0 B12R2.44 C=Cc1cc2[nH]ccc2cn1 271570a_100011290941_100000089685 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.44 C=Cc1ccc2[nH]ccc2c1 271570a_100011290941_100000211741 [0,0,0,0,0,0|2,0,2]=4 2 B12R2.44 C=Cc1ccc2[nH]cnc2c1 271570a_100011290941_100011265325 [0,0,0,0,0,0|1,0,3]=4 3 B12R2.44 C=Cc1ccc2c(c1)C=CC2 271570a_100011290941_100009814306 [0,0,0,0,0,0|3,0,1]=4 4 B12R2.44 C=Cc1ccc2c(c1)CC=C2 271570a_100011290941_200009818231 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.44 C=Cc1ccc2c(c1)NCC2 271570a_100011290941_100000754641 [0,0,0,0,0,0|2,0,2]=4 6 B12R2.44 C=Cc1ccc2cc[nH]c2c1 271570a_100011290941_100000743809 [0,0,0,0,0,0|2,0,1]=3 7 B12R2.44 C=Cc1ccc2cc[nH]c2n1 271570a_100011290941_100009814870 [0,0,0,0,0,0|3,0,1]=4 8 B12R2.44 C=Cc1ccc2ccoc2c1 271570a_100011290941_100000759542 [0,0,0,0,0,0|3,0,1]=4 9 B12R2.44 C=Cc1ccc2ccsc2c1 271570a_100011290941_100009888917 [0,0,0,0,0,0|3,0,1]=4 10 B12R2.44 C=Cc1ccc2cn[nH]c2c1 271570a_100011290941_100000049514 [0,0,0,0,0,0|3,0,1]=4 11 B12R2.44 C=Cc1ccc2nc[nH]c2n1 271570a_100011290941_100000077665 [0,0,0,0,0,0|2,0,1]=3 12 B12R2.44 C=Cc1ccc2nccn2c1 271570a_100011290941_100000746083 [0,0,0,0,0,0|3,0,1]=4 13 B12R2.44 C=Cc1ccc2ncnn2c1 271570a_100011290941_100009816971 [0,0,0,0,0,0|2,0,2]=4 14 B12R2.44 C=Cc1ccc2ncoc2c1 271570a_100011290941_100009817590 [0,0,0,0,0,0|2,0,1]=3 15 B12R2.44 C=Cc1ccc2ncsc2c1 271570a_100011290941_100009816678 [0,0,0,0,0,0|2,0,1]=3 16 B12R2.44 C=Cc1ccc2ncsc2n1 271570a_100011290941_100010381354 [0,0,0,0,0,0|3,0,1]=4 17 B12R2.44 C=Cc1ccc2nn[nH]c2c1 271570a_100011290941_100009817464 [0,0,0,0,0,0|2,0,1]=3 18 B12R2.44 C=Cc1ccc2nonc2c1 271570a_100011290941_100009814275 [0,0,0,0,0,0|2,0,2]=4 19 B12R2.44 C=Cc1ccc2nsnc2c1 271570a_100011290941_100009814274 [0,0,0,0,0,0|2,0,2]=4 20 B12R2.44 C=Cc1ccc2occc2c1 271570a_100011290941_100012343831 [0,0,0,0,0,0|3,0,1]=4 21 B12R2.44 C=Cc1ccc2ocnc2c1 271570a_100011290941_100009816175 [0,0,0,0,0,0|2,0,2]=4 22 B12R2.44 C=Cc1ccc2sccc2c1 271570a_100011290941_100009814439 [0,0,0,0,0,0|3,0,1]=4 23 B12R2.44 C=Cc1ccc2scnc2c1 271570a_100011290941_100010005895 [0,0,0,0,0,0|2,0,2]=4 24 B12R2.44 C=Cc1ccn2nccc2c1 271570a_100011290941_100000763084 [0,0,0,0,0,0|3,0,1]=4 25 B12R2.44 C=Cc1ccn2ncnc2c1 271570a_100011290941_100009819723 [0,0,0,0,0,0|2,0,2]=4 26 B12R2.44 C=Cc1cnc2cc[nH]c2c1 271570a_100011290941_100009818992 [0,0,0,0,0,0|3,0,1]=4 27 B12R2.44 C=Cc1cnc2nc[nH]c2c1 271570a_100011290941_100000760087 [0,0,0,0,0,0|2,0,1]=3 28 B12R2.44 C=Cc1cnc2ncoc2c1 271570a_100011290941_100000721906 [0,0,0,0,0,0|3,0,1]=4 29 B12R2.44 CNc1cc2[nH]ncc2cn1 27a_100102657272_100009872621 [0,0,0,0,0,0|4,0,0]=4 30 B12R2.44 CNc1cc2ncnn2cn1 27a_100102657272_100000101099 [0,0,0,0,0,0|3,0,1]=4 31 B12R2.44 CNc1ccc2c(c1)CCC2 2230a_100000211504_200000210301 [0,0,0,0,0,0|3,0,1]=4 32 B12R2.44 CNc1ccc2c(c1)CCC2 34a_100000211504_200000210301 [0,0,0,0,0,0|3,0,1]=4 33 B12R2.44 CNc1ccc2c(c1)CCO2 2230a_100000736984_200000210301 [0,0,0,0,0,0|3,0,1]=4 34 B12R2.44 CNc1ccc2c(c1)CCO2 34a_100000736984_200000210301 [0,0,0,0,0,0|3,0,1]=4 35 B12R2.44 CNc1ccc2c(c1)COC2 2230a_100011728444_200000210301 [0,0,0,0,0,0|4,0,0]=4 36 B12R2.44 CNc1ccc2c(c1)COC2 34a_100011728444_200000210301 [0,0,0,0,0,0|4,0,0]=4 37 B12R2.44 CNc1ccc2c(c1)OCO2 2230a_100000209953_200000210301 [0,0,0,0,0,0|3,0,1]=4 38 B12R2.44 CNc1ccc2c(c1)OCO2 34a_100000209953_200000210301 [0,0,0,0,0,0|3,0,1]=4 39 B12R2.44 CNc1ccc2ccoc2c1 34a_100000102395_200000210301 [0,0,0,0,0,0|3,0,0]=3 40 B12R2.44 CNc1ccc2cn[nH]c2n1 27a_100102657272_100009883947 [0,0,0,0,0,0|4,0,0]=4 41 B12R2.44 CNc1ccc2cnoc2c1 34a_100000084182_200000210301 [0,0,0,0,0,0|4,0,0]=4 42 B12R2.44 CNc1ccc2nccn2n1 27a_100102657272_100000058501 [0,0,0,0,0,0|4,0,0]=4 43 B12R2.44 CNc1ccc2ncoc2c1 34a_100011248239_200000210301 [0,0,0,0,0,0|2,0,0]=2 44 B12R2.44 CNc1ccc2ncsc2c1 34a_100011215093_200000210301 [0,0,0,0,0,0|2,0,0]=2 45 B12R2.44 CNc1ccc2ncsc2n1 27a_100102657272_100010381354 [0,0,0,0,0,0|3,0,0]=3 46 B12R2.44 CNc1ccc2occc2c1 34a_106430523501_200000210301 [0,0,0,0,0,0|3,0,0]=3 47 B12R2.44 CNc1ccc2ocnc2c1 34a_100011219863_200000210301 [0,0,0,0,0,0|2,0,1]=3 48 B12R2.44 CNc1ccc2oncc2c1 34a_100000037595_200000210301 [0,0,0,0,0,0|4,0,0]=4 49 B12R2.44 CNc1ccc2sccc2c1 34a_100000681076_200000210301 [0,0,0,0,0,0|3,0,0]=3 50 B12R2.44 CNc1ccc2sccc2n1 27a_100102657272_100012000956 [0,0,0,0,0,0|4,0,0]=4 51 B12R2.44 CNc1ccc2scnc2c1 34a_100000047738_200000210301 [0,0,0,0,0,0|2,0,1]=3 52 B12R2.44 CNc1ccc2sncc2c1 34a_100000077742_200000210301 [0,0,0,0,0,0|4,0,0]=4 53 B12R2.44 CNc1ccn2nccc2n1 27a_100102657272_100000051569 [0,0,0,0,0,0|4,0,0]=4 54 B12R2.44 CNc1ccn2ncnc2c1 27a_100102657272_100009819723 [0,0,0,0,0,0|2,0,1]=3 55 B12R2.44 CNc1ccn2ncnc2n1 27a_100102657272_100000054300 [0,0,0,0,0,0|3,0,1]=4 56 B12R2.44 CNc1ncc2cc[nH]c2n1 27a_100102657272_100000059789 [0,0,0,0,0,0|4,0,0]=4 57 B12R2.44 CNc1ncc2nc[nH]c2n1 27a_100102657272_100000009038 [0,0,0,0,0,0|3,0,0]=3 58 B12R2.44 COc1ccc2[nH]ccc2c1 34a_100000756620_200000210301 [0,0,0,0,0,0|1,0,1]=2 59 B12R2.44 COc1ccc2c(c1)CCC2 34a_100000209987_200000210301 [0,0,0,0,0,0|2,0,1]=3 60 B12R2.44 COc1ccc2c(c1)CCC2 7a_100000209987_200000210301 [0,0,0,0,0,0|2,0,1]=3 61 B12R2.44 COc1ccc2c(c1)CCN2 34a_100020636429_200000210301 [0,0,0,0,0,0|1,0,2]=3 62 B12R2.44 COc1ccc2c(c1)CNC2 34a_100015195982_200000210301 [0,0,0,0,0,0|3,0,0]=3 63 B12R2.44 COc1ccc2c(c1)NCC2 34a_100020636427_200000210301 [0,0,0,0,0,0|1,0,1]=2 64 B12R2.44 COc1ccc2c(c1)OCO2 34a_100000210298_200000210301 [0,0,0,0,0,0|2,0,1]=3 65 B12R2.44 COc1ccc2cc[nH]c2c1 34a_100000036713_200000210301 [0,0,0,0,0,0|1,0,0]=1 66 B12R2.44 COc1ccc2ccoc2c1 34a_100000089557_200000210301 [0,0,0,0,0,0|2,0,0]=2 67 B12R2.44 COc1ccc2ccoc2c1 7a_100000089557_200000210301 [0,0,0,0,0,0|2,0,0]=2 68 B12R2.44 COc1ccc2cnoc2c1 34a_100000098417_200000210301 [0,0,0,0,0,0|3,0,0]=3 69 B12R2.44 COc1ccc2cnoc2c1 7a_100000098417_200000210301 [0,0,0,0,0,0|3,0,0]=3 70 B12R2.44 COc1ccc2ncsc2c1 34a_100011995850_200000210301 [0,0,0,0,0,0|1,0,0]=1 71 B12R2.44 COc1ccc2ncsc2c1 7a_100011995850_200000210301 [0,0,0,0,0,0|1,0,0]=1 72 B12R2.44 COc1ccc2nonc2c1 34a_100000036933_200000210301 [0,0,0,0,0,0|1,0,1]=2 73 B12R2.44 COc1ccc2occc2c1 34a_100000070125_200000210301 [0,0,0,0,0,0|2,0,0]=2 74 B12R2.44 COc1ccc2occc2c1 7a_100000070125_200000210301 [0,0,0,0,0,0|2,0,0]=2 75 B12R2.44 COc1ccc2sccc2c1 34a_100012180905_200000210301 [0,0,0,0,0,0|2,0,0]=2 76 B12R2.44 COc1ccc2sccc2c1 7a_100012180905_200000210301 [0,0,0,0,0,0|2,0,0]=2 77 B12R2.44 COc1ccc2scnc2c1 34a_200009850626_200000210301 [0,0,0,0,0,0|1,0,1]=2 78 B12R2.44 COc1ccc2scnc2c1 7a_200009850626_200000210301 [0,0,0,0,0,0|1,0,1]=2 79 B12R2.44 COc1ccn2ccnc2c1 34a_100009863278_200000210301 [0,0,0,0,0,0|2,0,1]=3 80 B12R2.44 COc1cnc2[nH]ccc2c1 34a_100000087691_200000210301 [0,0,0,0,0,0|2,0,1]=3 81 B12R2.44 CSc1cc2[nH]ccc2cn1 62a_200000210301_100000089685 [0,0,0,0,0,0|2,1,0]=3 82 B12R2.44 CSc1cc2[nH]ncc2cn1 62a_200000210301_100009872621 [0,0,0,0,0,0|3,1,0]=4 83 B12R2.44 CSc1cc2c(cn1)CCN2 62a_100020639910_200000210301 [0,0,0,0,0,0|2,1,1]=4 84 B12R2.44 CSc1cc2c(cn1)CCN2 62a_200000210301_100020639910 [0,0,0,0,0,0|2,1,1]=4 85 B12R2.44 CSc1cc2cc[nH]c2cn1 62a_200000210301_100009864809 [0,0,0,0,0,0|2,1,1]=4 86 B12R2.44 CSc1cc2nc[nH]c2cn1 62a_200000210301_100000070173 [0,0,0,0,0,0|1,1,2]=4 87 B12R2.44 CSc1cc2ncnn2cn1 62a_100000101099_200000210301 [0,0,0,0,0,0|2,1,1]=4 88 B12R2.44 CSc1cc2ncnn2cn1 62a_200000210301_100000101099 [0,0,0,0,0,0|2,1,1]=4 89 B12R2.44 CSc1cc2sccc2cn1 62a_200000210301_200016184645 [0,0,0,0,0,0|3,1,0]=4 90 B12R2.44 CSc1ccc2[nH]ccc2c1 62a_200000210301_100000035808 [0,0,0,0,0,0|1,1,1]=3 91 B12R2.44 CSc1ccc2[nH]ccc2n1 62a_200000210301_100000087148 [0,0,0,0,0,0|2,1,1]=4 92 B12R2.44 CSc1ccc2[nH]cnc2c1 62a_200000210301_100011265325 [0,0,0,0,0,0|0,1,2]=3 93 B12R2.44 CSc1ccc2[nH]ncc2c1 62a_200000210301_100000049815 [0,0,0,0,0,0|2,1,1]=4 94 B12R2.44 CSc1ccc2c(c1)C=CC2 62a_100009814306_200000210301 [0,0,0,0,0,0|2,1,0]=3 95 B12R2.44 CSc1ccc2c(c1)C=CC2 62a_200000210301_100009814306 [0,0,0,0,0,0|2,1,0]=3 96 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200000210301_200009818231 [0,0,0,0,0,0|2,1,0]=3 97 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200009818231_200000210301 [0,0,0,0,0,0|2,1,0]=3 98 B12R2.44 CSc1ccc2c(c1)CCC2 62a_100000745594_200000210301 [0,0,0,0,0,0|2,1,1]=4 99 B12R2.44 CSc1ccc2c(c1)CCC2 62a_200000210301_100000745594 [0,0,0,0,0,0|2,1,1]=4 100 B12R2.44 CSc1ccc2c(c1)CCN2 62a_100000691068_200000210301 [0,0,0,0,0,0|1,1,2]=4 101 B12R2.44 CSc1ccc2c(c1)CCN2 62a_200000210301_100000691068 [0,0,0,0,0,0|1,1,2]=4 102 B12R2.44 CSc1ccc2c(c1)CCO2 62a_100000729065_200000210301 [0,0,0,0,0,0|2,1,1]=4 103 B12R2.44 CSc1ccc2c(c1)CCO2 62a_200000210301_100000729065 [0,0,0,0,0,0|2,1,1]=4 104 B12R2.44 CSc1ccc2c(c1)CNC2 62a_100000702344_200000210301 [0,0,0,0,0,0|3,1,0]=4 105 B12R2.44 CSc1ccc2c(c1)CNC2 62a_200000210301_100000702344 [0,0,0,0,0,0|3,1,0]=4 106 B12R2.44 CSc1ccc2c(c1)COC2 62a_100000698232_200000210301 [0,0,0,0,0,0|3,1,0]=4 107 B12R2.44 CSc1ccc2c(c1)COC2 62a_200000210301_100000698232 [0,0,0,0,0,0|3,1,0]=4 108 B12R2.44 CSc1ccc2c(c1)NCC2 62a_100000754641_200000210301 [0,0,0,0,0,0|1,1,1]=3 109 B12R2.44 CSc1ccc2c(c1)NCC2 62a_200000210301_100000754641 [0,0,0,0,0,0|1,1,1]=3 110 B12R2.44 CSc1ccc2c(c1)OCC2 62a_100009818566_200000210301 [0,0,0,0,0,0|2,1,1]=4 111 B12R2.44 CSc1ccc2c(c1)OCC2 62a_200000210301_100009818566 [0,0,0,0,0,0|2,1,1]=4 112 B12R2.44 CSc1ccc2cc[nH]c2c1 62a_200000210301_100000743809 [0,0,0,0,0,0|1,1,0]=2 113 B12R2.44 CSc1ccc2cc[nH]c2n1 62a_200000210301_100009814870 [0,0,0,0,0,0|2,1,0]=3 114 B12R2.44 CSc1ccc2ccnn2c1 62a_200000210301_100009820231 [0,0,0,0,0,0|2,1,1]=4 115 B12R2.44 CSc1ccc2ccoc2c1 62a_200000210301_100000759542 [0,0,0,0,0,0|2,1,0]=3 116 B12R2.44 CSc1ccc2ccsc2c1 62a_200000210301_100009888917 [0,0,0,0,0,0|2,1,0]=3 117 B12R2.44 CSc1ccc2cn[nH]c2c1 62a_200000210301_100000049514 [0,0,0,0,0,0|2,1,0]=3 118 B12R2.44 CSc1ccc2cn[nH]c2n1 62a_100009883947_200000210301 [0,0,0,0,0,0|3,1,0]=4 119 B12R2.44 CSc1ccc2cnoc2c1 62a_200000210301_100009817722 [0,0,0,0,0,0|3,1,0]=4 120 B12R2.44 CSc1ccc2cscc2c1 62a_200000210301_200010760811 [0,0,0,0,0,0|3,1,0]=4 121 B12R2.44 CSc1ccc2csnc2c1 62a_200000210301_100010170880 [0,0,0,0,0,0|2,1,1]=4 122 B12R2.44 CSc1ccc2nc[nH]c2n1 62a_100009820032_200000210301 [0,0,0,0,0,0|1,1,0]=2 123 B12R2.44 CSc1ccc2nc[nH]c2n1 62a_200000210301_100000077665 [0,0,0,0,0,0|1,1,0]=2 124 B12R2.44 CSc1ccc2nccn2c1 62a_100000746083_200000210301 [0,0,0,0,0,0|2,1,0]=3 125 B12R2.44 CSc1ccc2nccn2c1 62a_200000210301_100000746083 [0,0,0,0,0,0|2,1,0]=3 126 B12R2.44 CSc1ccc2nccn2n1 62a_100009883166_200000210301 [0,0,0,0,0,0|3,1,0]=4 127 B12R2.44 CSc1ccc2nccn2n1 62a_200000210301_100000058501 [0,0,0,0,0,0|3,1,0]=4 128 B12R2.44 CSc1ccc2ncnn2c1 62a_100009816971_200000210301 [0,0,0,0,0,0|1,1,1]=3 129 B12R2.44 CSc1ccc2ncnn2c1 62a_200000210301_100009816971 [0,0,0,0,0,0|1,1,1]=3 130 B12R2.44 CSc1ccc2ncoc2c1 62a_200000210301_100009817590 [0,0,0,0,0,0|1,1,0]=2 131 B12R2.44 CSc1ccc2ncsc2c1 62a_100009816678_200000210301 [0,0,0,0,0,0|1,1,0]=2 132 B12R2.44 CSc1ccc2ncsc2c1 62a_200000210301_100009816678 [0,0,0,0,0,0|1,1,0]=2 133 B12R2.44 CSc1ccc2ncsc2n1 62a_100010090457_200000210301 [0,0,0,0,0,0|2,1,0]=3 134 B12R2.44 CSc1ccc2ncsc2n1 62a_200000210301_100010381354 [0,0,0,0,0,0|2,1,0]=3 135 B12R2.44 CSc1ccc2nn[nH]c2c1 62a_200000210301_100009817464 [0,0,0,0,0,0|1,1,0]=2 136 B12R2.44 CSc1ccc2nncn2c1 62a_100000764363_200000210301 [0,0,0,0,0,0|3,1,0]=4 137 B12R2.44 CSc1ccc2nncn2c1 62a_200000210301_100000764363 [0,0,0,0,0,0|3,1,0]=4 138 B12R2.44 CSc1ccc2nnnn2c1 62a_100009817084_200000210301 [0,0,0,0,0,0|2,1,1]=4 139 B12R2.44 CSc1ccc2nnnn2c1 62a_200000210301_100009817084 [0,0,0,0,0,0|2,1,1]=4 140 B12R2.44 CSc1ccc2nonc2c1 62a_100009814275_200000210301 [0,0,0,0,0,0|1,1,1]=3 141 B12R2.44 CSc1ccc2nonc2c1 62a_200000210301_100009814275 [0,0,0,0,0,0|1,1,1]=3 142 B12R2.44 CSc1ccc2nsnc2c1 62a_100009814274_200000210301 [0,0,0,0,0,0|1,1,1]=3 143 B12R2.44 CSc1ccc2nsnc2c1 62a_200000210301_100009814274 [0,0,0,0,0,0|1,1,1]=3 144 B12R2.44 CSc1ccc2occc2c1 62a_200000210301_100000691453 [0,0,0,0,0,0|2,1,0]=3 145 B12R2.44 