0 B11R1.166 CN(C)c1cnc(nc1O)O nh024 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.166 Cc1cc(c(nc1)[N+](=O)[O-])O cdp244fp2 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] a257 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.13 CC(C)c1c[nH]c(=O)nc1 ct360de2lit7 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.13 Cc1ccc(cn1)N(C)C ct051vp1fp2de7 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.25 Cc1cc(ccc1CN)N dn093 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.25 Cc1ccc(c(c1)C)CI cic036 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.25 Cc1ccc(c(n1)C)OC ct074fp3vp1de2 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.25 Cc1ccc(c(n1)I)OC ct074fp3vp1de4 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.25 c1c(c(cnc1O)CO)O ct010vp1fp1 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.25 c1cc(c(cc1Cl)Cl)CI cic028 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.61 CN(C)c1c(cccn1)O cdp005fp1 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.61 Cc1ccncc1N(C)C ct051vp1fp2de1 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.893 Cc1ccc(c(c1C)O)[N+](=O)[O-] fpzz0112fp6 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.1703 Cc1cc(c(cn1)C(=O)OC)O cdp263fp1de29 [0,1,0,0,0,0|2,0,1]=4 15 B12R1.1703 Cc1ccc(c(n1)O)C(=O)OC cdp263fp1de20 [0,1,0,0,0,0|2,0,1]=4 16 B12R2.612 Cc1ccc2c(c1)ccn2C jmc119 [0,0,0,1,0,0|2,0,1]=4 17 B9R1.1 CCc1ccc(cn1)N s006fp2 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.1 CCc1ccc(cn1)O cdp254de7 [2,0,0,0,0,0|2,0,0]=4 19 B9R1.1 Cc1ccc(cn1)NC ct051vp1fp2de6 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.1 Cc1ccc(cn1)OC rp054 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.15 CCc1cccnc1O a006de13 [2,0,0,0,0,0|1,0,0]=3 22 B9R1.15 COc1ccncc1O rp265 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.15 c1cncc(c1CO)O f002fp1fp3 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.15 c1cncc(c1O)CO f002fp1fp3de1 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.69 Cc1cc(c(nc1)C)Br pb010vp1 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.69 Cc1cc(c(nc1)C)O cdp254de3 [2,0,0,0,0,0|1,0,0]=3 27 B9R1.69 Cc1cc(c(nc1)N)O cdp244fp3 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.69 Cc1ccc(c(c1)S)O jmc070 [2,0,0,0,0,0|1,1,0]=4 29 B9R1.69 Cc1ccc(nc1N)C fpzz0294fp2 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.69 Cc1ccc(nc1O)C a006de15 [2,0,0,0,0,0|1,0,0]=3 31 B9R1.69 Cc1cnc(cc1O)O ct010vp1fp5 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.69 c1cc(c(cc1O)O)S bio027 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.3 CS(=O)c1ccc(cc1)CO bio024 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.19 C[Si](C)(C)c1ccc(cc1)O jmc095 [1,1,0,0,0,0|1,1,0]=4 35 B11R1.19 Cc1ccc(nc1)[Sn](C)(C)C fpzz0302fp3 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.81 Cc1ccc(c(c1)C)CCN a062 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.279 COc1ccc(cc1N)CN dn090 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.279 c1cc(c(cc1CBr)Br)CBr hs2-a012de1 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.279 c1cc(c(cc1CBr)Cl)CBr hs2-a012de2 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.464 CCc1c(cc(nc1Cl)O)O un374 [1,1,0,0,0,0|2,0,0]=4 41 B13R1.3158 Cc1ccc(c(c1O)C=O)C(C)C bs003 [0,2,0,0,0,0|0,0,1]=3 42 B11R2.34 Cc1ccc(cc1)C2CC2 ll027 [1,0,0,1,0,0|0,0,0]=2 43 B11R2.34 c1cc(ccc1C2CC2)Cl ll020 [1,0,0,1,0,0|1,0,0]=3 44 B11R2.34 c1cc(ccc1C2CC2)F ll021 [1,0,0,1,0,0|1,0,0]=3 45 B11R2.36 Cc1ccc2ccoc2c1 un058de9 [1,0,0,1,0,0|0,0,2]=4 46 B11R2.1 c1cncc2c1C(CO2)O f002fp5 [1,0,0,1,0,0|2,0,0]=4 47 B11R2.55 Cc1ccccc1C2CC2 ll026 [1,0,0,1,0,0|1,0,0]=3 48 B11R2.55 c1ccc(c(c1)C2CC2)Cl ll018 [1,0,0,1,0,0|1,0,0]=3 49 B11R2.55 c1ccc(c(c1)C2CC2)F ll022 [1,0,0,1,0,0|1,0,0]=3 50 B11R1.20 Cc1ccc(cn1)NC(C)C ct051vp1fp2de10 [1,0,0,0,0,1|1,0,0]=3 51 B11R1.86 Cc1ccncc1NC(C)C ct051vp1fp2de4 [1,0,0,0,0,1|2,0,0]=4