1)CCN WX600199 [0,0,0,0,0,1|1,0,1]=3 45 B6R1.2 Cn1cncn1 WX690050 [2,0,0,0,0,0|1,0,1]=4 46 B6R1.2 c1c([nH]cn1)F WX607151 [2,0,0,0,0,0|1,0,0]=3 47 B6R1.2 c1c(cn[nH]1)N WX609205 [2,0,0,0,0,0|2,0,0]=4 48 B6R1.2 c1c(scn1)Br WX637038 [2,0,0,0,0,0|2,0,0]=4 49 B6R1.2 c1nc(sn1)N WX609092 [2,0,0,0,0,0|1,0,1]=4 50 B6R1.2 c1nnc(o1)N WX607009 [2,0,0,0,0,0|2,0,0]=4 51 B8R1.1 CCc1cc(no1)N WX609361 [1,1,0,0,0,0|2,0,0]=4 52 B8R1.1 Cc1[nH]c(cn1)C=O WX624179 [1,1,0,0,0,0|1,0,1]=4 53 B8R1.1 Cc1[nH]c(cn1)CO WX640040 [1,1,0,0,0,0|1,0,0]=3 54 B8R1.1 Cc1cc(sc1)CN WX609034 [1,1,0,0,0,0|2,0,0]=4 55 B8R1.1 Cc1ccc(s1)CN WX609036 [1,1,0,0,0,0|2,0,0]=4 56 B8R1.1 Cc1ccc(s1)CN WX609532 [1,1,0,0,0,0|2,0,0]=4 57 B8R1.1 Cc1ncc(s1)CCl WX630056 [1,1,0,0,0,0|2,0,0]=4 58 B8R1.1 Cc1ncc(s1)CN WX609044 [1,1,0,0,0,0|1,0,0]=3 59 B8R1.1 Cc1ncc(s1)CO WX640102 [1,1,0,0,0,0|2,0,0]=4 60 B8R1.1 c1c(sc(n1)Cl)CN WX600148 [1,1,0,0,0,0|1,0,0]=3 61 B8R1.7 CC(=O)c1cncs1 WX626015 [1,1,0,0,0,0|1,0,1]=4 62 B8R1.7 CC(c1[nH]ccn1)N WX603123 [1,1,0,0,0,0|2,0,0]=4 63 B8R1.7 CC(c1[nH]ccn1)N WX609071 [1,1,0,0,0,0|2,0,0]=4 64 B8R1.7 CC(c1c[nH]cn1)O WX642070 [1,1,0,0,0,0|0,0,2]=4 65 B8R1.7 CC(c1cccs1)N WX609033 [1,1,0,0,0,0|2,0,0]=4 66 B8R1.7 CC(c1cccs1)O WX642064 [1,1,0,0,0,0|2,0,0]=4 67 B8R1.7 CC(c1cncs1)N WX609041 [1,1,0,0,0,0|1,0,0]=3 68 B8R1.11 Cc1c([nH]cn1)C=O WX624181 [1,1,0,0,0,0|1,0,1]=4 69 B8R1.11 Cc1c(cno1)CN WX603019 [1,1,0,0,0,0|2,0,0]=4 70 B8R1.11 Cc1c(con1)CN WX603010 [1,1,0,0,0,0|2,0,0]=4 71 B8R1.11 Cc1c(scn1)CN WX609043 [1,1,0,0,0,0|1,0,0]=3 72 B8R1.11 Cc1c(scn1)CO WXC00854 [1,1,0,0,0,0|2,0,0]=4 73 B8R1.11 Cc1ccsc1CN WX609035 [1,1,0,0,0,0|2,0,0]=4 74 B8R1.11 Cn1c(ccn1)CN WX603006 [1,1,0,0,0,0|2,0,0]=4 75 B8R1.11 Cn1cccc1CN WX607145 [1,1,0,0,0,0|1,0,0]=3 76 B8R1.11 Cn1ccnc1CN WX609047 [1,1,0,0,0,0|2,0,0]=4 77 B8R1.11 Cn1cncc1C=O WX624180 [1,1,0,0,0,0|1,0,1]=4 78 B8R1.11 Cn1cncc1CN WX603044 [1,1,0,0,0,0|0,0,0]=2 79 B8R1.11 Cn1cncc1CO WX640128 [1,1,0,0,0,0|1,0,0]=3 80 B10R1.1 Cc1cnc(nc1)CCN WX607133 [0,1,0,0,0,1|1,0,1]=4 81 B10R1.15 C[C@H](CN)c1ccccc1 WX600102 [0,1,0,0,0,1|2,0,0]=4 82 B10R1.16 Cc1ccc(s1)CCCN WX607136 [0,2,0,0,0,0|2,0,0]=4 83 B10R1.16 Cc1ccc(s1)CCCN WXC02874 [0,2,0,0,0,0|2,0,0]=4 84 B10R1.54 Cc1cc(on1)CC(C)N WX600007 [0,2,0,0,0,0|2,0,0]=4 85 B10R1.11 CCOC(=O)c1cnc[nH]1 WX618277 [0,2,0,0,0,0|1,0,1]=4 86 B10R1.21 CNCCCn1ccnc1 WX600196 [0,2,0,0,0,0|2,0,0]=4 87 B10R1.66 c1c([nH]cn1)CCC(=O)O WX610115 [0,2,0,0,0,0|1,0,0]=3 88 B10R1.66 c1cc([nH]c1)CCC(=O)O WX610154 [0,2,0,0,0,0|2,0,0]=4 89 B10R2.2 C1Cc2c(sc(n2)N)C1 WX609531 [0,1,0,1,0,0|2,0,0]=4