CSc1ccc2occc2n1 62a_200000210301_100009851292 [0,0,0,0,0,0|3,1,0]=4 146 B12R2.44 CSc1ccc2ocnc2c1 62a_200000210301_100009816175 [0,0,0,0,0,0|1,1,1]=3 147 B12R2.44 CSc1ccc2oncc2c1 62a_200000210301_100009817723 [0,0,0,0,0,0|3,1,0]=4 148 B12R2.44 CSc1ccc2sccc2c1 62a_200000210301_100009814439 [0,0,0,0,0,0|2,1,0]=3 149 B12R2.44 CSc1ccc2sccc2n1 62a_200000210301_100012000956 [0,0,0,0,0,0|3,1,0]=4 150 B12R2.44 CSc1ccc2scnc2c1 62a_200000210301_100010005895 [0,0,0,0,0,0|1,1,1]=3 151 B12R2.44 CSc1ccn2ccnc2c1 62a_200000210301_100000087792 [0,0,0,0,0,0|2,1,1]=4 152 B12R2.44 CSc1ccn2nccc2c1 62a_200000210301_100000763084 [0,0,0,0,0,0|2,1,0]=3 153 B12R2.44 CSc1ccn2nccc2n1 62a_100000691470_200000210301 [0,0,0,0,0,0|3,1,0]=4 154 B12R2.44 CSc1ccn2nccc2n1 62a_200000210301_100000051569 [0,0,0,0,0,0|3,1,0]=4 155 B12R2.44 CSc1ccn2ncnc2c1 62a_100009819723_200000210301 [0,0,0,0,0,0|1,1,1]=3 156 B12R2.44 CSc1ccn2ncnc2c1 62a_200000210301_100009819723 [0,0,0,0,0,0|1,1,1]=3 157 B12R2.44 CSc1ccn2ncnc2n1 62a_100000054300_200000210301 [0,0,0,0,0,0|2,1,1]=4 158 B12R2.44 CSc1ccn2ncnc2n1 62a_200000210301_100000054300 [0,0,0,0,0,0|2,1,1]=4 159 B12R2.44 CSc1ccn2nncc2c1 62a_100009820036_200000210301 [0,0,0,0,0,0|3,1,0]=4 160 B12R2.44 CSc1ccn2nncc2c1 62a_200000210301_100009820036 [0,0,0,0,0,0|3,1,0]=4 161 B12R2.44 CSc1cn2ccnc2cn1 62a_102495339940_200000210301 [0,0,0,0,0,0|3,1,0]=4 162 B12R2.44 CSc1cn2ccnc2cn1 62a_200000210301_102495339940 [0,0,0,0,0,0|3,1,0]=4 163 B12R2.44 CSc1cn2ncnc2cn1 62a_100009847490_200000210301 [0,0,0,0,0,0|2,1,1]=4 164 B12R2.44 CSc1cn2ncnc2cn1 62a_200000210301_100009847490 [0,0,0,0,0,0|2,1,1]=4 165 B12R2.44 CSc1cnc2[nH]ccc2c1 62a_200000210301_100000760471 [0,0,0,0,0,0|2,1,1]=4 166 B12R2.44 CSc1cnc2c(c1)NCC2 62a_100000698607_200000210301 [0,0,0,0,0,0|2,1,1]=4 167 B12R2.44 CSc1cnc2c(c1)NCC2 62a_200000210301_100000698607 [0,0,0,0,0,0|2,1,1]=4 168 B12R2.44 CSc1cnc2cc[nH]c2c1 62a_200000210301_100009818992 [0,0,0,0,0,0|2,1,0]=3 169 B12R2.44 CSc1cnc2cc[nH]c2n1 62a_200000210301_100009847400 [0,0,0,0,0,0|3,1,0]=4 170 B12R2.44 CSc1cnc2cn[nH]c2c1 62a_200000210301_100009844038 [0,0,0,0,0,0|3,1,0]=4 171 B12R2.44 CSc1cnc2nc[nH]c2c1 62a_200000210301_100000760087 [0,0,0,0,0,0|1,1,0]=2 172 B12R2.44 CSc1cnc2nccn2c1 62a_100000764708_200000210301 [0,0,0,0,0,0|3,1,0]=4 173 B12R2.44 CSc1cnc2nccn2c1 62a_200000210301_100000764708 [0,0,0,0,0,0|3,1,0]=4 174 B12R2.44 CSc1cnc2ncnn2c1 62a_100000737005_200000210301 [0,0,0,0,0,0|2,1,1]=4 175 B12R2.44 CSc1cnc2ncnn2c1 62a_200000210301_100000737005 [0,0,0,0,0,0|2,1,1]=4 176 B12R2.44 CSc1cnc2ncoc2c1 62a_100000721906_200000210301 [0,0,0,0,0,0|2,1,0]=3 177 B12R2.44 CSc1cnc2ncoc2c1 62a_200000210301_100000721906 [0,0,0,0,0,0|2,1,0]=3 178 B12R2.44 CSc1cnc2nscc2c1 62a_200000210301_200020642285 [0,0,0,0,0,0|3,1,0]=4 179 B12R2.44 CSc1cnc2nscc2c1 62a_200020642285_200000210301 [0,0,0,0,0,0|3,1,0]=4 180 B12R2.44 CSc1cnc2nsnc2c1 62a_100010192137_200000210301 [0,0,0,0,0,0|2,1,1]=4 181 B12R2.44 CSc1cnc2nsnc2c1 62a_200000210301_100010192137 [0,0,0,0,0,0|2,1,1]=4 182 B12R2.44 CSc1cnc2sccc2c1 62a_200000210301_100010135160 [0,0,0,0,0,0|3,1,0]=4 183 B12R2.44 CSc1cnc2scnc2c1 62a_100010178689_200000210301 [0,0,0,0,0,0|2,1,1]=4 184 B12R2.44 CSc1cnc2scnc2c1 62a_200000210301_100010178689 [0,0,0,0,0,0|2,1,1]=4 185 B12R2.44 CSc1ncc2cc[nH]c2n1 62a_200000210301_100000059789 [0,0,0,0,0,0|3,1,0]=4 186 B12R2.44 CSc1ncc2nc[nH]c2n1 62a_200000210301_100000009038 [0,0,0,0,0,0|2,1,0]=3 187 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 2230a_100000211504_200025704644 [0,0,0,0,0,0|3,0,1]=4 188 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 34a_100000211504_200025704644 [0,0,0,0,0,0|3,0,1]=4 189 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 2230a_100000736984_200025704644 [0,0,0,0,0,0|3,0,1]=4 190 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 34a_100000736984_200025704644 [0,0,0,0,0,0|3,0,1]=4 191 B12R2.44 [13CH3]Nc1ccc2c(c1)COC2 2230a_100011728444_200025704644 [0,0,0,0,0,0|4,0,0]=4 192 B12R2.44 [13CH3]Nc1ccc2c(c1)COC2 34a_100011728444_200025704644 [0,0,0,0,0,0|4,0,0]=4 193 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 2230a_100000209953_200025704644 [0,0,0,0,0,0|3,0,1]=4 194 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 34a_100000209953_200025704644 [0,0,0,0,0,0|3,0,1]=4 195 B12R2.44 [13CH3]Nc1ccc2ccoc2c1 34a_100000102395_200025704644 [0,0,0,0,0,0|3,0,0]=3 196 B12R2.44 [13CH3]Nc1ccc2cnoc2c1 34a_100000084182_200025704644 [0,0,0,0,0,0|4,0,0]=4 197 B12R2.44 [13CH3]Nc1ccc2ncoc2c1 34a_100011248239_200025704644 [0,0,0,0,0,0|2,0,0]=2 198 B12R2.44 [13CH3]Nc1ccc2ncsc2c1 34a_100011215093_200025704644 [0,0,0,0,0,0|2,0,0]=2 199 B12R2.44 [13CH3]Nc1ccc2occc2c1 34a_106430523501_200025704644 [0,0,0,0,0,0|3,0,0]=3 200 B12R2.44 [13CH3]Nc1ccc2ocnc2c1 34a_100011219863_200025704644 [0,0,0,0,0,0|2,0,1]=3 201 B12R2.44 [13CH3]Nc1ccc2oncc2c1 34a_100000037595_200025704644 [0,0,0,0,0,0|4,0,0]=4 202 B12R2.44 [13CH3]Nc1ccc2sccc2c1 34a_100000681076_200025704644 [0,0,0,0,0,0|3,0,0]=3 203 B12R2.44 [13CH3]Nc1ccc2scnc2c1 34a_100000047738_200025704644 [0,0,0,0,0,0|2,0,1]=3 204 B12R2.44 [13CH3]Nc1ccc2sncc2c1 34a_100000077742_200025704644 [0,0,0,0,0,0|4,0,0]=4 205 B12R2.44 [13CH3]Oc1ccc2[nH]ccc2c1 34a_100000756620_200025704644 [0,0,0,0,0,0|1,0,1]=2 206 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 34a_100000209987_200025704644 [0,0,0,0,0,0|2,0,1]=3 207 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 7a_100000209987_200025704644 [0,0,0,0,0,0|2,0,1]=3 208 B12R2.44 [13CH3]Oc1ccc2c(c1)CCN2 34a_100020636429_200025704644 [0,0,0,0,0,0|1,0,2]=3 209 B12R2.44 [13CH3]Oc1ccc2c(c1)CNC2 34a_100015195982_200025704644 [0,0,0,0,0,0|3,0,0]=3 210 B12R2.44 [13CH3]Oc1ccc2c(c1)NCC2 34a_100020636427_200025704644 [0,0,0,0,0,0|1,0,1]=2 211 B12R2.44 [13CH3]Oc1ccc2c(c1)OCO2 34a_100000210298_200025704644 [0,0,0,0,0,0|2,0,1]=3 212 B12R2.44 [13CH3]Oc1ccc2cc[nH]c2c1 34a_100000036713_200025704644 [0,0,0,0,0,0|1,0,0]=1 213 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 34a_100000089557_200025704644 [0,0,0,0,0,0|2,0,0]=2 214 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 7a_100000089557_200025704644 [0,0,0,0,0,0|2,0,0]=2 215 B12R2.44 [13CH3]Oc1ccc2cnoc2c1 34a_100000098417_200025704644 [0,0,0,0,0,0|3,0,0]=3 216 B12R2.44 [13CH3]Oc1ccc2cnoc2c1 7a_100000098417_200025704644 [0,0,0,0,0,0|3,0,0]=3 217 B12R2.44 [13CH3]Oc1ccc2ncsc2c1 34a_100011995850_200025704644 [0,0,0,0,0,0|1,0,0]=1 218 B12R2.44 [13CH3]Oc1ccc2ncsc2c1 7a_100011995850_200025704644 [0,0,0,0,0,0|1,0,0]=1 219 B12R2.44 [13CH3]Oc1ccc2nonc2c1 34a_100000036933_200025704644 [0,0,0,0,0,0|1,0,1]=2 220 B12R2.44 [13CH3]Oc1ccc2occc2c1 34a_100000070125_200025704644 [0,0,0,0,0,0|2,0,0]=2 221 B12R2.44 [13CH3]Oc1ccc2occc2c1 7a_100000070125_200025704644 [0,0,0,0,0,0|2,0,0]=2 222 B12R2.44 [13CH3]Oc1ccc2sccc2c1 34a_100012180905_200025704644 [0,0,0,0,0,0|2,0,0]=2 223 B12R2.44 [13CH3]Oc1ccc2sccc2c1 7a_100012180905_200025704644 [0,0,0,0,0,0|2,0,0]=2 224 B12R2.44 [13CH3]Oc1ccc2scnc2c1 34a_200009850626_200025704644 [0,0,0,0,0,0|1,0,1]=2 225 B12R2.44 [13CH3]Oc1ccc2scnc2c1 7a_200009850626_200025704644 [0,0,0,0,0,0|1,0,1]=2 226 B12R2.44 [13CH3]Oc1ccn2ccnc2c1 34a_100009863278_200025704644 [0,0,0,0,0,0|2,0,1]=3 227 B12R2.44 [13CH3]Oc1cnc2[nH]ccc2c1 34a_100000087691_200025704644 [0,0,0,0,0,0|2,0,1]=3 228 B12R2.44 [13CH3]Sc1cc2[nH]ccc2cn1 62a_200025704644_100000089685 [0,0,0,0,0,0|2,1,0]=3 229 B12R2.44 [13CH3]Sc1cc2[nH]ncc2cn1 62a_200025704644_100009872621 [0,0,0,0,0,0|3,1,0]=4 230 B12R2.44 [13CH3]Sc1cc2c(cn1)CCN2 62a_100020639910_200025704644 [0,0,0,0,0,0|2,1,1]=4 231 B12R2.44 [13CH3]Sc1cc2c(cn1)CCN2 62a_200025704644_100020639910 [0,0,0,0,0,0|2,1,1]=4 232 B12R2.44 [13CH3]Sc1cc2cc[nH]c2cn1 62a_200025704644_100009864809 [0,0,0,0,0,0|2,1,1]=4 233 B12R2.44 [13CH3]Sc1cc2nc[nH]c2cn1 62a_200025704644_100000070173 [0,0,0,0,0,0|1,1,2]=4 234 B12R2.44 [13CH3]Sc1cc2ncnn2cn1 62a_100000101099_200025704644 [0,0,0,0,0,0|2,1,1]=4 235 B12R2.44 [13CH3]Sc1cc2ncnn2cn1 62a_200025704644_100000101099 [0,0,0,0,0,0|2,1,1]=4 236 B12R2.44 [13CH3]Sc1cc2sccc2cn1 62a_200025704644_200016184645 [0,0,0,0,0,0|3,1,0]=4 237 B12R2.44 [13CH3]Sc1ccc2[nH]ccc2c1 62a_200025704644_100000035808 [0,0,0,0,0,0|1,1,1]=3 238 B12R2.44 [13CH3]Sc1ccc2[nH]ccc2n1 62a_200025704644_100000087148 [0,0,0,0,0,0|2,1,1]=4 239 B12R2.44 [13CH3]Sc1ccc2[nH]cnc2c1 62a_200025704644_100011265325 [0,0,0,0,0,0|0,1,2]=3 240 B12R2.44 [13CH3]Sc1ccc2[nH]ncc2c1 62a_200025704644_100000049815 [0,0,0,0,0,0|2,1,1]=4 241 B12R2.44 [13CH3]Sc1ccc2c(c1)C=CC2 62a_100009814306_200025704644 [0,0,0,0,0,0|2,1,0]=3 242 B12R2.44 [13CH3]Sc1ccc2c(c1)C=CC2 62a_200025704644_100009814306 [0,0,0,0,0,0|2,1,0]=3 243 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200009818231_200025704644 [0,0,0,0,0,0|2,1,0]=3 244 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200025704644_200009818231 [0,0,0,0,0,0|2,1,0]=3 245 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_100000745594_200025704644 [0,0,0,0,0,0|2,1,1]=4 246 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_200025704644_100000745594 [0,0,0,0,0,0|2,1,1]=4 247 B12R2.44 [13CH3]Sc1ccc2c(c1)CCN2 62a_100000691068_200025704644 [0,0,0,0,0,0|1,1,2]=4 248 B12R2.44 [13CH3]Sc1ccc2c(c1)CCN2 62a_200025704644_100000691068 [0,0,0,0,0,0|1,1,2]=4 249 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_100000729065_200025704644 [0,0,0,0,0,0|2,1,1]=4 250 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_200025704644_100000729065 [0,0,0,0,0,0|2,1,1]=4 251 B12R2.44 [13CH3]Sc1ccc2c(c1)CNC2 62a_100000702344_200025704644 [0,0,0,0,0,0|3,1,0]=4 252 B12R2.44 [13CH3]Sc1ccc2c(c1)CNC2 62a_200025704644_100000702344 [0,0,0,0,0,0|3,1,0]=4 253 B12R2.44 [13CH3]Sc1ccc2c(c1)COC2 62a_100000698232_200025704644 [0,0,0,0,0,0|3,1,0]=4 254 B12R2.44 [13CH3]Sc1ccc2c(c1)COC2 62a_200025704644_100000698232 [0,0,0,0,0,0|3,1,0]=4 255 B12R2.44 [13CH3]Sc1ccc2c(c1)NCC2 62a_100000754641_200025704644 [0,0,0,0,0,0|1,1,1]=3 256 B12R2.44 [13CH3]Sc1ccc2c(c1)NCC2 62a_200025704644_100000754641 [0,0,0,0,0,0|1,1,1]=3 257 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_100009818566_200025704644 [0,0,0,0,0,0|2,1,1]=4 258 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_200025704644_100009818566 [0,0,0,0,0,0|2,1,1]=4 259 B12R2.44 [13CH3]Sc1ccc2cc[nH]c2c1 62a_200025704644_100000743809 [0,0,0,0,0,0|1,1,0]=2 260 B12R2.44 [13CH3]Sc1ccc2cc[nH]c2n1 62a_200025704644_100009814870 [0,0,0,0,0,0|2,1,0]=3 261 B12R2.44 [13CH3]Sc1ccc2ccnn2c1 62a_200025704644_100009820231 [0,0,0,0,0,0|2,1,1]=4 262 B12R2.44 [13CH3]Sc1ccc2ccoc2c1 62a_200025704644_100000759542 [0,0,0,0,0,0|2,1,0]=3 263 B12R2.44 [13CH3]Sc1ccc2ccsc2c1 62a_200025704644_100009888917 [0,0,0,0,0,0|2,1,0]=3 264 B12R2.44 [13CH3]Sc1ccc2cn[nH]c2c1 62a_200025704644_100000049514 [0,0,0,0,0,0|2,1,0]=3 265 B12R2.44 [13CH3]Sc1ccc2cn[nH]c2n1 62a_100009883947_200025704644 [0,0,0,0,0,0|3,1,0]=4 266 B12R2.44 [13CH3]Sc1ccc2cnoc2c1 62a_200025704644_100009817722 [0,0,0,0,0,0|3,1,0]=4 267 B12R2.44 [13CH3]Sc1ccc2cscc2c1 62a_200025704644_200010760811 [0,0,0,0,0,0|3,1,0]=4 268 B12R2.44 [13CH3]Sc1ccc2csnc2c1 62a_200025704644_100010170880 [0,0,0,0,0,0|2,1,1]=4 269 B12R2.44 [13CH3]Sc1ccc2nc[nH]c2n1 62a_100009820032_200025704644 [0,0,0,0,0,0|1,1,0]=2 270 B12R2.44 [13CH3]Sc1ccc2nc[nH]c2n1 62a_200025704644_100000077665 [0,0,0,0,0,0|1,1,0]=2 271 B12R2.44 [13CH3]Sc1ccc2nccn2c1 62a_100000746083_200025704644 [0,0,0,0,0,0|2,1,0]=3 272 B12R2.44 [13CH3]Sc1ccc2nccn2c1 62a_200025704644_100000746083 [0,0,0,0,0,0|2,1,0]=3 273 B12R2.44 [13CH3]Sc1ccc2nccn2n1 62a_100009883166_200025704644 [0,0,0,0,0,0|3,1,0]=4 274 B12R2.44 [13CH3]Sc1ccc2nccn2n1 62a_200025704644_100000058501 [0,0,0,0,0,0|3,1,0]=4 275 B12R2.44 [13CH3]Sc1ccc2ncnn2c1 62a_100009816971_200025704644 [0,0,0,0,0,0|1,1,1]=3 276 B12R2.44 [13CH3]Sc1ccc2ncnn2c1 62a_200025704644_100009816971 [0,0,0,0,0,0|1,1,1]=3 277 B12R2.44 [13CH3]Sc1ccc2ncoc2c1 62a_200025704644_100009817590 [0,0,0,0,0,0|1,1,0]=2 278 B12R2.44 [13CH3]Sc1ccc2ncsc2c1 62a_100009816678_200025704644 [0,0,0,0,0,0|1,1,0]=2 279 B12R2.44 [13CH3]Sc1ccc2ncsc2c1 62a_200025704644_100009816678 [0,0,0,0,0,0|1,1,0]=2 280 B12R2.44 [13CH3]Sc1ccc2ncsc2n1 62a_100010090457_200025704644 [0,0,0,0,0,0|2,1,0]=3 281 