0 B14R2.28472 CC1C(=O)Nc2cccc(c2O1)N MB05445 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.28472 Cc1cccc2c1nc(c(c2)C)Cl AB42069 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.28472 Cc1cccc2c1nc(c(c2)C)N AB05779 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.162 Cc1cccc2c1nc(cc2)C AB01019 [1,0,0,0,0,0|3,0,0]=4 4 B13R2.162 Cc1ccnc2c1cc(cc2)Br AB49783 [1,0,0,0,0,0|3,0,0]=4 5 B13R2.369 CC1C(=O)Nc2ccccc2N1 PB10143 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.369 CC1Cc2ccccc2NC1=O MB08929 [1,0,0,0,0,0|1,0,2]=4 7 B13R2.369 Cc1c(=O)oc2ccccc2n1 AB09692 [1,0,0,0,0,0|3,0,0]=4 8 B13R2.369 Cc1cc2ccccc2nc1N AB05768 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.369 c1ccc2=NC(=O)C(=O)N=c2c1 AB06251 [1,0,0,0,0,0|1,0,2]=4 10 B13R2.369 c1ccc2=NC(=O)C(C=c2c1)Br MB06803 [1,0,0,0,0,0|1,0,2]=4 11 B13R2.369 c1ccc2c(c1)cc(c(n2)Br)Br PB24640 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.369 c1ccc2c(c1)cc(c(n2)Cl)Br PB20265 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.369 c1ccc2cc(c(cc2c1)Br)Br PB10042 [1,0,0,0,0,0|3,0,0]=4 14 B13R2.369 c1ccc2cc(c(cc2c1)Br)I CB10892 [1,0,0,0,0,0|3,0,0]=4 15 B13R2.5179 Cc1ccc2c(n1)cccc2Br AB68514 [1,0,0,0,0,0|2,0,1]=4 16 B13R2.5179 Cc1cccc2c1OCC(=O)N2 AB53068 [1,0,0,0,0,0|1,0,1]=3 17 B13R2.5179 c1cc(c2c(c1)NC(=O)CO2)N MB08392 [1,0,0,0,0,0|2,0,1]=4 18 B13R2.5179 c1cc2c(c(c1)Br)OCC(=O)N2 AB50082 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.5179 c1cc2c(c(c1)Cl)OCC(=O)N2 AB43540 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.5179 c1cc2c(c(c1)F)OCC(=O)N2 AB53069 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.5179 c1cc2c(c(c1)O)OCC(=O)N2 AB65028 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.5179 c1cc2c(ccc(=O)[nH]2)c(c1)Br MB09288 [1,0,0,0,0,0|1,0,0]=2 23 B13R2.5179 c1cc2c(ccc(=O)[nH]2)c(c1)O MB02360 [1,0,0,0,0,0|1,0,0]=2 24 B13R2.5179 c1cc2c(ccc(n2)Cl)c(c1)Br AB45170 [1,0,0,0,0,0|2,0,1]=4 25 B13R2.5179 c1cc2c(ccc(n2)N)c(c1)Br MB09289 [1,0,0,0,0,0|2,0,1]=4 26 B15R2.59733 Cc1cc(c2cc(c(nc2c1)Cl)C)C AB51892 [0,1,0,0,0,0|2,0,1]=4 27 B15R2.59733 Cc1cc(c2cc(c(nc2c1)N)C)C AB51652 [0,1,0,0,0,0|2,0,1]=4 28 B15R2.63633 Cc1ccc(c2c1cc(c(n2)Cl)C)C AB51894 [0,1,0,0,0,0|2,0,1]=4 29 B15R2.63633 Cc1ccc(c2c1cc(c(n2)N)C)C AB51653 [0,1,0,0,0,0|2,0,1]=4 30 B13R2.4825 c1cc2c(c(c1)Br)NC(=O)C2=O AB07072 [0,0,0,0,1,0|2,0,1]=4 31 B13R2.4825 c1cc2c(c(c1)Cl)NC(=O)C2=O AB01335 [0,0,0,0,1,0|2,0,1]=4 32 B13R2.4825 c1cc2c(c(c1)F)NC(=O)C2=O AB09245 [0,0,0,0,1,0|2,0,1]=4 33 B13R2.4825 c1cc2c(c(c1)I)NC(=O)C2=O MB01744 [0,0,0,0,1,0|2,0,1]=4 34 B13R2.4856 c1cc2c(c(c1)Br)C(=O)C(=O)N2 AB15602 [0,0,0,0,1,0|1,0,1]=3 35 B13R2.4856 c1cc2c(c(c1)I)C(=O)C(=O)N2 MB02863 [0,0,0,0,1,0|1,0,1]=3 36 B12R1.43 C[C@@H](C(=O)Nc1ccccc1)O AB72181 [1,0,1,0,0,0|0,0,2]=4 37 B12R1.1009 c1cc(c(c(c1)F)CC(=O)O)N AB31835 [1,0,1,0,0,0|1,0,1]=4 38 B12R2.24 c1cc(cc2c1ccnc2)O MB01177 [2,0,0,0,0,0|2,0,0]=4 39 B12R2.24 c1cc2ccc(=O)[nH]c2nc1 PB26329 [2,0,0,0,0,0|1,0,0]=3 40 B12R2.24 c1cc2cnccc2cc1O AB19117 [2,0,0,0,0,0|2,0,0]=4 41 B12R2.24 c1ccc2c(c1)NC(=O)CO2 AB04166 [2,0,0,0,0,0|1,0,1]=4 42 B12R2.24 c1ccc2c(c1)NCC(=O)N2 AB04744 [2,0,0,0,0,0|1,0,1]=4 43 B12R2.24 c1ccc2c(c1)c[nH]c(=O)n2 MB05981 [2,0,0,0,0,0|1,0,1]=4 44 B12R2.24 c1ccc2c(c1)cc(cn2)Br AB00810 [2,0,0,0,0,0|1,0,1]=4 45 B12R2.24 c1ccc2c(c1)ccc(n2)Br MB01039 [2,0,0,0,0,0|1,0,1]=4 46 B12R2.24 c1ccc2c(c1)ccc(n2)Cl AB00798 [2,0,0,0,0,0|1,0,1]=4 47 B12R2.24 c1ccc2cnc(cc2c1)O PB24595 [2,0,0,0,0,0|2,0,0]=4 48 B12R2.1081 Cc1cccc2c1cncc2 MB06665 [2,0,0,0,0,0|2,0,0]=4 49 B12R2.1081 Cc1ccnc2c1cccn2 CB10327 [2,0,0,0,0,0|1,0,1]=4 50 B12R2.1081 c1cc2c(cccn2)c(c1)Br AB05240 [2,0,0,0,0,0|1,0,1]=4 51 B14R2.142 COc1ccc2cccc(c2c1)Cl AB44054 [1,1,0,0,0,0|2,0,0]=4 52 B14R2.142 COc1ccc2cccc(c2c1)N AB44293 [1,1,0,0,0,0|2,0,0]=4 53 B14R2.8235 Cc1cc(nc2c1cc(cc2)O)Cl AB06491 [1,1,0,0,0,0|2,0,0]=4 54 B14R2.8235 Cc1cc(nc2c1cc(cc2)O)O AB45126 [1,1,0,0,0,0|2,0,0]=4 55 B14R2.1128 c1ccc2c(c1)cc(c(n2)C=O)Br AB46109 [1,1,0,0,0,0|1,0,1]=4 56 B14R2.1128 c1ccc2c(c1)cc(c(n2)O)C=O AB11914 [1,1,0,0,0,0|2,0,0]=4 57 B14R2.8239 Cc1cc2ccc(cc2oc1=O)O AB50338 [1,1,0,0,0,0|2,0,0]=4 58 B14R2.1073 COc1cccc2c1OCC(=O)N2 MB11346 [1,1,0,0,0,0|1,0,1]=4 59 B14R2.1073 COc1cccc2c1ccc(=O)[nH]2 MB10591 [1,1,0,0,0,0|0,0,0]=2 60 B14R2.29365 Cc1cc(c2c(c1)NC(=O)CO2)C AB49698 [1,1,0,0,0,0|1,0,1]=4 61 B14R2.29365 Cc1cc(cc2c1OCC(=O)N2)Br AB53059 [1,1,0,0,0,0|1,0,1]=4 62 B14R2.29365 Cc1ccc2c(cc(cc2n1)C)C AB51599 [1,1,0,0,0,0|1,0,1]=4 63 B14R2.8620 Cc1ccc(c2c1NC(=O)C2=O)Br AB25936 [0,1,0,0,1,0|1,0,1]=4 64 B14R2.27750 c1c(cc(c2c1NC(=O)C2=O)Br)Br MB07222 [0,1,0,0,1,0|1,0,1]=4 65 B14R2.27750 c1c(cc(c2c1NC(=O)C2=O)Cl)Cl PB30714 [0,1,0,0,1,0|1,0,1]=4 66 B14R2.27750 c1c(cc(c2c1NC(=O)C2=O)F)F AB15600 [0,1,0,0,1,0|1,0,1]=4 67 B12R2.202 Cc1cccc2c1nc(s2)O AB16509 [1,0,0,0,1,0|2,0,0]=4