B12R2.44 [13CH3]Sc1ccc2ncsc2n1 62a_200025704644_100010381354 [0,0,0,0,0,0|2,1,0]=3 282 B12R2.44 [13CH3]Sc1ccc2nn[nH]c2c1 62a_200025704644_100009817464 [0,0,0,0,0,0|1,1,0]=2 283 B12R2.44 [13CH3]Sc1ccc2nncn2c1 62a_100000764363_200025704644 [0,0,0,0,0,0|3,1,0]=4 284 B12R2.44 [13CH3]Sc1ccc2nncn2c1 62a_200025704644_100000764363 [0,0,0,0,0,0|3,1,0]=4 285 B12R2.44 [13CH3]Sc1ccc2nnnn2c1 62a_100009817084_200025704644 [0,0,0,0,0,0|2,1,1]=4 286 B12R2.44 [13CH3]Sc1ccc2nnnn2c1 62a_200025704644_100009817084 [0,0,0,0,0,0|2,1,1]=4 287 B12R2.44 [13CH3]Sc1ccc2nonc2c1 62a_100009814275_200025704644 [0,0,0,0,0,0|1,1,1]=3 288 B12R2.44 [13CH3]Sc1ccc2nonc2c1 62a_200025704644_100009814275 [0,0,0,0,0,0|1,1,1]=3 289 B12R2.44 [13CH3]Sc1ccc2nsnc2c1 62a_100009814274_200025704644 [0,0,0,0,0,0|1,1,1]=3 290 B12R2.44 [13CH3]Sc1ccc2nsnc2c1 62a_200025704644_100009814274 [0,0,0,0,0,0|1,1,1]=3 291 B12R2.44 [13CH3]Sc1ccc2occc2c1 62a_200025704644_100000691453 [0,0,0,0,0,0|2,1,0]=3 292 B12R2.44 [13CH3]Sc1ccc2occc2n1 62a_200025704644_100009851292 [0,0,0,0,0,0|3,1,0]=4 293 B12R2.44 [13CH3]Sc1ccc2ocnc2c1 62a_200025704644_100009816175 [0,0,0,0,0,0|1,1,1]=3 294 B12R2.44 [13CH3]Sc1ccc2oncc2c1 62a_200025704644_100009817723 [0,0,0,0,0,0|3,1,0]=4 295 B12R2.44 [13CH3]Sc1ccc2sccc2c1 62a_200025704644_100009814439 [0,0,0,0,0,0|2,1,0]=3 296 B12R2.44 [13CH3]Sc1ccc2sccc2n1 62a_200025704644_100012000956 [0,0,0,0,0,0|3,1,0]=4 297 B12R2.44 [13CH3]Sc1ccc2scnc2c1 62a_200025704644_100010005895 [0,0,0,0,0,0|1,1,1]=3 298 B12R2.44 [13CH3]Sc1ccn2ccnc2c1 62a_200025704644_100000087792 [0,0,0,0,0,0|2,1,1]=4 299 B12R2.44 [13CH3]Sc1ccn2nccc2c1 62a_200025704644_100000763084 [0,0,0,0,0,0|2,1,0]=3 300 B12R2.44 [13CH3]Sc1ccn2nccc2n1 62a_100000691470_200025704644 [0,0,0,0,0,0|3,1,0]=4 301 B12R2.44 [13CH3]Sc1ccn2nccc2n1 62a_200025704644_100000051569 [0,0,0,0,0,0|3,1,0]=4 302 B12R2.44 [13CH3]Sc1ccn2ncnc2c1 62a_100009819723_200025704644 [0,0,0,0,0,0|1,1,1]=3 303 B12R2.44 [13CH3]Sc1ccn2ncnc2c1 62a_200025704644_100009819723 [0,0,0,0,0,0|1,1,1]=3 304 B12R2.44 [13CH3]Sc1ccn2ncnc2n1 62a_100000054300_200025704644 [0,0,0,0,0,0|2,1,1]=4 305 B12R2.44 [13CH3]Sc1ccn2ncnc2n1 62a_200025704644_100000054300 [0,0,0,0,0,0|2,1,1]=4 306 B12R2.44 [13CH3]Sc1ccn2nncc2c1 62a_100009820036_200025704644 [0,0,0,0,0,0|3,1,0]=4 307 B12R2.44 [13CH3]Sc1ccn2nncc2c1 62a_200025704644_100009820036 [0,0,0,0,0,0|3,1,0]=4 308 B12R2.44 [13CH3]Sc1cn2ccnc2cn1 62a_102495339940_200025704644 [0,0,0,0,0,0|3,1,0]=4 309 B12R2.44 [13CH3]Sc1cn2ccnc2cn1 62a_200025704644_102495339940 [0,0,0,0,0,0|3,1,0]=4 310 B12R2.44 [13CH3]Sc1cn2ncnc2cn1 62a_100009847490_200025704644 [0,0,0,0,0,0|2,1,1]=4 311 B12R2.44 [13CH3]Sc1cn2ncnc2cn1 62a_200025704644_100009847490 [0,0,0,0,0,0|2,1,1]=4 312 B12R2.44 [13CH3]Sc1cnc2[nH]ccc2c1 62a_200025704644_100000760471 [0,0,0,0,0,0|2,1,1]=4 313 B12R2.44 [13CH3]Sc1cnc2c(c1)NCC2 62a_100000698607_200025704644 [0,0,0,0,0,0|2,1,1]=4 314 B12R2.44 [13CH3]Sc1cnc2c(c1)NCC2 62a_200025704644_100000698607 [0,0,0,0,0,0|2,1,1]=4 315 B12R2.44 [13CH3]Sc1cnc2cc[nH]c2c1 62a_200025704644_100009818992 [0,0,0,0,0,0|2,1,0]=3 316 B12R2.44 [13CH3]Sc1cnc2cc[nH]c2n1 62a_200025704644_100009847400 [0,0,0,0,0,0|3,1,0]=4 317 B12R2.44 [13CH3]Sc1cnc2cn[nH]c2c1 62a_200025704644_100009844038 [0,0,0,0,0,0|3,1,0]=4 318 B12R2.44 [13CH3]Sc1cnc2nc[nH]c2c1 62a_200025704644_100000760087 [0,0,0,0,0,0|1,1,0]=2 319 B12R2.44 [13CH3]Sc1cnc2nccn2c1 62a_100000764708_200025704644 [0,0,0,0,0,0|3,1,0]=4 320 B12R2.44 [13CH3]Sc1cnc2nccn2c1 62a_200025704644_100000764708 [0,0,0,0,0,0|3,1,0]=4 321 B12R2.44 [13CH3]Sc1cnc2ncnn2c1 62a_100000737005_200025704644 [0,0,0,0,0,0|2,1,1]=4 322 B12R2.44 [13CH3]Sc1cnc2ncnn2c1 62a_200025704644_100000737005 [0,0,0,0,0,0|2,1,1]=4 323 B12R2.44 [13CH3]Sc1cnc2ncoc2c1 62a_100000721906_200025704644 [0,0,0,0,0,0|2,1,0]=3 324 B12R2.44 [13CH3]Sc1cnc2ncoc2c1 62a_200025704644_100000721906 [0,0,0,0,0,0|2,1,0]=3 325 B12R2.44 [13CH3]Sc1cnc2nscc2c1 62a_200020642285_200025704644 [0,0,0,0,0,0|3,1,0]=4 326 B12R2.44 [13CH3]Sc1cnc2nscc2c1 62a_200025704644_200020642285 [0,0,0,0,0,0|3,1,0]=4 327 B12R2.44 [13CH3]Sc1cnc2nsnc2c1 62a_100010192137_200025704644 [0,0,0,0,0,0|2,1,1]=4 328 B12R2.44 [13CH3]Sc1cnc2nsnc2c1 62a_200025704644_100010192137 [0,0,0,0,0,0|2,1,1]=4 329 B12R2.44 [13CH3]Sc1cnc2sccc2c1 62a_200025704644_100010135160 [0,0,0,0,0,0|3,1,0]=4 330 B12R2.44 [13CH3]Sc1cnc2scnc2c1 62a_100010178689_200025704644 [0,0,0,0,0,0|2,1,1]=4 331 B12R2.44 [13CH3]Sc1cnc2scnc2c1 62a_200025704644_100010178689 [0,0,0,0,0,0|2,1,1]=4 332 B12R2.44 [13CH3]Sc1ncc2cc[nH]c2n1 62a_200025704644_100000059789 [0,0,0,0,0,0|3,1,0]=4 333 B12R2.44 [13CH3]Sc1ncc2nc[nH]c2n1 62a_200025704644_100000009038 [0,0,0,0,0,0|2,1,0]=3 334 B11R2.36 Oc1cc2[nH]ccc2cn1 271570a_203496583355_100000089685 [1,0,0,0,0,0|2,0,0]=3 335 B11R2.36 Oc1cc2[nH]ncc2cn1 271570a_203496583355_100009872621 [1,0,0,0,0,0|3,0,0]=4 336 B11R2.36 Oc1cc2c(cn1)CCN2 271570a_203496583355_100020639910 [1,0,0,0,0,0|2,0,1]=4 337 B11R2.36 Oc1cc2cc[nH]c2cn1 271570a_203496583355_100009864809 [1,0,0,0,0,0|2,0,1]=4 338 B11R2.36 Oc1cc2nc[nH]c2cn1 271570a_203496583355_100000070173 [1,0,0,0,0,0|1,0,2]=4 339 B11R2.36 Oc1cc2ncnn2cn1 271570a_203496583355_100000101099 [1,0,0,0,0,0|2,0,1]=4 340 B11R2.36 Oc1cc2sccc2cn1 271570a_203496583355_200016184645 [1,0,0,0,0,0|3,0,0]=4 341 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,0,0,0,0,0|1,0,1]=3 342 B11R2.36 Oc1ccc2[nH]ccc2n1 271570a_203496583355_100000087148 [1,0,0,0,0,0|2,0,1]=4 343 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [1,0,0,0,0,0|0,0,2]=3 344 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [1,0,0,0,0,0|2,0,1]=4 345 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,0,0,0,0,0|2,0,0]=3 346 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,0,0,0,0,0|2,0,0]=3 347 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [1,0,0,0,0,0|2,0,1]=4 348 B11R2.36 Oc1ccc2c(c1)CCN2 271570a_203496583355_100000026929 [1,0,0,0,0,0|1,0,2]=4 349 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,0,0,0,0,0|2,0,1]=4 350 B11R2.36 Oc1ccc2c(c1)CNC2 271570a_203496583355_100000702344 [1,0,0,0,0,0|3,0,0]=4 351 B11R2.36 Oc1ccc2c(c1)COC2 271570a_203496583355_100000698232 [1,0,0,0,0,0|3,0,0]=4 352 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [1,0,0,0,0,0|1,0,1]=3 353 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [1,0,0,0,0,0|2,0,1]=4 354 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [1,0,0,0,0,0|2,0,1]=4 355 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,0,0,0,0,0|1,0,0]=2 356 B11R2.36 Oc1ccc2cc[nH]c2n1 271570a_203496583355_100009814870 [1,0,0,0,0,0|2,0,0]=3 357 B11R2.36 Oc1ccc2ccnn2c1 271570a_203496583355_100009820231 [1,0,0,0,0,0|2,0,1]=4 358 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,0,0,0,0,0|2,0,0]=3 359 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,0,0,0,0,0|2,0,0]=3 360 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,0,0,0,0,0|2,0,0]=3 361 B11R2.36 Oc1ccc2cn[nH]c2n1 271570a_203496583355_100009883947 [1,0,0,0,0,0|3,0,0]=4 362 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [1,0,0,0,0,0|3,0,0]=4 363 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [1,0,0,0,0,0|3,0,0]=4 364 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [1,0,0,0,0,0|2,0,1]=4 365 B11R2.36 Oc1ccc2nc[nH]c2n1 271570a_203496583355_100000077665 [1,0,0,0,0,0|1,0,0]=2 366 B11R2.36 Oc1ccc2nccn2c1 271570a_203496583355_100000746083 [1,0,0,0,0,0|2,0,0]=3 367 B11R2.36 Oc1ccc2nccn2n1 271570a_203496583355_100009883166 [1,0,0,0,0,0|3,0,0]=4 368 B11R2.36 Oc1ccc2ncnn2c1 271570a_203496583355_100009816971 [1,0,0,0,0,0|1,0,1]=3 369 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [1,0,0,0,0,0|1,0,0]=2 370 B11R2.36 Oc1ccc2ncsc2c1 271570a_203496583355_100009816678 [1,0,0,0,0,0|1,0,0]=2 371 B11R2.36 Oc1ccc2ncsc2n1 271570a_203496583355_100010381354 [1,0,0,0,0,0|2,0,0]=3 372 B11R2.36 Oc1ccc2nn[nH]c2c1 271570a_203496583355_100009817464 [1,0,0,0,0,0|1,0,0]=2 373 B11R2.36 Oc1ccc2nncn2c1 271570a_203496583355_100000764363 [1,0,0,0,0,0|3,0,0]=4 374 B11R2.36 Oc1ccc2nnnn2c1 271570a_203496583355_100009817084 [1,0,0,0,0,0|2,0,1]=4 375 B11R2.36 Oc1ccc2nonc2c1 271570a_203496583355_100009814275 [1,0,0,0,0,0|1,0,1]=3 376 B11R2.36 Oc1ccc2nsnc2c1 271570a_203496583355_100009814274 [1,0,0,0,0,0|1,0,1]=3 377 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,0,0,0,0,0|2,0,0]=3 378 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [1,0,0,0,0,0|3,0,0]=4 379 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [1,0,0,0,0,0|1,0,1]=3 380 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [1,0,0,0,0,0|3,0,0]=4 381 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [1,0,0,0,0,0|2,0,0]=3 382 B11R2.36 Oc1ccc2sccc2n1 271570a_203496583355_100012000956 [1,0,0,0,0,0|3,0,0]=4 383 B11R2.36 Oc1ccc2scnc2c1 271570a_203496583355_100010005895 [1,0,0,0,0,0|1,0,1]=3 384 B11R2.36 Oc1ccn2ccnc2c1 271570a_203496583355_100009816855 [1,0,0,0,0,0|2,0,1]=4 385 B11R2.36 Oc1ccn2nccc2c1 271570a_203496583355_100000763084 [1,0,0,0,0,0|2,0,0]=3 386 B11R2.36 Oc1ccn2nccc2n1 271570a_203496583355_100000691470 [1,0,0,0,0,0|3,0,0]=4 387 B11R2.36 Oc1ccn2ncnc2c1 271570a_203496583355_100009819723 [1,0,0,0,0,0|1,0,1]=3 388 B11R2.36 Oc1ccn2ncnc2n1 271570a_203496583355_100000054300 [1,0,0,0,0,0|2,0,1]=4 389 B11R2.36 Oc1ccn2nncc2c1 271570a_203496583355_100009820036 [1,0,0,0,0,0|3,0,0]=4 390 B11R2.36 Oc1cn2ccnc2cn1 271570a_203496583355_102495339940 [1,0,0,0,0,0|3,0,0]=4 391 B11R2.36 Oc1cn2ncnc2cn1 271570a_203496583355_100009847490 [1,0,0,0,0,0|2,0,1]=4 392 B11R2.36 Oc1cnc2[nH]ccc2c1 271570a_203496583355_100000760471 [1,0,0,0,0,0|2,0,1]=4 393 B11R2.36 Oc1cnc2c(c1)NCC2 271570a_203496583355_100000698607 [1,0,0,0,0,0|2,0,1]=4 394 B11R2.36 Oc1cnc2cc[nH]c2c1 271570a_203496583355_100009818992 [1,0,0,0,0,0|2,0,0]=3 395 B11R2.36 Oc1cnc2cn[nH]c2c1 271570a_203496583355_100009844038 [1,0,0,0,0,0|3,0,0]=4 396 B11R2.36 Oc1cnc2nc[nH]c2c1 271570a_203496583355_100000760087 [1,0,0,0,0,0|1,0,0]=2 397 B11R2.36 Oc1cnc2nccn2c1 271570a_203496583355_100000764708 [1,0,0,0,0,0|3,0,0]=4 398 B11R2.36 Oc1cnc2ncnn2c1 271570a_203496583355_100000737005 [1,0,0,0,0,0|2,0,1]=4 399 B11R2.36 Oc1cnc2ncoc2c1 271570a_203496583355_100000721906 [1,0,0,0,0,0|2,0,0]=3 400 B11R2.36 Oc1cnc2nscc2c1 271570a_203496583355_200020642285 [1,0,0,0,0,0|3,0,0]=4 401 B11R2.36 Oc1cnc2nsnc2c1 271570a_203496583355_100010192137 [1,0,0,0,0,0|2,0,1]=4 402 B11R2.36 Oc1cnc2sccc2c1 271570a_203496583355_100010135160 [1,0,0,0,0,0|3,0,0]=4 403 B11R2.36 Oc1cnc2scnc2c1 271570a_203496583355_100010178689 [1,0,0,0,0,0|2,0,1]=4 404 B13R2.84 C=Cc1ccc2cc[nH]c2c1C 271570a_100011290941_100009816929 [0,1,0,0,0,0|2,0,1]=4 405 B13R2.84 C=Cc1ccc2ncsc2c1N 271570a_100011290941_100010998030 [0,1,0,0,0,0|2,0,1]=4 406 B13R2.84 C=Cc1cnc2nc[nH]c2c1C 271570a_100011290941_100010140963 [0,1,0,0,0,0|2,0,1]=4 407 B13R2.84 COc1ccc2[nH]ccc2c1O 271570a_203496583355_100010169049 [0,1,0,0,0,0|1,0,1]=3 408 B13R2.84 COc1ccc2[nH]ncc2c1Cl 7a_100009844731_200000210301 [0,1,0,0,0,0|2,0,1]=4 409 B13R2.84 COc1ccc2[nH]ncc2c1O 271570a_203496583355_100010125576 [0,1,0,0,0,0|2,0,1]=4 410 B13R2.84 COc1cnc2[nH]ccc2c1O 271570a_203496583355_100000097410 [0,1,0,0,0,0|2,0,1]=4 411 B13R2.84 COc1ncc2cc[nH]c2c1O 271570a_203496583355_100010168355 [0,1,0,0,0,0|2,0,0]=3 412 B13R2.84 CSc1ccc2[nH]ccc2c1C 62a_200000210301_100010731972 [0,1,0,0,0,0|1,1,1]=4 413 B13R2.84 CSc1ccc2[nH]ccc2c1F 62a_100000700836_200000210301 [0,1,0,0,0,0|1,1,1]=4 414 B13R2.84 CSc1ccc2[nH]ccc2c1F 62a_200000210301_100000700836 [0,1,0,0,0,0|1,1,1]=4 415 B13R2.84 CSc1ccc2[nH]cnc2c1C 62a_200000210301_100010009745 [0,1,0,0,0,0|0,1,2]=4 416 B13R2.84 CSc1ccc2cc[nH]c2c1C 62a_200000210301_100009816929 [0,1,0,0,0,0|1,1,0]=3 417 B13R2.84 CSc1ccc2cn[nH]c2c1F 62a_200000210301_100102525427 [0,1,0,0,0,0|2,1,0]=4 418 B13R2.84 CSc1ccc2nccn2c1C 62a_100012569086_200000210301 [0,1,0,0,0,0|2,1,0]=4 419 B13R2.84 CSc1ccc2nccn2c1C 62a_200000210301_100012569086 [0,1,0,0,0,0|2,1,0]=4 420 B13R2.84 CSc1ccc2ncnn2c1C 62a_200000210301_100010201169 [0,1,0,0,0,0|1,1,1]=4 421 B13R2.84 CSc1ccc2ncsc2c1N 62a_100010998030_200000210301 [0,1,0,0,0,0|1,1,0]=3 422 B13R2.84 CSc1cnc2nc[nH]c2c1C 62a_200000210301_100010140963 [0,1,0,0,0,0|1,1,0]=3 423 B13R2.84 CSc1ncc2cc[nH]c2c1C 62a_200000210301_100010244392 [0,1,0,0,0,0|2,1,0]=4 424 B13R2.84 Cc1c(ccc2c1[nH]cc2)S[13CH3] 62a_200025704644_100009816929 [0,1,0,0,0,0|1,1,0]=3 425 B13R2.84 Cc1c(ccc2c1cc[nH]2)S[13CH3] 62a_200025704644_100010731972 [0,1,0,0,0,0|1,1,1]=4 426 B13R2.84 Cc1c(ccc2c1nc[nH]2)S[13CH3] 62a_200025704644_100010009745 [0,1,0,0,0,0|0,1,2]=4 427 B13R2.84 Cc1c(ccc2n1ccn2)S[13CH3] 62a_100012569086_200025704644 [0,1,0,0,0,0|2,1,0]=4 428 B13R2.84 Cc1c(ccc2n1ccn2)S[13CH3] 62a_200025704644_100012569086 [0,1,0,0,0,0|2,1,0]=4 429 B13R2.84 Cc1c(ccc2n1ncn2)S[13CH3] 62a_200025704644_100010201169 [0,1,0,0,0,0|1,1,1]=4 430 B13R2.84 Cc1c(cnc2c1[nH]cn2)S[13CH3] 62a_200025704644_100010140963 [0,1,0,0,0,0|1,1,0]=3 431 B13R2.84 Cc1c(ncc2c1[nH]cc2)S[13CH3] 62a_200025704644_100010244392 [0,1,0,0,0,0|2,1,0]=4 432 B13R2.84 N#Cc1ccc2cc[nH]c2c1O 271570a_203496583355_103550291079 [0,1,0,0,0,0|3,0,0]=4 433 B13R2.84 [13CH3]Oc1ccc2[nH]ncc2c1Cl 7a_100009844731_200025704644 [0,1,0,0,0,0|2,0,1]=4 434 B13R2.84 [13CH3]Sc1ccc2[nH]ccc2c1F 62a_100000700836_200025704644 [0,1,0,0,0,0|1,1,1]=4 435 B13R2.84 [13CH3]Sc1ccc2[nH]ccc2c1F 62a_200025704644_100000700836 [0,1,0,0,0,0|1,1,1]=4 436 B13R2.84 [13CH3]Sc1ccc2cn[nH]c2c1F 62a_200025704644_100102525427 [0,1,0,0,0,0|2,1,0]=4 437 B13R2.84 [13CH3]Sc1ccc2ncsc2c1N 62a_100010998030_200025704644 [0,1,0,0,0,0|1,1,0]=3 438 B13R2.430 C=C(C)c1cc2[nH]ccc2cn1 271570a_100000694244_100000089685 [0,1,0,0,0,0|3,0,0]=4 439 B13R2.430 C=C(C)c1ccc2[nH]ccc2c1 271570a_100000694244_100000211741 [0,1,0,0,0,0|2,0,1]=4 440 B13R2.430 C=C(C)c1ccc2[nH]cnc2c1 271570a_100000694244_100011265325 [0,1,0,0,0,0|1,0,2]=4 441 B13R2.430 C=C(C)c1ccc2c(c1)C=CC2 271570a_100000694244_100009814306 [0,1,0,0,0,0|3,0,0]=4 442 B13R2.430 C=C(C)c1ccc2c(c1)CC=C2 271570a_100000694244_200009818231 [0,1,0,0,0,0|3,0,0]=4 443 B13R2.430 C=C(C)c1ccc2c(c1)NCC2 271570a_100000694244_100000754641 [0,1,0,0,0,0|2,0,1]=4 444 B13R2.430 C=C(C)c1ccc2cc[nH]c2c1 271570a_100000694244_100000743809 [0,1,0,0,0,0|2,0,0]=3 445 B13R2.430 C=C(C)c1ccc2cc[nH]c2n1 271570a_100000694244_100009814870 [0,1,0,0,0,0|3,0,0]=4 446 B13R2.430 C=C(C)c1ccc2ccoc2c1 271570a_100000694244_100000759542 [0,1,0,0,0,0|3,0,0]=4 447 B13R2.430 C=C(C)c1ccc2ccsc2c1 271570a_100000694244_100009888917 [0,1,0,0,0,0|3,0,0]=4 448 B13R2.430 C=C(C)c1ccc2cn[nH]c2c1 271570a_100000694244_100000049514 [0,1,0,0,0,0|3,0,0]=4 449 B13R2.430 C=C(C)c1ccc2nc[nH]c2n1 271570a_100000694244_100000077665 [0,1,0,0,0,0|2,0,0]=3 450 B13R2.430 C=C(C)c1ccc2nccn2c1 271570a_100000694244_100000746083 [0,1,0,0,0,0|3,0,0]=4 451 B13R2.430 C=C(C)c1ccc2ncnn2c1 271570a_100000694244_100009816971 [0,1,0,0,0,0|2,0,1]=4 452 B13R2.430 C=C(C)c1ccc2ncoc2c1 271570a_100000694244_100009817590 [0,1,0,0,0,0|2,0,0]=3 453 B13R2.430 C=C(C)c1ccc2ncsc2c1 271570a_100000694244_100009816678 [0,1,0,0,0,0|2,0,0]=3 454 B13R2.430 C=C(C)c1ccc2ncsc2n1 271570a_100000694244_100010381354 [0,1,0,0,0,0|3,0,0]=4 455 B13R2.430 C=C(C)c1ccc2nn[nH]c2c1 271570a_100000694244_100009817464 [0,1,0,0,0,0|2,0,0]=3 456 B13R2.430 C=C(C)c1ccc2nonc2c1 271570a_100000694244_100009814275 [0,1,0,0,0,0|2,0,1]=4 457 B13R2.430 C=C(C)c1ccc2nsnc2c1 271570a_100000694244_100009814274 [0,1,0,0,0,0|2,0,1]=4 458 B13R2.430 C=C(C)c1ccc2occc2c1 271570a_100000694244_100012343831 [0,1,0,0,0,0|3,0,0]=4 459 B13R2.430 C=C(C)c1ccc2ocnc2c1 271570a_100000694244_100009816175 [0,1,0,0,0,0|2,0,1]=4 460 B13R2.430 C=C(C)c1ccc2sccc2c1 271570a_100000694244_100009814439 [0,1,0,0,0,0|3,0,0]=4 461 B13R2.430 C=C(C)c1ccc2scnc2c1 271570a_100000694244_100010005895 [0,1,0,0,0,0|2,0,1]=4 462 B13R2.430 C=C(C)c1ccn2nccc2c1 271570a_100000694244_100000763084 [0,1,0,0,0,0|3,0,0]=4 463 B13R2.430 C=C(C)c1ccn2ncnc2c1 271570a_100000694244_100009819723 [0,1,0,0,0,0|2,0,1]=4 464 B13R2.430 C=C(C)c1cnc2cc[nH]c2c1 271570a_100000694244_100009818992 [0,1,0,0,0,0|3,0,0]=4 465 B13R2.430 C=C(C)c1cnc2nc[nH]c2c1 271570a_100000694244_100000760087 [0,1,0,0,0,0|2,0,0]=3 466 B13R2.430 C=C(C)c1cnc2ncoc2c1 271570a_100000694244_100000721906 [0,1,0,0,0,0|3,0,0]=4 467 B13R2.430 CC(=O)c1ccc2[nH]ccc2c1 1458a_100000752189_200000210301 [0,1,0,0,0,0|2,0,1]=4 468 B13R2.430 CC(=O)c1ccc2[nH]cnc2c1 1458a_100000184039_200000210301 [0,1,0,0,0,0|1,0,2]=4 469 B13R2.430 CC(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_200000210301 [0,1,0,0,0,0|2,0,0]=3 470 B13R2.430 CC(=O)c1ccc2ccoc2c1 1458a_100000077109_200000210301 [0,1,0,0,0,0|3,0,0]=4 471 B13R2.430 CC(=O)c1ccc2ccsc2c1 1458a_100000045399_200000210301 [0,1,0,0,0,0|3,0,0]=4 472 B13R2.430 CC(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_200000210301 [0,1,0,0,0,0|3,0,0]=4 473 B13R2.430 CC(=O)c1ccc2ncoc2c1 1458a_100000750374_200000210301 [0,1,0,0,0,0|2,0,0]=3 474 B13R2.430 CC(=O)c1ccc2ncsc2c1 1458a_100000183663_200000210301 [0,1,0,0,0,0|2,0,0]=3 475 B13R2.430 CC(=O)c1ccc2nonc2c1 1458a_100000031939_200000210301 [0,1,0,0,0,0|2,0,1]=4 476 B13R2.430 CC(=O)c1ccc2nsnc2c1 1458a_100000041451_200000210301 [0,1,0,0,0,0|2,0,1]=4 477 B13R2.430 CC(=O)c1ccc2occc2c1 1458a_100000039204_200000210301 [0,1,0,0,0,0|3,0,0]=4 478 B13R2.430 CC(=O)c1ccc2ocnc2c1 1458a_100000238527_200000210301 [0,1,0,0,0,0|2,0,1]=4 479 B13R2.430 CC(=O)c1ccc2sccc2c1 1458a_100000766740_200000210301 [0,1,0,0,0,0|3,0,0]=4 480 B13R2.430 CC(=O)c1ccc2scnc2c1 1458a_100000068124_200000210301 [0,1,0,0,0,0|2,0,1]=4 481 B13R2.430 CN(C)c1ccc2ncsc2n1 27a_100102631434_100010381354 [0,1,0,0,0,0|3,0,0]=4 482 B13R2.430 CN(C)c1ccn2ncnc2c1 27a_100102631434_100009819723 [0,1,0,0,0,0|2,0,1]=4 483 B13R2.430 CN(C)c1ncc2nc[nH]c2n1 27a_100102631434_100000009038 [0,1,0,0,0,0|3,0,0]=4 484 B13R2.430 [13CH3]C(=O)c1ccc2[nH]ccc2c1 1458a_100000752189_200025704644 [0,1,0,0,0,0|2,0,1]=4 485 B13R2.430 [13CH3]C(=O)c1ccc2[nH]cnc2c1 1458a_100000184039_200025704644 [0,1,0,0,0,0|1,0,2]=4 486 B13R2.430 [13CH3]C(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_200025704644 [0,1,0,0,0,0|2,0,0]=3 487 B13R2.430 [13CH3]C(=O)c1ccc2ccoc2c1 1458a_100000077109_200025704644 [0,1,0,0,0,0|3,0,0]=4 488 B13R2.430 [13CH3]C(=O)c1ccc2ccsc2c1 1458a_100000045399_200025704644 [0,1,0,0,0,0|3,0,0]=4 489 B13R2.430 [13CH3]C(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_200025704644 [0,1,0,0,0,0|3,0,0]=4 490 B13R2.430 [13CH3]C(=O)c1ccc2ncoc2c1 1458a_100000750374_200025704644 [0,1,0,0,0,0|2,0,0]=3 491 B13R2.430 [13CH3]C(=O)c1ccc2ncsc2c1 1458a_100000183663_200025704644 [0,1,0,0,0,0|2,0,0]=3 492 B13R2.430 [13CH3]C(=O)c1ccc2nonc2c1 1458a_100000031939_200025704644 [0,1,0,0,0,0|2,0,1]=4 493 B13R2.430 [13CH3]C(=O)c1ccc2nsnc2c1 1458a_100000041451_200025704644 [0,1,0,0,0,0|2,0,1]=4 494 B13R2.430 [13CH3]C(=O)c1ccc2occc2c1 1458a_100000039204_200025704644 [0,1,0,0,0,0|3,0,0]=4 495 B13R2.430 [13CH3]C(=O)c1ccc2ocnc2c1 1458a_100000238527_200025704644 [0,1,0,0,0,0|2,0,1]=4 496 B13R2.430 [13CH3]C(=O)c1ccc2sccc2c1 1458a_100000766740_200025704644 [0,1,0,0,0,0|3,0,0]=4 497 B13R2.430 [13CH3]C(=O)c1ccc2scnc2c1 1458a_100000068124_200025704644 [0,1,0,0,0,0|2,0,1]=4 498 B13R2.449 C=C=Cc1ccc2cc[nH]c2c1 271570a_100015277604_100000743809 [0,1,0,0,0,0|2,0,1]=4 499 B13R2.449 C=C=Cc1ccc2nc[nH]c2n1 271570a_100015277604_100000077665 [0,1,0,0,0,0|2,0,1]=4 500 B13R2.449 C=C=Cc1ccc2ncoc2c1 271570a_100015277604_100009817590 [0,1,0,0,0,0|2,0,1]=4 501 B13R2.449 C=C=Cc1ccc2ncsc2c1 271570a_100015277604_100009816678 [0,1,0,0,0,0|2,0,1]=4 502 B13R2.449 C=C=Cc1ccc2nn[nH]c2c1 271570a_100015277604_100009817464 [0,1,0,0,0,0|2,0,1]=4 503 B13R2.449 C=C=Cc1cnc2nc[nH]c2c1 271570a_100015277604_100000760087 [0,1,0,0,0,0|2,0,1]=4 504 B13R2.449 CC=Cc1cc2[nH]ccc2cn1 271570a_100016259895_100000089685 [0,1,0,0,0,0|3,0,0]=4 505 B13R2.449 CC=Cc1ccc2[nH]ccc2c1 271570a_100016259895_100000211741 [0,1,0,0,0,0|2,0,1]=4 506 B13R2.449 CC=Cc1ccc2[nH]cnc2c1 271570a_100016259895_100011265325 [0,1,0,0,0,0|1,0,2]=4 507 B13R2.449 CC=Cc1ccc2c(c1)C=CC2 271570a_100016259895_100009814306 [0,1,0,0,0,0|3,0,0]=4 508 B13R2.449 CC=Cc1ccc2c(c1)CC=C2 271570a_100016259895_200009818231 [0,1,0,0,0,0|3,0,0]=4 509 B13R2.449 CC=Cc1ccc2c(c1)NCC2 271570a_100016259895_100000754641 [0,1,0,0,0,0|2,0,1]=4 510 B13R2.449 CC=Cc1ccc2cc[nH]c2c1 271570a_100016259895_100000743809 [0,1,0,0,0,0|2,0,0]=3 511 B13R2.449 CC=Cc1ccc2cc[nH]c2n1 271570a_100016259895_100009814870 [0,1,0,0,0,0|3,0,0]=4 512 B13R2.449 CC=Cc1ccc2ccoc2c1 271570a_100016259895_100000759542 [0,1,0,0,0,0|3,0,0]=4 513 B13R2.449 CC=Cc1ccc2ccsc2c1 271570a_100016259895_100009888917 [0,1,0,0,0,0|3,0,0]=4 514 B13R2.449 CC=Cc1ccc2cn[nH]c2c1 271570a_100016259895_100000049514 [0,1,0,0,0,0|3,0,0]=4 515 B13R2.449 CC=Cc1ccc2nc[nH]c2n1 271570a_100016259895_100000077665 [0,1,0,0,0,0|2,0,0]=3 516 B13R2.449 CC=Cc1ccc2nccn2c1 271570a_100016259895_100000746083 [0,1,0,0,0,0|3,0,0]=4 517 B13R2.449 CC=Cc1ccc2ncnn2c1 271570a_100016259895_100009816971 [0,1,0,0,0,0|2,0,1]=4 518 B13R2.449 CC=Cc1ccc2ncoc2c1 271570a_100016259895_100009817590 [0,1,0,0,0,0|2,0,0]=3 519 B13R2.449 CC=Cc1ccc2ncsc2c1 271570a_100016259895_100009816678 [0,1,0,0,0,0|2,0,0]=3 520 B13R2.449 CC=Cc1ccc2ncsc2n1 271570a_100016259895_100010381354 [0,1,0,0,0,0|3,0,0]=4 521 B13R2.449 CC=Cc1ccc2nn[nH]c2c1 271570a_100016259895_100009817464 [0,1,0,0,0,0|2,0,0]=3 522 B13R2.449 CC=Cc1ccc2nonc2c1 271570a_100016259895_100009814275 [0,1,0,0,0,0|2,0,1]=4 523 B13R2.449 CC=Cc1ccc2nsnc2c1 271570a_100016259895_100009814274 [0,1,0,0,0,0|2,0,1]=4 524 B13R2.449 CC=Cc1ccc2occc2c1 271570a_100016259895_100012343831 [0,1,0,0,0,0|3,0,0]=4 525 B13R2.449 CC=Cc1ccc2ocnc2c1 271570a_100016259895_100009816175 [0,1,0,0,0,0|2,0,1]=4 526 B13R2.449 CC=Cc1ccc2sccc2c1 271570a_100016259895_100009814439 [0,1,0,0,0,0|3,0,0]=4 527 B13R2.449 CC=Cc1ccc2scnc2c1 271570a_100016259895_100010005895 [0,1,0,0,0,0|2,0,1]=4 528 B13R2.449 CC=Cc1ccn2nccc2c1 271570a_100016259895_100000763084 [0,1,0,0,0,0|3,0,0]=4 529 B13R2.449 CC=Cc1ccn2ncnc2c1 271570a_100016259895_100009819723 [0,1,0,0,0,0|2,0,1]=4 530 B13R2.449 CC=Cc1cnc2cc[nH]c2c1 271570a_100016259895_100009818992 [0,1,0,0,0,0|3,0,0]=4 531 B13R2.449 CC=Cc1cnc2nc[nH]c2c1 271570a_100016259895_100000760087 [0,1,0,0,0,0|2,0,0]=3 532 B13R2.449 CC=Cc1cnc2ncoc2c1 271570a_100016259895_100000721906 [0,1,0,0,0,0|3,0,0]=4 533 B13R2.449 CCNc1ccc2ccoc2c1 34a_100000102395_100000210202 [0,1,0,0,0,0|3,0,0]=4 534 B13R2.449 CCNc1ccc2ncoc2c1 34a_100011248239_100000210202 [0,1,0,0,0,0|2,0,0]=3 535 B13R2.449 CCNc1ccc2ncsc2c1 34a_100011215093_100000210202 [0,1,0,0,0,0|2,0,0]=3 536 B13R2.449 CCNc1ccc2ncsc2n1 27a_100015525214_100010381354 [0,1,0,0,0,0|3,0,0]=4 537 B13R2.449 CCNc1ccc2occc2c1 34a_106430523501_100000210202 [0,1,0,0,0,0|3,0,0]=4 538 B13R2.449 CCNc1ccc2ocnc2c1 34a_100011219863_100000210202 [0,1,0,0,0,0|2,0,1]=4 539 B13R2.449 CCNc1ccc2sccc2c1 34a_100000681076_100000210202 [0,1,0,0,0,0|3,0,0]=4 540 B13R2.449 CCNc1ccc2scnc2c1 34a_100000047738_100000210202 [0,1,0,0,0,0|2,0,1]=4 541 B13R2.449 CCNc1ccn2ncnc2c1 27a_100015525214_100009819723 [0,1,0,0,0,0|2,0,1]=4 542 B13R2.449 CCNc1ncc2nc[nH]c2n1 27a_100015525214_100000009038 [0,1,0,0,0,0|3,0,0]=4 543 B13R2.449 CCOc1ccc2[nH]ccc2c1 34a_100000756620_100000210202 [0,1,0,0,0,0|1,0,1]=3 544 B13R2.449 CCOc1ccc2c(c1)CCC2 34a_100000209987_100000210202 [0,1,0,0,0,0|2,0,1]=4 545 B13R2.449 CCOc1ccc2c(c1)CCC2 7a_100000209987_100000210202 [0,1,0,0,0,0|2,0,1]=4 546 B13R2.449 CCOc1ccc2c(c1)CCN2 34a_100020636429_100000210202 [0,1,0,0,0,0|1,0,2]=4 547 B13R2.449 CCOc1ccc2c(c1)CNC2 34a_100015195982_100000210202 [0,1,0,0,0,0|3,0,0]=4 548 B13R2.449 CCOc1ccc2c(c1)NCC2 34a_100020636427_100000210202 [0,1,0,0,0,0|1,0,1]=3 549 B13R2.449 CCOc1ccc2c(c1)OCO2 34a_100000210298_100000210202 [0,1,0,0,0,0|2,0,1]=4 550 B13R2.449 CCOc1ccc2cc[nH]c2c1 34a_100000036713_100000210202 [0,1,0,0,0,0|1,0,0]=2 551 B13R2.449 CCOc1ccc2ccoc2c1 34a_100000089557_100000210202 [0,1,0,0,0,0|2,0,0]=3 552 B13R2.449 CCOc1ccc2ccoc2c1 7a_100000089557_100000210202 [0,1,0,0,0,0|2,0,0]=3 553 B13R2.449 CCOc1ccc2cnoc2c1 34a_100000098417_100000210202 [0,1,0,0,0,0|3,0,0]=4 554 B13R2.449 CCOc1ccc2cnoc2c1 7a_100000098417_100000210202 [0,1,0,0,0,0|3,0,0]=4 555 B13R2.449 CCOc1ccc2ncsc2c1 34a_100011995850_100000210202 [0,1,0,0,0,0|1,0,0]=2 556 B13R2.449 CCOc1ccc2ncsc2c1 7a_100011995850_100000210202 [0,1,0,0,0,0|1,0,0]=2 557 B13R2.449 CCOc1ccc2nonc2c1 34a_100000036933_100000210202 [0,1,0,0,0,0|1,0,1]=3 558 B13R2.449 CCOc1ccc2occc2c1 34a_100000070125_100000210202 [0,1,0,0,0,0|2,0,0]=3 559 B13R2.449 CCOc1ccc2occc2c1 7a_100000070125_100000210202 [0,1,0,0,0,0|2,0,0]=3 560 B13R2.449 CCOc1ccc2sccc2c1 34a_100012180905_100000210202 [0,1,0,0,0,0|2,0,0]=3 561 B13R2.449 CCOc1ccc2sccc2c1 7a_100012180905_100000210202 [0,1,0,0,0,0|2,0,0]=3 562 B13R2.449 CCOc1ccc2scnc2c1 34a_200009850626_100000210202 [0,1,0,0,0,0|1,0,1]=3 563 B13R2.449 CCOc1ccc2scnc2c1 7a_200009850626_100000210202 [0,1,0,0,0,0|1,0,1]=3 564 B13R2.449 CCOc1ccn2ccnc2c1 34a_100009863278_100000210202 [0,1,0,0,0,0|2,0,1]=4 565 B13R2.449 CCOc1cnc2[nH]ccc2c1 34a_100000087691_100000210202 [0,1,0,0,0,0|2,0,1]=4 566 B13R2.449 CCSc1cc2[nH]ccc2cn1 62a_100000210202_100000089685 [0,1,0,0,0,0|2,1,0]=4 567 B13R2.449 CCSc1ccc2[nH]ccc2c1 62a_100000210202_100000035808 [0,1,0,0,0,0|1,1,1]=4 568 B13R2.449 CCSc1ccc2[nH]cnc2c1 62a_100000210202_100011265325 [0,1,0,0,0,0|0,1,2]=4 569 B13R2.449 CCSc1ccc2c(c1)C=CC2 62a_100000210202_100009814306 [0,1,0,0,0,0|2,1,0]=4 570 B13R2.449 CCSc1ccc2c(c1)C=CC2 62a_100009814306_100000210202 [0,1,0,0,0,0|2,1,0]=4 571 B13R2.449 CCSc1ccc2c(c1)CC=C2 62a_100000210202_200009818231 [0,1,0,0,0,0|2,1,0]=4 572 B13R2.449 CCSc1ccc2c(c1)CC=C2 62a_200009818231_100000210202 [0,1,0,0,0,0|2,1,0]=4 573 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000210202_100000754641 [0,1,0,0,0,0|1,1,1]=4 574 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000754641_100000210202 [0,1,0,0,0,0|1,1,1]=4 575 B13R2.449 CCSc1ccc2cc[nH]c2c1 62a_100000210202_100000743809 [0,1,0,0,0,0|1,1,0]=3 576 B13R2.449 CCSc1ccc2cc[nH]c2n1 62a_100000210202_100009814870 [0,1,0,0,0,0|2,1,0]=4 577 B13R2.449 CCSc1ccc2ccoc2c1 62a_100000210202_100000759542 [0,1,0,0,0,0|2,1,0]=4 578 B13R2.449 CCSc1ccc2ccsc2c1 62a_100000210202_100009888917 [0,1,0,0,0,0|2,1,0]=4 579 B13R2.449 CCSc1ccc2cn[nH]c2c1 62a_100000210202_100000049514 [0,1,0,0,0,0|2,1,0]=4 580 B13R2.449 CCSc1ccc2nc[nH]c2n1 62a_100000210202_100000077665 [0,1,0,0,0,0|1,1,0]=3 581 B13R2.449 CCSc1ccc2nc[nH]c2n1 62a_100009820032_100000210202 [0,1,0,0,0,0|1,1,0]=3 582 B13R2.449 CCSc1ccc2nccn2c1 62a_100000210202_100000746083 [0,1,0,0,0,0|2,1,0]=4 583 B13R2.449 CCSc1ccc2nccn2c1 62a_100000746083_100000210202 [0,1,0,0,0,0|2,1,0]=4 584 B13R2.449 CCSc1ccc2ncnn2c1 62a_100000210202_100009816971 [0,1,0,0,0,0|1,1,1]=4 585 B13R2.449 CCSc1ccc2ncnn2c1 62a_100009816971_100000210202 [0,1,0,0,0,0|1,1,1]=4 586 B13R2.449 CCSc1ccc2ncoc2c1 62a_100000210202_100009817590 [0,1,0,0,0,0|1,1,0]=3 587 B13R2.449 CCSc1ccc2ncsc2c1 62a_100000210202_100009816678 [0,1,0,0,0,0|1,1,0]=3 588 B13R2.449 CCSc1ccc2ncsc2c1 62a_100009816678_100000210202 [0,1,0,0,0,0|1,1,0]=3 589 B13R2.449 CCSc1ccc2ncsc2n1 62a_100000210202_100010381354 [0,1,0,0,0,0|2,1,0]=4 590 B13R2.449 CCSc1ccc2ncsc2n1 62a_100010090457_100000210202 [0,1,0,0,0,0|2,1,0]=4 591 B13R2.449 CCSc1ccc2nn[nH]c2c1 62a_100000210202_100009817464 [0,1,0,0,0,0|1,1,0]=3 592 B13R2.449 CCSc1ccc2nonc2c1 62a_100000210202_100009814275 [0,1,0,0,0,0|1,1,1]=4 593 B13R2.449 CCSc1ccc2nonc2c1 62a_100009814275_100000210202 [0,1,0,0,0,0|1,1,1]=4 594 B13R2.449 CCSc1ccc2nsnc2c1 62a_100000210202_100009814274 [0,1,0,0,0,0|1,1,1]=4 595 B13R2.449 CCSc1ccc2nsnc2c1 62a_100009814274_100000210202 [0,1,0,0,0,0|1,1,1]=4 596 B13R2.449 CCSc1ccc2occc2c1 62a_100000210202_100000691453 [0,1,0,0,0,0|2,1,0]=4 597 B13R2.449 CCSc1ccc2ocnc2c1 62a_100000210202_100009816175 [0,1,0,0,0,0|1,1,1]=4 598 B13R2.449 CCSc1ccc2sccc2c1 62a_100000210202_100009814439 [0,1,0,0,0,0|2,1,0]=4 599 B13R2.449 CCSc1ccc2scnc2c1 62a_100000210202_100010005895 [0,1,0,0,0,0|1,1,1]=4 600 B13R2.449 CCSc1ccn2nccc2c1 62a_100000210202_100000763084 [0,1,0,0,0,0|2,1,0]=4 601 B13R2.449 CCSc1ccn2ncnc2c1 62a_100000210202_100009819723 [0,1,0,0,0,0|1,1,1]=4 602 B13R2.449 CCSc1ccn2ncnc2c1 62a_100009819723_100000210202 [0,1,0,0,0,0|1,1,1]=4 603 B13R2.449 CCSc1cnc2cc[nH]c2c1 62a_100000210202_100009818992 [0,1,0,0,0,0|2,1,0]=4 604 B13R2.449 CCSc1cnc2nc[nH]c2c1 62a_100000210202_100000760087 [0,1,0,0,0,0|1,1,0]=3 605 B13R2.449 CCSc1cnc2ncoc2c1 62a_100000210202_100000721906 [0,1,0,0,0,0|2,1,0]=4 606 B13R2.449 CCSc1cnc2ncoc2c1 62a_100000721906_100000210202 [0,1,0,0,0,0|2,1,0]=4 607 B13R2.449 CCSc1ncc2nc[nH]c2n1 62a_100000210202_100000009038 [0,1,0,0,0,0|2,1,0]=4 608 B13R2.449 CNCc1ccc2[nH]ccc2c1 207a_100102657272_100011197475 [0,1,0,0,0,0|2,0,1]=4 609 B13R2.449 CNCc1ccc2[nH]ccc2c1 270004a_106832991635_100011197475 [0,1,0,0,0,0|2,0,1]=4 610 B13R2.449 CNCc1ccc2cc[nH]c2c1 207a_100102657272_100011218920 [0,1,0,0,0,0|2,0,0]=3 611 B13R2.449 CNCc1ccc2cc[nH]c2c1 270004a_106832991635_100011218920 [0,1,0,0,0,0|2,0,0]=3 612 B13R2.449 CNCc1ccc2cc[nH]c2n1 207a_100102657272_100000089654 [0,1,0,0,0,0|3,0,0]=4 613 B13R2.449 CNCc1ccc2cc[nH]c2n1 270004a_106832991635_100000089654 [0,1,0,0,0,0|3,0,0]=4 614 B13R2.449 CNCc1ccc2ccsc2c1 207a_100102657272_100000112508 [0,1,0,0,0,0|3,0,0]=4 615 B13R2.449 CNCc1ccc2ccsc2c1 270004a_106832991635_100000112508 [0,1,0,0,0,0|3,0,0]=4 616 B13R2.449 CNCc1ccc2cn[nH]c2c1 207a_100102657272_100137314666 [0,1,0,0,0,0|3,0,0]=4 617 B13R2.449 CNCc1ccc2cn[nH]c2c1 2230a_106832991635_100020605281 [0,1,0,0,0,0|3,0,0]=4 618 B13R2.449 CNCc1ccc2cn[nH]c2c1 26a_100102657272_100000061304 [0,1,0,0,0,0|3,0,0]=4 619 B13R2.449 CNCc1ccc2cn[nH]c2c1 270004a_106832991635_100137314666 [0,1,0,0,0,0|3,0,0]=4 620 B13R2.449 CNCc1ccc2cn[nH]c2c1 34a_100102657272_100020605281 [0,1,0,0,0,0|3,0,0]=4 621 B13R2.449 CNCc1ccc2cn[nH]c2c1 7a_106832991635_100020605281 [0,1,0,0,0,0|3,0,0]=4 622 B13R2.449 CNCc1ccc2n[nH]cc2c1 207a_100102657272_100000068381 [0,1,0,0,0,0|3,0,0]=4 623 B13R2.449 CNCc1ccc2n[nH]cc2c1 270004a_106832991635_100000068381 [0,1,0,0,0,0|3,0,0]=4 624 B13R2.449 CNCc1ccc2nc[nH]c2c1 207a_100102657272_100000059205 [0,1,0,0,0,0|1,0,0]=2 625 B13R2.449 CNCc1ccc2nc[nH]c2c1 270004a_106832991635_100000059205 [0,1,0,0,0,0|1,0,0]=2 626 B13R2.449 CNCc1ccc2nccn2c1 207a_100102657272_100000059712 [0,1,0,0,0,0|3,0,0]=4 627 B13R2.449 CNCc1ccc2nccn2c1 270004a_106832991635_100000059712 [0,1,0,0,0,0|3,0,0]=4 628 B13R2.449 CNCc1ccc2ncnn2c1 207a_100102657272_100000102685 [0,1,0,0,0,0|2,0,1]=4 629 B13R2.449 CNCc1ccc2ncnn2c1 270004a_106832991635_100000102685 [0,1,0,0,0,0|2,0,1]=4 630 B13R2.449 CNCc1ccc2ncoc2c1 207a_100102657272_100000059852 [0,1,0,0,0,0|2,0,0]=3 631 B13R2.449 CNCc1ccc2ncoc2c1 2230a_106832991635_106359897996 [0,1,0,0,0,0|2,0,0]=3 632 B13R2.449 CNCc1ccc2ncoc2c1 270004a_106832991635_100000059852 [0,1,0,0,0,0|2,0,0]=3 633 B13R2.449 CNCc1ccc2ncoc2c1 34a_100102657272_106359897996 [0,1,0,0,0,0|2,0,0]=3 634 B13R2.449 CNCc1ccc2ncoc2c1 7a_106832991635_106359897996 [0,1,0,0,0,0|2,0,0]=3 635 B13R2.449 CNCc1ccc2ncsc2c1 207a_100102657272_100009861089 [0,1,0,0,0,0|2,0,0]=3 636 B13R2.449 CNCc1ccc2ncsc2c1 2230a_106832991635_100009847474 [0,1,0,0,0,0|2,0,0]=3 637 B13R2.449 CNCc1ccc2ncsc2c1 270004a_106832991635_100009861089 [0,1,0,0,0,0|2,0,0]=3 638 B13R2.449 CNCc1ccc2ncsc2c1 34a_100102657272_100009847474 [0,1,0,0,0,0|2,0,0]=3 639 B13R2.449 CNCc1ccc2ncsc2c1 7a_106832991635_100009847474 [0,1,0,0,0,0|2,0,0]=3 640 B13R2.449 CNCc1ccc2nonc2c1 2230a_106832991635_100000733437 [0,1,0,0,0,0|2,0,1]=4 641 B13R2.449 CNCc1ccc2nonc2c1 270004a_106832991635_100000042170 [0,1,0,0,0,0|2,0,1]=4 642 B13R2.449 CNCc1ccc2nonc2c1 34a_100102657272_100000733437 [0,1,0,0,0,0|2,0,1]=4 643 B13R2.449 CNCc1ccc2nonc2c1 7a_106832991635_100000733437 [0,1,0,0,0,0|2,0,1]=4 644 B13R2.449 CNCc1ccc2nsnc2c1 207a_100102657272_100000042169 [0,1,0,0,0,0|2,0,1]=4 645 B13R2.449 CNCc1ccc2nsnc2c1 2230a_106832991635_100000187484 [0,1,0,0,0,0|2,0,1]=4 646 B13R2.449 CNCc1ccc2nsnc2c1 270004a_106832991635_100000042169 [0,1,0,0,0,0|2,0,1]=4 647 B13R2.449 CNCc1ccc2nsnc2c1 34a_100102657272_100000187484 [0,1,0,0,0,0|2,0,1]=4 648 B13R2.449 CNCc1ccc2nsnc2c1 7a_106832991635_100000187484 [0,1,0,0,0,0|2,0,1]=4 649 B13R2.449 CNCc1ccc2occc2c1 207a_100102657272_100000040644 [0,1,0,0,0,0|3,0,0]=4 650 B13R2.449 CNCc1ccc2occc2c1 2230a_100020591328_200000210301 [0,1,0,0,0,0|3,0,0]=4 651 B13R2.449 CNCc1ccc2occc2c1 26a_100102657272_100000070125 [0,1,0,0,0,0|3,0,0]=4 652 B13R2.449 CNCc1ccc2occc2c1 270004a_106832991635_100000040644 [0,1,0,0,0,0|3,0,0]=4 653 B13R2.449 CNCc1ccc2occc2c1 34a_100020591328_200000210301 [0,1,0,0,0,0|3,0,0]=4 654 B13R2.449 CNCc1ccc2ocnc2c1 207a_100102657272_100010271902 [0,1,0,0,0,0|2,0,1]=4 655 B13R2.449 CNCc1ccc2ocnc2c1 2230a_106832991635_200010203175 [0,1,0,0,0,0|2,0,1]=4 656 B13R2.449 CNCc1ccc2ocnc2c1 270004a_106832991635_100010271902 [0,1,0,0,0,0|2,0,1]=4 657 B13R2.449 CNCc1ccc2ocnc2c1 34a_100102657272_200010203175 [0,1,0,0,0,0|2,0,1]=4 658 B13R2.449 CNCc1ccc2ocnc2c1 7a_106832991635_200010203175 [0,1,0,0,0,0|2,0,1]=4 659 B13R2.449 CNCc1ccc2sccc2c1 207a_100102657272_100000050658 [0,1,0,0,0,0|3,0,0]=4 660 B13R2.449 CNCc1ccc2sccc2c1 2230a_100000732457_200000210301 [0,1,0,0,0,0|3,0,0]=4 661 B13R2.449 CNCc1ccc2sccc2c1 270004a_106832991635_100000050658 [0,1,0,0,0,0|3,0,0]=4 662 B13R2.449 CNCc1ccc2sccc2c1 34a_100000732457_200000210301 [0,1,0,0,0,0|3,0,0]=4 663 B13R2.449 CNCc1ccc2scnc2c1 207a_100102657272_100000718305 [0,1,0,0,0,0|2,0,1]=4 664 B13R2.449 CNCc1ccc2scnc2c1 270004a_106832991635_100000718305 [0,1,0,0,0,0|2,0,1]=4 665 B13R2.449 CNCc1ccn2nccc2c1 207a_100102657272_100009861398 [0,1,0,0,0,0|3,0,0]=4 666 B13R2.449 CNCc1ccn2nccc2c1 270004a_106832991635_100009861398 [0,1,0,0,0,0|3,0,0]=4 667 B13R2.449 CNCc1cnc2cc[nH]c2c1 207a_100102657272_100000094745 [0,1,0,0,0,0|3,0,0]=4 668 B13R2.449 CNCc1cnc2cc[nH]c2c1 270004a_106832991635_100000094745 [0,1,0,0,0,0|3,0,0]=4 669 B13R2.449 COCc1ccc2c(c1)CCC2 34a_200000765175_200000210301 [0,1,0,0,0,0|2,0,1]=4 670 B13R2.449 COCc1ccc2c(c1)CCC2 7a_200000765175_200000210301 [0,1,0,0,0,0|2,0,1]=4 671 B13R2.449 COCc1ccc2c(c1)CCO2 34a_100011219353_200000210301 [0,1,0,0,0,0|2,0,1]=4 672 B13R2.449 COCc1ccc2c(c1)CCO2 7a_100011219353_200000210301 [0,1,0,0,0,0|2,0,1]=4 673 B13R2.449 COCc1ccc2c(c1)NCC2 34a_100000694088_200000210301 [0,1,0,0,0,0|1,0,1]=3 674 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100000210967_200000210301 [0,1,0,0,0,0|2,0,1]=4 675 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100138415774_100000189651 [0,1,0,0,0,0|2,0,1]=4 676 B13R2.449 COCc1ccc2ccoc2c1 34a_200009859634_200000210301 [0,1,0,0,0,0|2,0,0]=3 677 B13R2.449 COCc1ccc2ccoc2c1 7a_200009859634_200000210301 [0,1,0,0,0,0|2,0,0]=3 678 B13R2.449 COCc1ccc2ccsc2c1 34a_100010262773_200000210301 [0,1,0,0,0,0|2,0,0]=3 679 B13R2.449 COCc1ccc2ccsc2c1 7a_100010262773_200000210301 [0,1,0,0,0,0|2,0,0]=3 680 B13R2.449 COCc1ccc2cn[nH]c2c1 34a_100138415774_100020605281 [0,1,0,0,0,0|2,0,0]=3 681 B13R2.449 COCc1ccc2ncoc2c1 34a_100138415774_106359897996 [0,1,0,0,0,0|1,0,0]=2 682 B13R2.449 COCc1ccc2ncsc2c1 34a_100138415774_100009847474 [0,1,0,0,0,0|1,0,0]=2 683 B13R2.449 COCc1ccc2nonc2c1 34a_100138415774_100000733437 [0,1,0,0,0,0|1,0,1]=3 684 B13R2.449 COCc1ccc2nsnc2c1 34a_100138415774_100000187484 [0,1,0,0,0,0|1,0,1]=3 685 B13R2.449 COCc1ccc2occc2c1 34a_100000067418_200000210301 [0,1,0,0,0,0|2,0,0]=3 686 B13R2.449 COCc1ccc2occc2c1 7a_100000067418_200000210301 [0,1,0,0,0,0|2,0,0]=3 687 B13R2.449 COCc1ccc2ocnc2c1 34a_100138415774_200010203175 [0,1,0,0,0,0|1,0,1]=3 688 B13R2.449 COCc1ccc2sccc2c1 34a_100000068000_200000210301 [0,1,0,0,0,0|2,0,0]=3 689 B13R2.449 COCc1ccc2sccc2c1 7a_100000068000_200000210301 [0,1,0,0,0,0|2,0,0]=3 690 B13R2.449 COCc1ccc2scnc2c1 34a_100009883289_200000210301 [0,1,0,0,0,0|1,0,1]=3 691 B13R2.449 CSCc1ccc2cn[nH]c2c1 62a_100020605281_200000210301 [0,1,0,0,0,0|2,1,0]=4 692 B13R2.449 CSCc1ccc2cn[nH]c2c1 62a_200000210301_100020605281 [0,1,0,0,0,0|2,1,0]=4 693 B13R2.449 CSCc1ccc2ncoc2c1 62a_106359897996_200000210301 [0,1,0,0,0,0|1,1,0]=3 694 B13R2.449 CSCc1ccc2ncoc2c1 62a_200000210301_106359897996 [0,1,0,0,0,0|1,1,0]=3 695 B13R2.449 CSCc1ccc2ncsc2c1 62a_100009847474_200000210301 [0,1,0,0,0,0|1,1,0]=3 696 B13R2.449 CSCc1ccc2ncsc2c1 62a_200000210301_100009847474 [0,1,0,0,0,0|1,1,0]=3 697 B13R2.449 CSCc1ccc2nonc2c1 62a_100000733437_200000210301 [0,1,0,0,0,0|1,1,1]=4 698 B13R2.449 CSCc1ccc2nonc2c1 62a_200000210301_100000733437 [0,1,0,0,0,0|1,1,1]=4 699 B13R2.449 CSCc1ccc2nsnc2c1 62a_100000187484_200000210301 [0,1,0,0,0,0|1,1,1]=4 700 B13R2.449 CSCc1ccc2nsnc2c1 62a_200000210301_100000187484 [0,1,0,0,0,0|1,1,1]=4 701 B13R2.449 CSCc1ccc2ocnc2c1 62a_200000210301_200010203175 [0,1,0,0,0,0|1,1,1]=4 702 B13R2.449 FCNc1ccc2ccoc2c1 34a_100000102395_100015361967 [0,1,0,0,0,0|3,0,0]=4 703 B13R2.449 FCNc1ccc2ncoc2c1 34a_100011248239_100015361967 [0,1,0,0,0,0|2,0,0]=3 704 B13R2.449 FCNc1ccc2ncsc2c1 34a_100011215093_100015361967 [0,1,0,0,0,0|2,0,0]=3 705 B13R2.449 FCNc1ccc2occc2c1 34a_106430523501_100015361967 [0,1,0,0,0,0|3,0,0]=4 706 B13R2.449 FCNc1ccc2ocnc2c1 34a_100011219863_100015361967 [0,1,0,0,0,0|2,0,1]=4 707 B13R2.449 FCNc1ccc2sccc2c1 34a_100000681076_100015361967 [0,1,0,0,0,0|3,0,0]=4 708 B13R2.449 FCNc1ccc2scnc2c1 34a_100000047738_100015361967 [0,1,0,0,0,0|2,0,1]=4 709 B13R2.449 FCOc1ccc2[nH]ccc2c1 34a_100000756620_100015361967 [0,1,0,0,0,0|1,0,1]=3 710 B13R2.449 FCOc1ccc2c(c1)CCC2 34a_100000209987_100015361967 [0,1,0,0,0,0|2,0,1]=4 711 B13R2.449 FCOc1ccc2c(c1)CCC2 7a_100000209987_100015361967 [0,1,0,0,0,0|2,0,1]=4 712 B13R2.449 FCOc1ccc2c(c1)CCN2 34a_100020636429_100015361967 [0,1,0,0,0,0|1,0,2]=4 713 B13R2.449 FCOc1ccc2c(c1)CNC2 34a_100015195982_100015361967 [0,1,0,0,0,0|3,0,0]=4 714 B13R2.449 FCOc1ccc2c(c1)NCC2 34a_100020636427_100015361967 [0,1,0,0,0,0|1,0,1]=3 715 B13R2.449 FCOc1ccc2c(c1)OCO2 34a_100000210298_100015361967 [0,1,0,0,0,0|2,0,1]=4 716 B13R2.449 FCOc1ccc2cc[nH]c2c1 34a_100000036713_100015361967 [0,1,0,0,0,0|1,0,0]=2 717 B13R2.449 FCOc1ccc2ccoc2c1 34a_100000089557_100015361967 [0,1,0,0,0,0|2,0,0]=3 718 B13R2.449 FCOc1ccc2ccoc2c1 7a_100000089557_100015361967 [0,1,0,0,0,0|2,0,0]=3 719 B13R2.449 FCOc1ccc2cnoc2c1 34a_100000098417_100015361967 [0,1,0,0,0,0|3,0,0]=4 720 B13R2.449 FCOc1ccc2cnoc2c1 7a_100000098417_100015361967 [0,1,0,0,0,0|3,0,0]=4 721 B13R2.449 FCOc1ccc2ncsc2c1 34a_100011995850_100015361967 [0,1,0,0,0,0|1,0,0]=2 722 B13R2.449 FCOc1ccc2ncsc2c1 7a_100011995850_100015361967 [0,1,0,0,0,0|1,0,0]=2 723 B13R2.449 FCOc1ccc2nonc2c1 34a_100000036933_100015361967 [0,1,0,0,0,0|1,0,1]=3 724 B13R2.449 FCOc1ccc2occc2c1 34a_100000070125_100015361967 [0,1,0,0,0,0|2,0,0]=3 725 B13R2.449 FCOc1ccc2occc2c1 7a_100000070125_100015361967 [0,1,0,0,0,0|2,0,0]=3 726 B13R2.449 FCOc1ccc2sccc2c1 34a_100012180905_100015361967 [0,1,0,0,0,0|2,0,0]=3 727 B13R2.449 FCOc1ccc2sccc2c1 7a_100012180905_100015361967 [0,1,0,0,0,0|2,0,0]=3 728 B13R2.449 FCOc1ccc2scnc2c1 34a_200009850626_100015361967 [0,1,0,0,0,0|1,0,1]=3 729 B13R2.449 FCOc1ccc2scnc2c1 7a_200009850626_100015361967 [0,1,0,0,0,0|1,0,1]=3 730 B13R2.449 FCOc1ccn2ccnc2c1 34a_100009863278_100015361967 [0,1,0,0,0,0|2,0,1]=4 731 B13R2.449 FCOc1cnc2[nH]ccc2c1 34a_100000087691_100015361967 [0,1,0,0,0,0|2,0,1]=4 732 B13R2.449 FCSc1cc2[nH]ccc2cn1 62a_100015361967_100000089685 [0,1,0,0,0,0|2,1,0]=4 733 B13R2.449 FCSc1ccc2[nH]ccc2c1 62a_100015361967_100000035808 [0,1,0,0,0,0|1,1,1]=4 734 B13R2.449 FCSc1ccc2[nH]cnc2c1 62a_100015361967_100011265325 [0,1,0,0,0,0|0,1,2]=4 735 B13R2.449 FCSc1ccc2c(c1)C=CC2 62a_100009814306_100015361967 [0,1,0,0,0,0|2,1,0]=4 736 B13R2.449 FCSc1ccc2c(c1)C=CC2 62a_100015361967_100009814306 [0,1,0,0,0,0|2,1,0]=4 737 B13R2.449 FCSc1ccc2c(c1)CC=C2 62a_100015361967_200009818231 [0,1,0,0,0,0|2,1,0]=4 738 B13R2.449 FCSc1ccc2c(c1)CC=C2 62a_200009818231_100015361967 [0,1,0,0,0,0|2,1,0]=4 739 B13R2.449 FCSc1ccc2c(c1)NCC2 62a_100000754641_100015361967 [0,1,0,0,0,0|1,1,1]=4 740 B13R2.449 FCSc1ccc2c(c1)NCC2 62a_100015361967_100000754641 [0,1,0,0,0,0|1,1,1]=4 741 B13R2.449 FCSc1ccc2cc[nH]c2c1 62a_100015361967_100000743809 [0,1,0,0,0,0|1,1,0]=3 742 B13R2.449 FCSc1ccc2cc[nH]c2n1 62a_100015361967_100009814870 [0,1,0,0,0,0|2,1,0]=4 743 B13R2.449 FCSc1ccc2ccoc2c1 62a_100015361967_100000759542 [0,1,0,0,0,0|2,1,0]=4 744 B13R2.449 FCSc1ccc2ccsc2c1 62a_100015361967_100009888917 [0,1,0,0,0,0|2,1,0]=4 745 B13R2.449 FCSc1ccc2cn[nH]c2c1 62a_100015361967_100000049514 [0,1,0,0,0,0|2,1,0]=4 746 B13R2.449 FCSc1ccc2nc[nH]c2n1 62a_100009820032_100015361967 [0,1,0,0,0,0|1,1,0]=3 747 B13R2.449 FCSc1ccc2nc[nH]c2n1 62a_100015361967_100000077665 [0,1,0,0,0,0|1,1,0]=3 748 B13R2.449 FCSc1ccc2nccn2c1 62a_100000746083_100015361967 [0,1,0,0,0,0|2,1,0]=4 749 B13R2.449 FCSc1ccc2nccn2c1 62a_100015361967_100000746083 [0,1,0,0,0,0|2,1,0]=4 750 B13R2.449 FCSc1ccc2ncnn2c1 62a_100009816971_100015361967 [0,1,0,0,0,0|1,1,1]=4 751 B13R2.449 FCSc1ccc2ncnn2c1 62a_100015361967_100009816971 [0,1,0,0,0,0|1,1,1]=4 752 B13R2.449 FCSc1ccc2ncoc2c1 62a_100015361967_100009817590 [0,1,0,0,0,0|1,1,0]=3 753 B13R2.449 FCSc1ccc2ncsc2c1 62a_100009816678_100015361967 [0,1,0,0,0,0|1,1,0]=3 754 B13R2.449 FCSc1ccc2ncsc2c1 62a_100015361967_100009816678 [0,1,0,0,0,0|1,1,0]=3 755 B13R2.449 FCSc1ccc2ncsc2n1 62a_100010090457_100015361967 [0,1,0,0,0,0|2,1,0]=4 756 B13R2.449 FCSc1ccc2ncsc2n1 62a_100015361967_100010381354 [0,1,0,0,0,0|2,1,0]=4 757 B13R2.449 FCSc1ccc2nn[nH]c2c1 62a_100015361967_100009817464 [0,1,0,0,0,0|1,1,0]=3 758 B13R2.449 FCSc1ccc2nonc2c1 62a_100009814275_100015361967 [0,1,0,0,0,0|1,1,1]=4 759 B13R2.449 FCSc1ccc2nonc2c1 62a_100015361967_100009814275 [0,1,0,0,0,0|1,1,1]=4 760 B13R2.449 FCSc1ccc2nsnc2c1 62a_100009814274_100015361967 [0,1,0,0,0,0|1,1,1]=4 761 B13R2.449 FCSc1ccc2nsnc2c1 62a_100015361967_100009814274 [0,1,0,0,0,0|1,1,1]=4 762 B13R2.449 FCSc1ccc2occc2c1 62a_100015361967_100000691453 [0,1,0,0,0,0|2,1,0]=4 763 B13R2.449 FCSc1ccc2ocnc2c1 62a_100015361967_100009816175 [0,1,0,0,0,0|1,1,1]=4 764 B13R2.449 FCSc1ccc2sccc2c1 62a_100015361967_100009814439 [0,1,0,0,0,0|2,1,0]=4 765 B13R2.449 FCSc1ccc2scnc2c1 62a_100015361967_100010005895 [0,1,0,0,0,0|1,1,1]=4 766 B13R2.449 FCSc1ccn2nccc2c1 62a_100015361967_100000763084 [0,1,0,0,0,0|2,1,0]=4 767 B13R2.449 FCSc1ccn2ncnc2c1 62a_100009819723_100015361967 [0,1,0,0,0,0|1,1,1]=4 768 B13R2.449 FCSc1ccn2ncnc2c1 62a_100015361967_100009819723 [0,1,0,0,0,0|1,1,1]=4 769 B13R2.449 FCSc1cnc2cc[nH]c2c1 62a_100015361967_100009818992 [0,1,0,0,0,0|2,1,0]=4 770 B13R2.449 FCSc1cnc2nc[nH]c2c1 62a_100015361967_100000760087 [0,1,0,0,0,0|1,1,0]=3 771 B13R2.449 FCSc1cnc2ncoc2c1 62a_100000721906_100015361967 [0,1,0,0,0,0|2,1,0]=4 772 B13R2.449 FCSc1cnc2ncoc2c1 62a_100015361967_100000721906 [0,1,0,0,0,0|2,1,0]=4 773 B13R2.449 FCSc1ncc2nc[nH]c2n1 62a_100015361967_100000009038 [0,1,0,0,0,0|2,1,0]=4 774 B13R2.449 [13CH3]NCc1ccc2occc2c1 2230a_100020591328_200025704644 [0,1,0,0,0,0|3,0,0]=4 775 B13R2.449 [13CH3]NCc1ccc2occc2c1 34a_100020591328_200025704644 [0,1,0,0,0,0|3,0,0]=4 776 B13R2.449 [13CH3]NCc1ccc2sccc2c1 2230a_100000732457_200025704644 [0,1,0,0,0,0|3,0,0]=4 777 B13R2.449 [13CH3]NCc1ccc2sccc2c1 34a_100000732457_200025704644 [0,1,0,0,0,0|3,0,0]=4 778 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 34a_200000765175_200025704644 [0,1,0,0,0,0|2,0,1]=4 779 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 7a_200000765175_200025704644 [0,1,0,0,0,0|2,0,1]=4 780 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 34a_100011219353_200025704644 [0,1,0,0,0,0|2,0,1]=4 781 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 7a_100011219353_200025704644 [0,1,0,0,0,0|2,0,1]=4 782 B13R2.449 [13CH3]OCc1ccc2c(c1)NCC2 34a_100000694088_200025704644 [0,1,0,0,0,0|1,0,1]=3 783 B13R2.449 [13CH3]OCc1ccc2c(c1)OCO2 34a_100000210967_200025704644 [0,1,0,0,0,0|2,0,1]=4 784 B13R2.449 [13CH3]OCc1ccc2ccoc2c1 34a_200009859634_200025704644 [0,1,0,0,0,0|2,0,0]=3 785 B13R2.449 [13CH3]OCc1ccc2ccoc2c1 7a_200009859634_200025704644 [0,1,0,0,0,0|2,0,0]=3 786 B13R2.449 [13CH3]OCc1ccc2ccsc2c1 34a_100010262773_200025704644 [0,1,0,0,0,0|2,0,0]=3 787 B13R2.449 [13CH3]OCc1ccc2ccsc2c1 7a_100010262773_200025704644 [0,1,0,0,0,0|2,0,0]=3 788 B13R2.449 [13CH3]OCc1ccc2occc2c1 34a_100000067418_200025704644 [0,1,0,0,0,0|2,0,0]=3 789 B13R2.449 [13CH3]OCc1ccc2occc2c1 7a_100000067418_200025704644 [0,1,0,0,0,0|2,0,0]=3 790 B13R2.449 [13CH3]OCc1ccc2sccc2c1 34a_100000068000_200025704644 [0,1,0,0,0,0|2,0,0]=3 791 B13R2.449 [13CH3]OCc1ccc2sccc2c1 7a_100000068000_200025704644 [0,1,0,0,0,0|2,0,0]=3 792 B13R2.449 [13CH3]OCc1ccc2scnc2c1 34a_100009883289_200025704644 [0,1,0,0,0,0|1,0,1]=3 793 B13R2.449 [13CH3]SCc1ccc2cn[nH]c2c1 62a_100020605281_200025704644 [0,1,0,0,0,0|2,1,0]=4 794 B13R2.449 [13CH3]SCc1ccc2cn[nH]c2c1 62a_200025704644_100020605281 [0,1,0,0,0,0|2,1,0]=4 795 B13R2.449 [13CH3]SCc1ccc2ncoc2c1 62a_106359897996_200025704644 [0,1,0,0,0,0|1,1,0]=3 796 B13R2.449 [13CH3]SCc1ccc2ncoc2c1 62a_200025704644_106359897996 [0,1,0,0,0,0|1,1,0]=3 797 B13R2.449 [13CH3]SCc1ccc2ncsc2c1 62a_100009847474_200025704644 [0,1,0,0,0,0|1,1,0]=3 798 B13R2.449 [13CH3]SCc1ccc2ncsc2c1 62a_200025704644_100009847474 [0,1,0,0,0,0|1,1,0]=3 799 B13R2.449 [13CH3]SCc1ccc2nonc2c1 62a_100000733437_200025704644 [0,1,0,0,0,0|1,1,1]=4 800 B13R2.449 [13CH3]SCc1ccc2nonc2c1 62a_200025704644_100000733437 [0,1,0,0,0,0|1,1,1]=4 801 B13R2.449 [13CH3]SCc1ccc2nsnc2c1 62a_100000187484_200025704644 [0,1,0,0,0,0|1,1,1]=4 802 B13R2.449 [13CH3]SCc1ccc2nsnc2c1 62a_200025704644_100000187484 [0,1,0,0,0,0|1,1,1]=4 803 B13R2.449 [13CH3]SCc1ccc2ocnc2c1 62a_200025704644_200010203175 [0,1,0,0,0,0|1,1,1]=4 804 B13R2.599 C=Cc1cc2[nH]ccc2cc1Br 271570a_100011290941_100000703010 [0,1,0,0,0,0|2,0,1]=4 805 B13R2.599 C=Cc1cc2[nH]ccc2cc1C 271570a_100011290941_100010199660 [0,1,0,0,0,0|2,0,1]=4 806 B13R2.599 C=Cc1cc2[nH]ccc2cc1F 271570a_100011290941_100009817181 [0,1,0,0,0,0|2,0,1]=4 807 B13R2.599 C=Cc1cc2[nH]cnc2cc1C 271570a_100011290941_200010107306 [0,1,0,0,0,0|1,0,1]=3 808 B13R2.599 C=Cc1cc2[nH]nnc2cc1C 271570a_100011290941_100010721108 [0,1,0,0,0,0|2,0,1]=4 809 B13R2.599 C=Cc1cc2[nH]nnc2cc1F 271570a_100011290941_100010075030 [0,1,0,0,0,0|2,0,1]=4 810 B13R2.599 COc1cc2[nH]ccc2cc1O 271570a_203496583355_100010245498 [0,1,0,0,0,0|1,0,0]=2 811 B13R2.599 COc1cc2[nH]cnc2cc1O 271570a_203496583355_100010062394 [0,1,0,0,0,0|0,0,0]=1 812 B13R2.599 COc1cc2c(cc1Br)CCC2 34a_200010659162_200000210301 [0,1,0,0,0,0|2,0,1]=4 813 B13R2.599 COc1cc2c(cc1Br)CCC2 7a_200010659162_200000210301 [0,1,0,0,0,0|2,0,1]=4 814 B13R2.599 COc1cc2c(cc1Br)OCO2 34a_100010290809_200000210301 [0,1,0,0,0,0|2,0,1]=4 815 B13R2.599 COc1cc2c(cc1Br)OCO2 7a_100010290809_200000210301 [0,1,0,0,0,0|2,0,1]=4 816 B13R2.599 COc1cc2c(cc1C)OCO2 34a_100000145572_200000210301 [0,1,0,0,0,0|2,0,1]=4 817 B13R2.599 COc1cc2c(cc1C)OCO2 7a_100000145572_200000210301 [0,1,0,0,0,0|2,0,1]=4 818 B13R2.599 COc1cc2c(cc1F)CCC2 34a_200000146645_200000210301 [0,1,0,0,0,0|2,0,1]=4 819 B13R2.599 COc1cc2c(cc1F)CCC2 7a_200000146645_200000210301 [0,1,0,0,0,0|2,0,1]=4 820 B13R2.599 COc1cc2cc[nH]c2cc1O 271570a_203496583355_100010245486 [0,1,0,0,0,0|1,0,1]=3 821 B13R2.599 COc1cc2cn[nH]c2cc1O 271570a_203496583355_100010074698 [0,1,0,0,0,0|2,0,1]=4 822 B13R2.599 COc1cc2n[nH]cc2cc1O 271570a_203496583355_100020876381 [0,1,0,0,0,0|2,0,1]=4 823 B13R2.599 COc1nc2[nH]ccc2cc1O 271570a_203496583355_100010168744 [0,1,0,0,0,0|2,0,0]=3 824 B13R2.599 CSc1cc2[nH]ccc2cc1Br 62a_100000703010_200000210301 [0,1,0,0,0,0|1,1,0]=3 825 B13R2.599 CSc1cc2[nH]ccc2cc1Br 62a_200000210301_100000703010 [0,1,0,0,0,0|1,1,0]=3 826 B13R2.599 CSc1cc2[nH]ccc2cc1C 62a_200000210301_100010199660 [0,1,0,0,0,0|1,1,0]=3 827 B13R2.599 CSc1cc2[nH]ccc2cc1F 62a_100009817181_200000210301 [0,1,0,0,0,0|1,1,0]=3 828 B13R2.599 CSc1cc2[nH]ccc2cc1F 62a_200000210301_100009817181 [0,1,0,0,0,0|1,1,0]=3 829 B13R2.599 CSc1cc2[nH]cnc2cc1C 62a_200000210301_200010107306 [0,1,0,0,0,0|0,1,0]=2 830 B13R2.599 CSc1cc2[nH]ncc2cc1C 62a_200000210301_100009816928 [0,1,0,0,0,0|2,1,0]=4 831 B13R2.599 CSc1cc2[nH]ncc2cc1F 62a_100010131892_200000210301 [0,1,0,0,0,0|2,1,0]=4 832 B13R2.599 CSc1cc2[nH]ncc2cc1F 62a_200000210301_100010131892 [0,1,0,0,0,0|2,1,0]=4 833 B13R2.599 CSc1cc2[nH]ncc2cc1N 62a_100011012411_200000210301 [0,1,0,0,0,0|2,1,0]=4 834 B13R2.599 CSc1cc2[nH]ncc2cc1N 62a_200000210301_100011012411 [0,1,0,0,0,0|2,1,0]=4 835 B13R2.599 CSc1cc2[nH]ncc2cc1O 62a_200000210301_100010080172 [0,1,0,0,0,0|2,1,0]=4 836 B13R2.599 CSc1cc2[nH]nnc2cc1C 62a_200000210301_100010721108 [0,1,0,0,0,0|1,1,0]=3 837 B13R2.599 CSc1cc2[nH]nnc2cc1F 62a_100010075030_200000210301 [0,1,0,0,0,0|1,1,0]=3 838 B13R2.599 CSc1cc2[nH]nnc2cc1F 62a_200000210301_100010075030 [0,1,0,0,0,0|1,1,0]=3 839 B13R2.599 CSc1cc2c[nH]nc2cc1F 62a_100020825709_200000210301 [0,1,0,0,0,0|2,1,0]=4 840 B13R2.599 CSc1cc2cc[nH]c2cc1C 62a_200000210301_100010199648 [0,1,0,0,0,0|1,1,1]=4 841 B13R2.599 CSc1cc2cc[nH]c2cc1F 62a_100000731065_200000210301 [0,1,0,0,0,0|1,1,1]=4 842 B13R2.599 CSc1cc2cc[nH]c2cc1F 62a_200000210301_100000731065 [0,1,0,0,0,0|1,1,1]=4 843 B13R2.599 CSc1cc2cc[nH]c2cc1N 62a_100010212544_200000210301 [0,1,0,0,0,0|1,1,1]=4 844 B13R2.599 CSc1cc2cc[nH]c2cc1N 62a_200000210301_100010212544 [0,1,0,0,0,0|1,1,1]=4 845 B13R2.599 CSc1cc2nc[nH]c2cc1F 62a_100012361300_200000210301 [0,1,0,0,0,0|0,1,2]=4 846 B13R2.599 CSc1cc2nc[nH]c2cc1F 62a_200000210301_100012361300 [0,1,0,0,0,0|0,1,2]=4 847 B13R2.599 CSc1cc2nc[nH]c2cc1N 62a_200000210301_200010336578 [0,1,0,0,0,0|0,1,2]=4 848 B13R2.599 CSc1cc2nc[nH]c2cc1N 62a_200010336578_200000210301 [0,1,0,0,0,0|0,1,2]=4 849 B13R2.599 CSc1cc2sccc2cc1C 62a_100010762285_200000210301 [0,1,0,0,0,0|2,1,0]=4 850 B13R2.599 CSc1cc2sccc2cc1C 62a_200000210301_100010762285 [0,1,0,0,0,0|2,1,0]=4 851 B13R2.599 CSc1cn2ccnc2cc1C 62a_100020606757_200000210301 [0,1,0,0,0,0|2,1,0]=4 852 B13R2.599 CSc1cn2ccnc2cc1C 62a_200000210301_100020606757 [0,1,0,0,0,0|2,1,0]=4 853 B13R2.599 CSc1cn2ncnc2cc1C 62a_100010254783_200000210301 [0,1,0,0,0,0|1,1,1]=4 854 B13R2.599 CSc1cn2ncnc2cc1C 62a_200000210301_100010254783 [0,1,0,0,0,0|1,1,1]=4 855 B13R2.599 Cc1cc2[nH]ccc2cc1S[13CH3] 62a_200025704644_100010199648 [0,1,0,0,0,0|1,1,1]=4 856 B13R2.599 Cc1cc2c(cc1O[13CH3])OCO2 34a_100000145572_200025704644 [0,1,0,0,0,0|2,0,1]=4 857 B13R2.599 Cc1cc2c(cc1O[13CH3])OCO2 7a_100000145572_200025704644 [0,1,0,0,0,0|2,0,1]=4 858 B13R2.599 Cc1cc2cc[nH]c2cc1S[13CH3] 62a_200025704644_100010199660 [0,1,0,0,0,0|1,1,0]=3 859 B13R2.599 Cc1cc2ccsc2cc1S[13CH3] 62a_100010762285_200025704644 [0,1,0,0,0,0|2,1,0]=4 860 B13R2.599 Cc1cc2ccsc2cc1S[13CH3] 62a_200025704644_100010762285 [0,1,0,0,0,0|2,1,0]=4 861 B13R2.599 Cc1cc2cn[nH]c2cc1S[13CH3] 62a_200025704644_100009816928 [0,1,0,0,0,0|2,1,0]=4 862 B13R2.599 Cc1cc2nc[nH]c2cc1S[13CH3] 62a_200025704644_200010107306 [0,1,0,0,0,0|0,1,0]=2 863 B13R2.599 Cc1cc2nccn2cc1S[13CH3] 62a_100020606757_200025704644 [0,1,0,0,0,0|2,1,0]=4 864 B13R2.599 Cc1cc2nccn2cc1S[13CH3] 62a_200025704644_100020606757 [0,1,0,0,0,0|2,1,0]=4 865 B13R2.599 Cc1cc2ncnn2cc1S[13CH3] 62a_100010254783_200025704644 [0,1,0,0,0,0|1,1,1]=4 866 B13R2.599 Cc1cc2ncnn2cc1S[13CH3] 62a_200025704644_100010254783 [0,1,0,0,0,0|1,1,1]=4 867 B13R2.599 Cc1cc2nn[nH]c2cc1S[13CH3] 62a_200025704644_100010721108 [0,1,0,0,0,0|1,1,0]=3 868 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 34a_200010659162_200025704644 [0,1,0,0,0,0|2,0,1]=4 869 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 7a_200010659162_200025704644 [0,1,0,0,0,0|2,0,1]=4 870 B13R2.599 [13CH3]Oc1cc2c(cc1Br)OCO2 34a_100010290809_200025704644 [0,1,0,0,0,0|2,0,1]=4 871 B13R2.599 [13CH3]Oc1cc2c(cc1Br)OCO2 7a_100010290809_200025704644 [0,1,0,0,0,0|2,0,1]=4 872 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 34a_200000146645_200025704644 [0,1,0,0,0,0|2,0,1]=4 873 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 7a_200000146645_200025704644 [0,1,0,0,0,0|2,0,1]=4 874 B13R2.599 [13CH3]Sc1cc2[nH]ccc2cc1Br 62a_100000703010_200025704644 [0,1,0,0,0,0|1,1,0]=3 875 B13R2.599 [13CH3]Sc1cc2[nH]ccc2cc1Br 62a_200025704644_100000703010 [0,1,0,0,0,0|1,1,0]=3 876 B13R2.599 [13CH3]Sc1cc2[nH]ccc2cc1F 62a_100009817181_200025704644 [0,1,0,0,0,0|1,1,0]=3 877 B13R2.599 [13CH3]Sc1cc2[nH]ccc2cc1F 62a_200025704644_100009817181 [0,1,0,0,0,0|1,1,0]=3 878 B13R2.599 [13CH3]Sc1cc2[nH]ncc2cc1F 62a_100010131892_200025704644 [0,1,0,0,0,0|2,1,0]=4 879 B13R2.599 [13CH3]Sc1cc2[nH]ncc2cc1F 62a_200025704644_100010131892 [0,1,0,0,0,0|2,1,0]=4 880 B13R2.599 [13CH3]Sc1cc2[nH]ncc2cc1N 62a_100011012411_200025704644 [0,1,0,0,0,0|2,1,0]=4 881 B13R2.599 [13CH3]Sc1cc2[nH]ncc2cc1N 62a_200025704644_100011012411 [0,1,0,0,0,0|2,1,0]=4 882 B13R2.599 [13CH3]Sc1cc2[nH]ncc2cc1O 62a_200025704644_100010080172 [0,1,0,0,0,0|2,1,0]=4 883 B13R2.599 [13CH3]Sc1cc2[nH]nnc2cc1F 62a_100010075030_200025704644 [0,1,0,0,0,0|1,1,0]=3 884 B13R2.599 [13CH3]Sc1cc2[nH]nnc2cc1F 62a_200025704644_100010075030 [0,1,0,0,0,0|1,1,0]=3 885 B13R2.599 [13CH3]Sc1cc2c[nH]nc2cc1F 62a_100020825709_200025704644 [0,1,0,0,0,0|2,1,0]=4 886 B13R2.599 [13CH3]Sc1cc2cc[nH]c2cc1F 62a_100000731065_200025704644 [0,1,0,0,0,0|1,1,1]=4 887 B13R2.599 [13CH3]Sc1cc2cc[nH]c2cc1F 62a_200025704644_100000731065 [0,1,0,0,0,0|1,1,1]=4 888 B13R2.599 [13CH3]Sc1cc2cc[nH]c2cc1N 62a_100010212544_200025704644 [0,1,0,0,0,0|1,1,1]=4 889 B13R2.599 [13CH3]Sc1cc2cc[nH]c2cc1N 62a_200025704644_100010212544 [0,1,0,0,0,0|1,1,1]=4 890 B13R2.599 [13CH3]Sc1cc2nc[nH]c2cc1F 62a_100012361300_200025704644 [0,1,0,0,0,0|0,1,2]=4 891 B13R2.599 [13CH3]Sc1cc2nc[nH]c2cc1F 62a_200025704644_100012361300 [0,1,0,0,0,0|0,1,2]=4 892 B13R2.599 [13CH3]Sc1cc2nc[nH]c2cc1N 62a_200010336578_200025704644 [0,1,0,0,0,0|0,1,2]=4 893 B13R2.599 [13CH3]Sc1cc2nc[nH]c2cc1N 62a_200025704644_200010336578 [0,1,0,0,0,0|0,1,2]=4 894 B13R2.654 C=Cc1cc(c2cc[nH]c2c1)Br 271570a_100011290941_100009814775 [0,1,0,0,0,0|2,0,1]=4 895 B13R2.654 C=Cc1cc(c2cc[nH]c2c1)F 271570a_100011290941_100010186028 [0,1,0,0,0,0|2,0,1]=4 896 B13R2.654 C=Cc1cc(c2cc[nH]c2c1)N 271570a_100011290941_106744500199 [0,1,0,0,0,0|2,0,1]=4 897 B13R2.654 C=Cc1cc(c2nc[nH]c2c1)C 271570a_100011290941_100000239325 [0,1,0,0,0,0|1,0,1]=3 898 B13R2.654 CNc1cc(c2cc[nH]c2c1)F 34a_100000085187_200000210301 [0,1,0,0,0,0|2,0,0]=3 899 B13R2.654 CNc1nc(c2nc[nH]c2n1)C 27a_100102657272_100000093496 [0,1,0,0,0,0|3,0,0]=4 900 B13R2.654 CNc1nc(c2nc[nH]c2n1)N 27a_100102657272_100102524922 [0,1,0,0,0,0|3,0,0]=4 901 B13R2.654 COc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100010292072 [0,1,0,0,0,0|2,0,1]=4 902 B13R2.654 COc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006585 [0,1,0,0,0,0|1,0,0]=2 903 B13R2.654 COc1cc(c2ccnn2c1)O 271570a_203496583355_100010739841 [0,1,0,0,0,0|2,0,1]=4 904 B13R2.654 COc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010188275 [0,1,0,0,0,0|2,0,0]=3 905 B13R2.654 COc1cc(c2nc[nH]c2c1)O 271570a_203496583355_100102526192 [0,1,0,0,0,0|0,0,0]=1 906 B13R2.654 COc1cc(c2ncsc2c1)C 34a_200009842467_200000210301 [0,1,0,0,0,0|1,0,0]=2 907 B13R2.654 COc1cc(c2ncsc2c1)C 7a_200009842467_200000210301 [0,1,0,0,0,0|1,0,0]=2 908 B13R2.654 COc1cc(c2occc2c1)Br 34a_200010248604_200000210301 [0,1,0,0,0,0|2,0,0]=3 909 B13R2.654 COc1cc(c2occc2c1)Br 7a_200010248604_200000210301 [0,1,0,0,0,0|2,0,0]=3 910 B13R2.654 CSc1cc(c2[nH]ccc2c1)C 62a_200000210301_100009817142 [0,1,0,0,0,0|1,1,1]=4 911 B13R2.654 CSc1cc(c2[nH]ccc2c1)F 62a_200000210301_100010138380 [0,1,0,0,0,0|1,1,1]=4 912 B13R2.654 CSc1cc(c2[nH]ccc2c1)N 62a_200000210301_100009813507 [0,1,0,0,0,0|1,1,1]=4 913 B13R2.654 CSc1cc(c2cc[nH]c2c1)Br 62a_100009814775_200000210301 [0,1,0,0,0,0|1,1,0]=3 914 B13R2.654 CSc1cc(c2cc[nH]c2c1)Br 62a_200000210301_100009814775 [0,1,0,0,0,0|1,1,0]=3 915 B13R2.654 CSc1cc(c2cc[nH]c2c1)F 62a_100010186028_200000210301 [0,1,0,0,0,0|1,1,0]=3 916 B13R2.654 CSc1cc(c2cc[nH]c2c1)F 62a_200000210301_100010186028 [0,1,0,0,0,0|1,1,0]=3 917 B13R2.654 CSc1cc(c2cc[nH]c2c1)N 62a_200000210301_106744500199 [0,1,0,0,0,0|1,1,0]=3 918 B13R2.654 CSc1cc(c2cn[nH]c2c1)Br 62a_100009814768_200000210301 [0,1,0,0,0,0|2,1,0]=4 919 B13R2.654 CSc1cc(c2cn[nH]c2c1)Br 62a_200000210301_100009814768 [0,1,0,0,0,0|2,1,0]=4 920 B13R2.654 CSc1cc(c2cn[nH]c2c1)C 62a_200000210301_100009816875 [0,1,0,0,0,0|2,1,0]=4 921 B13R2.654 CSc1cc(c2cn[nH]c2c1)Cl 62a_200000210301_100000050090 [0,1,0,0,0,0|2,1,0]=4 922 B13R2.654 CSc1cc(c2cn[nH]c2c1)F 62a_200000210301_100010185991 [0,1,0,0,0,0|2,1,0]=4 923 B13R2.654 CSc1cc(c2cn[nH]c2c1)N 62a_200000210301_100010177796 [0,1,0,0,0,0|2,1,0]=4 924 B13R2.654 CSc1cc(c2cn[nH]c2c1)O 62a_200000210301_100010185960 [0,1,0,0,0,0|2,1,0]=4 925 B13R2.654 CSc1cc(c2nc[nH]c2c1)C 62a_200000210301_100000239325 [0,1,0,0,0,0|0,1,0]=2 926 B13R2.654 CSc1cc(c2nccn2c1)C 62a_200000210301_100000701042 [0,1,0,0,0,0|2,1,0]=4 927 B13R2.654 CSc1cc(c2nccn2c1)F 62a_100010174814_200000210301 [0,1,0,0,0,0|2,1,0]=4 928 B13R2.654 CSc1cc(c2nccn2c1)F 62a_200000210301_100010174814 [0,1,0,0,0,0|2,1,0]=4 929 B13R2.654 CSc1cc(c2nccn2c1)N 62a_200000210301_100009816852 [0,1,0,0,0,0|2,1,0]=4 930 B13R2.654 CSc1cc(c2nccn2c1)O 62a_200000210301_100010074634 [0,1,0,0,0,0|2,1,0]=4 931 B13R2.654 CSc1cc(c2ncnn2c1)C 62a_200000210301_100010201170 [0,1,0,0,0,0|1,1,1]=4 932 B13R2.654 CSc1cc(c2ncnn2c1)F 62a_100015548010_200000210301 [0,1,0,0,0,0|1,1,1]=4 933 B13R2.654 CSc1cc(c2ncnn2c1)F 62a_200000210301_100015548010 [0,1,0,0,0,0|1,1,1]=4 934 B13R2.654 CSc1cc(c2occc2c1)C 62a_200000210301_100012361858 [0,1,0,0,0,0|2,1,0]=4 935 B13R2.654 CSc1cc(c2occc2c1)F 62a_200000210301_100012355474 [0,1,0,0,0,0|2,1,0]=4 936 B13R2.654 CSc1nc(c2nc[nH]c2n1)C 62a_200000210301_100000093496 [0,1,0,0,0,0|2,1,0]=4 937 B13R2.654 Cc1cc(cc2c1[nH]cc2)S[13CH3] 62a_200025704644_100009817142 [0,1,0,0,0,0|1,1,1]=4 938 B13R2.654 Cc1cc(cc2c1cn[nH]2)S[13CH3] 62a_200025704644_100009816875 [0,1,0,0,0,0|2,1,0]=4 939 B13R2.654 Cc1cc(cc2c1nc[nH]2)S[13CH3] 62a_200025704644_100000239325 [0,1,0,0,0,0|0,1,0]=2 940 B13R2.654 Cc1cc(cc2c1ncs2)O[13CH3] 34a_200009842467_200025704644 [0,1,0,0,0,0|1,0,0]=2 941 B13R2.654 Cc1cc(cc2c1ncs2)O[13CH3] 7a_200009842467_200025704644 [0,1,0,0,0,0|1,0,0]=2 942 B13R2.654 Cc1cc(cc2c1occ2)S[13CH3] 62a_200025704644_100012361858 [0,1,0,0,0,0|2,1,0]=4 943 B13R2.654 Cc1cc(cn2c1ncc2)S[13CH3] 62a_200025704644_100000701042 [0,1,0,0,0,0|2,1,0]=4 944 B13R2.654 Cc1cc(cn2c1ncn2)S[13CH3] 62a_200025704644_100010201170 [0,1,0,0,0,0|1,1,1]=4 945 B13R2.654 Cc1nc(nc2c1nc[nH]2)S[13CH3] 62a_200025704644_100000093496 [0,1,0,0,0,0|2,1,0]=4 946 B13R2.654 N#Cc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100000694428 [0,1,0,0,0,0|3,0,0]=4 947 B13R2.654 N#Cc1cc(c2nc[nH]c2c1)O 271570a_203496583355_100010718406 [0,1,0,0,0,0|2,0,0]=3 948 B13R2.654 [13CH3]Nc1cc(c2cc[nH]c2c1)F 34a_100000085187_200025704644 [0,1,0,0,0,0|2,0,0]=3 949 B13R2.654 [13CH3]Oc1cc(c2occc2c1)Br 34a_200010248604_200025704644 [0,1,0,0,0,0|2,0,0]=3 950 B13R2.654 [13CH3]Oc1cc(c2occc2c1)Br 7a_200010248604_200025704644 [0,1,0,0,0,0|2,0,0]=3 951 B13R2.654 [13CH3]Sc1cc(c2[nH]ccc2c1)F 62a_200025704644_100010138380 [0,1,0,0,0,0|1,1,1]=4 952 B13R2.654 [13CH3]Sc1cc(c2[nH]ccc2c1)N 62a_200025704644_100009813507 [0,1,0,0,0,0|1,1,1]=4 953 B13R2.654 [13CH3]Sc1cc(c2cc[nH]c2c1)Br 62a_100009814775_200025704644 [0,1,0,0,0,0|1,1,0]=3 954 B13R2.654 [13CH3]Sc1cc(c2cc[nH]c2c1)Br 62a_200025704644_100009814775 [0,1,0,0,0,0|1,1,0]=3 955 B13R2.654 [13CH3]Sc1cc(c2cc[nH]c2c1)F 62a_100010186028_200025704644 [0,1,0,0,0,0|1,1,0]=3 956 B13R2.654 [13CH3]Sc1cc(c2cc[nH]c2c1)F 62a_200025704644_100010186028 [0,1,0,0,0,0|1,1,0]=3 957 B13R2.654 [13CH3]Sc1cc(c2cc[nH]c2c1)N 62a_200025704644_106744500199 [0,1,0,0,0,0|1,1,0]=3 958 B13R2.654 [13CH3]Sc1cc(c2cn[nH]c2c1)Br 62a_100009814768_200025704644 [0,1,0,0,0,0|2,1,0]=4 959 B13R2.654 [13CH3]Sc1cc(c2cn[nH]c2c1)Br 62a_200025704644_100009814768 [0,1,0,0,0,0|2,1,0]=4 960 B13R2.654 [13CH3]Sc1cc(c2cn[nH]c2c1)Cl 62a_200025704644_100000050090 [0,1,0,0,0,0|2,1,0]=4 961 B13R2.654 [13CH3]Sc1cc(c2cn[nH]c2c1)F 62a_200025704644_100010185991 [0,1,0,0,0,0|2,1,0]=4 962 B13R2.654 [13CH3]Sc1cc(c2cn[nH]c2c1)N 62a_200025704644_100010177796 [0,1,0,0,0,0|2,1,0]=4 963 B13R2.654 [13CH3]Sc1cc(c2cn[nH]c2c1)O 62a_200025704644_100010185960 [0,1,0,0,0,0|2,1,0]=4 964 B13R2.654 [13CH3]Sc1cc(c2nccn2c1)F 62a_100010174814_200025704644 [0,1,0,0,0,0|2,1,0]=4 965 B13R2.654 [13CH3]Sc1cc(c2nccn2c1)F 62a_200025704644_100010174814 [0,1,0,0,0,0|2,1,0]=4 966 B13R2.654 [13CH3]Sc1cc(c2nccn2c1)N 62a_200025704644_100009816852 [0,1,0,0,0,0|2,1,0]=4 967 B13R2.654 [13CH3]Sc1cc(c2nccn2c1)O 62a_200025704644_100010074634 [0,1,0,0,0,0|2,1,0]=4 968 B13R2.654 [13CH3]Sc1cc(c2ncnn2c1)F 62a_100015548010_200025704644 [0,1,0,0,0,0|1,1,1]=4 969 B13R2.654 [13CH3]Sc1cc(c2ncnn2c1)F 62a_200025704644_100015548010 [0,1,0,0,0,0|1,1,1]=4 970 B13R2.654 [13CH3]Sc1cc(c2occc2c1)F 62a_200025704644_100012355474 [0,1,0,0,0,0|2,1,0]=4 971 B13R2.669 C=Cc1cc2c(cn1)ncn2C 271570a_100011290941_100009863791 [0,1,0,0,0,0|2,0,1]=4 972 B13R2.669 C=Cc1ccc2ccn(c2c1)C 271570a_100011290941_100011934912 [0,1,0,0,0,0|2,0,1]=4 973 B13R2.669 C=Cc1ccc2ncn(c2c1)C 271570a_100011290941_100000702186 [0,1,0,0,0,0|1,0,1]=3 974 B13R2.669 C=Cc1ccc2nnn(c2c1)C 271570a_100011290941_100010241234 [0,1,0,0,0,0|2,0,1]=4 975 B13R2.669 CNc1ccc2ccn(c2c1)C 34a_100000712629_200000210301 [0,1,0,0,0,0|2,0,0]=3 976 B13R2.669 CNc1ccc2cnn(c2c1)C 34a_100011329731_200000210301 [0,1,0,0,0,0|3,0,0]=4 977 B13R2.669 CNc1ccc2ncn(c2c1)C 34a_100015183096_200000210301 [0,1,0,0,0,0|1,0,0]=2 978 B13R2.669 CNc1ccc2scc(c2c1)Br 2230a_100011178648_200000210301 [0,1,0,0,0,0|3,0,0]=4 979 B13R2.669 CNc1ccc2scc(c2c1)Br 34a_100011178648_200000210301 [0,1,0,0,0,0|3,0,0]=4 980 B13R2.669 CNc1ncc2ncn(c2n1)C 27a_100102657272_100000085903 [0,1,0,0,0,0|3,0,0]=4 981 B13R2.669 COc1cc2c(c[nH]c2cn1)O 271570a_203496583355_200010163580 [0,1,0,0,0,0|2,0,1]=4 982 B13R2.669 COc1ccc2[nH]cc(c2c1)C 34a_100000131216_200000210301 [0,1,0,0,0,0|1,0,1]=3 983 B13R2.669 COc1ccc2[nH]cc(c2n1)O 271570a_203496583355_100010199035 [0,1,0,0,0,0|2,0,1]=4 984 B13R2.669 COc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100012353730 [0,1,0,0,0,0|2,0,1]=4 985 B13R2.669 COc1ccc2c(c1)C(=O)CC2 34a_100009827925_200000210301 [0,1,0,0,0,0|2,0,1]=4 986 B13R2.669 COc1ccc2c(c1)C(=O)CC2 7a_100009827925_200000210301 [0,1,0,0,0,0|2,0,1]=4 987 B13R2.669 COc1ccc2c(c1)C(=O)NC2 34a_100000087830_200000210301 [0,1,0,0,0,0|3,0,0]=4 988 B13R2.669 COc1ccc2cnn(c2c1)C 34a_100009862793_200000210301 [0,1,0,0,0,0|2,0,0]=3 989 B13R2.669 COc1ccn2ncc(c2n1)O 271570a_203496583355_200010893797 [0,1,0,0,0,0|3,0,0]=4 990 B13R2.669 COc1cnc2[nH]cc(c2c1)O 271570a_203496583355_100010199036 [0,1,0,0,0,0|2,0,1]=4 991 B13R2.669 CSc1cc2c(ccn2C)cn1 62a_100020639908_200000210301 [0,1,0,0,0,0|2,1,0]=4 992 B13R2.669 CSc1cc2c(ccn2C)cn1 62a_200000210301_100020639908 [0,1,0,0,0,0|2,1,0]=4 993 B13R2.669 CSc1cc2c(cn1)ncn2C 62a_200000210301_100009863791 [0,1,0,0,0,0|1,1,0]=3 994 B13R2.669 CSc1ccc2[nH]cc(c2c1)C 62a_200000210301_100009816687 [0,1,0,0,0,0|1,1,1]=4 995 B13R2.669 CSc1ccc2ccn(c2c1)C 62a_200000210301_100011934912 [0,1,0,0,0,0|1,1,0]=3 996 B13R2.669 CSc1ccc2cnn(c2c1)C 62a_100009817177_200000210301 [0,1,0,0,0,0|2,1,0]=4 997 B13R2.669 CSc1ccc2cnn(c2c1)C 62a_200000210301_100009817177 [0,1,0,0,0,0|2,1,0]=4 998 B13R2.669 CSc1ccc2ncc(n2c1)Br 62a_100010184845_200000210301 [0,1,0,0,0,0|2,1,0]=4 999 B13R2.669 CSc1ccc2ncc(n2c1)Br 62a_200000210301_100010184845 [0,1,0,0,0,0|2,1,0]=4 1000 B13R2.669 CSc1ccc2ncc(n2c1)C 62a_100012353388_200000210301 [0,1,0,0,0,0|2,1,0]=4 1001 B13R2.669 CSc1ccc2ncc(n2c1)C 62a_200000210301_100012353388 [0,1,0,0,0,0|2,1,0]=4 1002 B13R2.669 CSc1ccc2ncc(n2c1)F 62a_100025711191_200000210301 [0,1,0,0,0,0|2,1,0]=4 1003 B13R2.669 CSc1ccc2ncc(n2c1)F 62a_200000210301_100025711191 [0,1,0,0,0,0|2,1,0]=4 1004 B13R2.669 CSc1ccc2ncn(c2c1)C 62a_200000210301_100000702186 [0,1,0,0,0,0|0,1,0]=2 1005 B13R2.669 CSc1ccc2nnn(c2c1)C 62a_100010241234_200000210301 [0,1,0,0,0,0|1,1,0]=3 1006 B13R2.669 CSc1ccc2nnn(c2c1)C 62a_200000210301_100010241234 [0,1,0,0,0,0|1,1,0]=3 1007 B13R2.669 CSc1ccc2occ(c2c1)C 62a_200000210301_100000728893 [0,1,0,0,0,0|2,1,0]=4 1008 B13R2.669 CSc1ccc2scc(c2c1)C 62a_200000210301_100009814196 [0,1,0,0,0,0|2,1,0]=4 1009 B13R2.669 CSc1cnc2ccn(c2c1)C 62a_200000210301_100010761474 [0,1,0,0,0,0|2,1,0]=4 1010 B13R2.669 CSc1ncc2ncn(c2n1)C 62a_200000210301_100000085903 [0,1,0,0,0,0|2,1,0]=4 1011 B13R2.669 Cc1c[nH]c2c1cc(cc2)O[13CH3] 34a_100000131216_200025704644 [0,1,0,0,0,0|1,0,1]=3 1012 B13R2.669 Cc1c[nH]c2c1cc(cc2)S[13CH3] 62a_200025704644_100009816687 [0,1,0,0,0,0|1,1,1]=4 1013 B13R2.669 Cc1cnc2n1cc(cc2)S[13CH3] 62a_100012353388_200025704644 [0,1,0,0,0,0|2,1,0]=4 1014 B13R2.669 Cc1cnc2n1cc(cc2)S[13CH3] 62a_200025704644_100012353388 [0,1,0,0,0,0|2,1,0]=4 1015 B13R2.669 Cc1coc2c1cc(cc2)S[13CH3] 62a_200025704644_100000728893 [0,1,0,0,0,0|2,1,0]=4 1016 B13R2.669 Cc1csc2c1cc(cc2)S[13CH3] 62a_200025704644_100009814196 [0,1,0,0,0,0|2,1,0]=4 1017 B13R2.669 Cn1ccc2c1cc(cc2)N[13CH3] 34a_100000712629_200025704644 [0,1,0,0,0,0|2,0,0]=3 1018 B13R2.669 Cn1ccc2c1cc(cc2)S[13CH3] 62a_200025704644_100011934912 [0,1,0,0,0,0|1,1,0]=3 1019 B13R2.669 Cn1ccc2c1cc(cn2)S[13CH3] 62a_200025704644_100010761474 [0,1,0,0,0,0|2,1,0]=4 1020 B13R2.669 Cn1ccc2c1cc(nc2)S[13CH3] 62a_100020639908_200025704644 [0,1,0,0,0,0|2,1,0]=4 1021 B13R2.669 Cn1ccc2c1cc(nc2)S[13CH3] 62a_200025704644_100020639908 [0,1,0,0,0,0|2,1,0]=4 1022 B13R2.669 Cn1cnc2c1cc(cc2)N[13CH3] 34a_100015183096_200025704644 [0,1,0,0,0,0|1,0,0]=2 1023 B13R2.669 Cn1cnc2c1cc(cc2)S[13CH3] 62a_200025704644_100000702186 [0,1,0,0,0,0|0,1,0]=2 1024 B13R2.669 Cn1cnc2c1cc(nc2)S[13CH3] 62a_200025704644_100009863791 [0,1,0,0,0,0|1,1,0]=3 1025 B13R2.669 Cn1cnc2c1nc(nc2)S[13CH3] 62a_200025704644_100000085903 [0,1,0,0,0,0|2,1,0]=4 1026 B13R2.669 Cn1ncc2c1cc(cc2)N[13CH3] 34a_100011329731_200025704644 [0,1,0,0,0,0|3,0,0]=4 1027 B13R2.669 Cn1ncc2c1cc(cc2)O[13CH3] 34a_100009862793_200025704644 [0,1,0,0,0,0|2,0,0]=3 1028 B13R2.669 Cn1ncc2c1cc(cc2)S[13CH3] 62a_100009817177_200025704644 [0,1,0,0,0,0|2,1,0]=4 1029 B13R2.669 Cn1ncc2c1cc(cc2)S[13CH3] 62a_200025704644_100009817177 [0,1,0,0,0,0|2,1,0]=4 1030 B13R2.669 Cn1nnc2c1cc(cc2)S[13CH3] 62a_100010241234_200025704644 [0,1,0,0,0,0|1,1,0]=3 1031 B13R2.669 Cn1nnc2c1cc(cc2)S[13CH3] 62a_200025704644_100010241234 [0,1,0,0,0,0|1,1,0]=3 1032 B13R2.669 [13CH3]Nc1ccc2scc(c2c1)Br 2230a_100011178648_200025704644 [0,1,0,0,0,0|3,0,0]=4 1033 B13R2.669 [13CH3]Nc1ccc2scc(c2c1)Br 34a_100011178648_200025704644 [0,1,0,0,0,0|3,0,0]=4 1034 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 34a_100009827925_200025704644 [0,1,0,0,0,0|2,0,1]=4 1035 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 7a_100009827925_200025704644 [0,1,0,0,0,0|2,0,1]=4 1036 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)NC2 34a_100000087830_200025704644 [0,1,0,0,0,0|3,0,0]=4 1037 B13R2.669 [13CH3]Sc1ccc2ncc(n2c1)Br 62a_100010184845_200025704644 [0,1,0,0,0,0|2,1,0]=4 1038 B13R2.669 [13CH3]Sc1ccc2ncc(n2c1)Br 62a_200025704644_100010184845 [0,1,0,0,0,0|2,1,0]=4 1039 B13R2.669 [13CH3]Sc1ccc2ncc(n2c1)F 62a_100025711191_200025704644 [0,1,0,0,0,0|2,1,0]=4 1040 B13R2.669 [13CH3]Sc1ccc2ncc(n2c1)F 62a_200025704644_100025711191 [0,1,0,0,0,0|2,1,0]=4 1041 B13R2.2121 C=Cc1cc2[nH]c(nc2cn1)O 271570a_100011290941_100010516660 [0,1,0,0,0,0|2,0,1]=4 1042 B13R2.2121 C=Cc1ccc2[nH]c(=O)[nH]c2c1 271570a_100011290941_100011221360 [0,1,0,0,0,0|1,0,2]=4 1043 B13R2.2121 C=Cc1ccc2c(c1)NC(=O)C2 271570a_100011290941_100000760487 [0,1,0,0,0,0|2,0,1]=4 1044 B13R2.2121 C=Cc1ccc2cc([nH]c2c1)C 271570a_100011290941_100010196937 [0,1,0,0,0,0|2,0,1]=4 1045 B13R2.2121 C=Cc1ccc2nc([nH]c2n1)C 271570a_100011290941_100000079090 [0,1,0,0,0,0|2,0,1]=4 1046 B13R2.2121 C=Cc1ccc2nc(oc2c1)C 271570a_100011290941_100010171164 [0,1,0,0,0,0|2,0,1]=4 1047 B13R2.2121 C=Cc1ccc2nc(oc2c1)N 271570a_100011290941_100010000678 [0,1,0,0,0,0|2,0,1]=4 1048 B13R2.2121 C=Cc1ccc2nc(sc2c1)C 271570a_100011290941_100009813144 [0,1,0,0,0,0|2,0,1]=4 1049 B13R2.2121 C=Cc1ccc2nc(sc2c1)Cl 271570a_100011290941_100010163703 [0,1,0,0,0,0|2,0,1]=4 1050 B13R2.2121 C=Cc1ccc2nc(sc2c1)N 271570a_100011290941_100102524914 [0,1,0,0,0,0|2,0,1]=4 1051 B13R2.2121 C=Cc1ccc2oc(=O)[nH]c2c1 271570a_100011290941_100000764829 [0,1,0,0,0,0|2,0,1]=4 1052 B13R2.2121 C=Cc1ccc2sc(=O)[nH]c2c1 271570a_100011290941_100000239354 [0,1,0,0,0,0|2,0,1]=4 1053 B13R2.2121 C=Cc1cnc2nc([nH]c2c1)C 271570a_100011290941_100000758206 [0,1,0,0,0,0|2,0,1]=4 1054 B13R2.2121 CNc1ccc2nc(oc2c1)C 34a_100000736495_200000210301 [0,1,0,0,0,0|2,0,0]=3 1055 B13R2.2121 CNc1ccc2nc(sc2c1)Cl 27a_100102657272_100010163703 [0,1,0,0,0,0|2,0,0]=3 1056 B13R2.2121 CNc1ccc2nn(cc2c1)C 34a_100000067545_200000210301 [0,1,0,0,0,0|3,0,0]=4 1057 B13R2.2121 CNc1ccc2oc(nc2c1)C 34a_100000195416_200000210301 [0,1,0,0,0,0|2,0,1]=4 1058 B13R2.2121 COc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200000210301 [0,1,0,0,0,0|1,0,1]=3 1059 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 34a_100000073708_200000210301 [0,1,0,0,0,0|1,0,1]=3 1060 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 7a_100000073708_200000210301 [0,1,0,0,0,0|1,0,1]=3 1061 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 34a_100000035078_200000210301 [0,1,0,0,0,0|2,0,0]=3 1062 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 7a_100000035078_200000210301 [0,1,0,0,0,0|2,0,0]=3 1063 B13R2.2121 COc1ccc2c(c1)CN(C2)C 269982a_100000051402_200000210301 [0,1,0,0,0,0|3,0,0]=4 1064 B13R2.2121 COc1ccc2c(c1)CN(C2)C 34a_100000051402_200000210301 [0,1,0,0,0,0|3,0,0]=4 1065 B13R2.2121 COc1ccc2c(c1)CN(C2)[13CH3] 269982a_100000051402_200025704644 [0,1,0,0,0,0|3,0,0]=4 1066 B13R2.2121 COc1ccc2c(c1)CN(C2)[13CH3] 34a_100000051402_200025704644 [0,1,0,0,0,0|3,0,0]=4 1067 B13R2.2121 COc1ccc2cc([nH]c2c1)C 34a_100000058111_200000210301 [0,1,0,0,0,0|1,0,0]=2 1068 B13R2.2121 COc1ccc2cc(oc2c1)C 34a_100000095638_200000210301 [0,1,0,0,0,0|2,0,0]=3 1069 B13R2.2121 COc1ccc2cc(oc2c1)C 7a_100000095638_200000210301 [0,1,0,0,0,0|2,0,0]=3 1070 B13R2.2121 COc1ccc2nc(oc2c1)C 34a_100000116946_200000210301 [0,1,0,0,0,0|1,0,0]=2 1071 B13R2.2121 COc1ccc2nc(oc2c1)C 7a_100000116946_200000210301 [0,1,0,0,0,0|1,0,0]=2 1072 B13R2.2121 COc1ccc2nc(sc2c1)Br 7a_100010063415_200000210301 [0,1,0,0,0,0|1,0,0]=2 1073 B13R2.2121 COc1ccc2nc(sc2c1)C 34a_100000008955_200000210301 [0,1,0,0,0,0|1,0,0]=2 1074 B13R2.2121 COc1ccc2nc(sc2c1)C 7a_100000008955_200000210301 [0,1,0,0,0,0|1,0,0]=2 1075 B13R2.2121 COc1ccc2nc(sc2c1)N 7a_100000012012_200000210301 [0,1,0,0,0,0|1,0,0]=2 1076 B13R2.2121 COc1ccc2nc(sc2c1)O 271570a_203496583355_100010195960 [0,1,0,0,0,0|1,0,0]=2 1077 B13R2.2121 COc1ccc2nn(cc2c1)C 34a_100000106843_200000210301 [0,1,0,0,0,0|2,0,0]=3 1078 B13R2.2121 COc1ccc2oc(nc2c1)C 34a_100000102623_200000210301 [0,1,0,0,0,0|1,0,1]=3 1079 B13R2.2121 COc1ccc2oc(nc2c1)C 7a_100000102623_200000210301 [0,1,0,0,0,0|1,0,1]=3 1080 B13R2.2121 COc1ccc2oc(nc2c1)Cl 34a_100010673232_200000210301 [0,1,0,0,0,0|1,0,1]=3 1081 B13R2.2121 COc1ccc2oc(nc2c1)Cl 7a_100010673232_200000210301 [0,1,0,0,0,0|1,0,1]=3 1082 B13R2.2121 COc1ccc2sc(nc2c1)C 34a_100000031546_200000210301 [0,1,0,0,0,0|1,0,1]=3 1083 B13R2.2121 COc1ccc2sc(nc2c1)C 7a_100000031546_200000210301 [0,1,0,0,0,0|1,0,1]=3 1084 B13R2.2121 COc1ccc2sc(nc2c1)N 7a_100000066538_200000210301 [0,1,0,0,0,0|1,0,1]=3 1085 B13R2.2121 COc1ccn2cc(nc2c1)C 34a_106256048495_200000210301 [0,1,0,0,0,0|2,0,1]=4 1086 B13R2.2121 CSc1cc2[nH]c(nc2cn1)O 62a_200000210301_100010516660 [0,1,0,0,0,0|1,1,0]=3 1087 B13R2.2121 CSc1cc2c(cn1)CC(=O)N2 62a_200000210301_100000089690 [0,1,0,0,0,0|2,1,0]=4 1088 B13R2.2121 CSc1ccc2[nH]c(=O)[nH]c2c1 62a_200000210301_200011356815 [0,1,0,0,0,0|0,1,1]=3 1089 B13R2.2121 CSc1ccc2[nH]c(=O)oc2c1 62a_200000210301_100000697996 [0,1,0,0,0,0|1,1,1]=4 1090 B13R2.2121 CSc1ccc2[nH]c(cc2c1)C 62a_200000210301_100011214893 [0,1,0,0,0,0|1,1,1]=4 1091 B13R2.2121 CSc1ccc2[nH]c(nc2c1)C 62a_200000210301_100011264012 [0,1,0,0,0,0|0,1,2]=4 1092 B13R2.2121 CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_200000210301 [0,1,0,0,0,0|2,1,0]=4 1093 B13R2.2121 CSc1ccc2c(c1)CC(=O)N2 62a_200000210301_100000754858 [0,1,0,0,0,0|1,1,1]=4 1094 B13R2.2121 CSc1ccc2c(c1)NC(=O)C2 62a_200000210301_100000760487 [0,1,0,0,0,0|1,1,0]=3 1095 B13R2.2121 CSc1ccc2c(n1)NC(=O)C2 62a_200000210301_100000104062 [0,1,0,0,0,0|2,1,0]=4 1096 B13R2.2121 CSc1ccc2cc([nH]c2c1)C 62a_200000210301_100010196937 [0,1,0,0,0,0|1,1,0]=3 1097 B13R2.2121 CSc1ccc2nc([nH]c2c1)Cl 62a_200000210301_100010204286 [0,1,0,0,0,0|0,1,0]=2 1098 B13R2.2121 CSc1ccc2nc([nH]c2n1)C 62a_100010074185_200000210301 [0,1,0,0,0,0|1,1,0]=3 1099 B13R2.2121 CSc1ccc2nc(cn2c1)C 62a_100000194050_200000210301 [0,1,0,0,0,0|2,1,0]=4 1100 B13R2.2121 CSc1ccc2nc(cn2c1)C 62a_200000210301_100000194050 [0,1,0,0,0,0|2,1,0]=4 1101 B13R2.2121 CSc1ccc2nc(nn2c1)C 62a_100009815719_200000210301 [0,1,0,0,0,0|1,1,1]=4 1102 B13R2.2121 CSc1ccc2nc(nn2c1)C 62a_200000210301_100009815719 [0,1,0,0,0,0|1,1,1]=4 1103 B13R2.2121 CSc1ccc2nc(nn2c1)N 62a_100000766472_200000210301 [0,1,0,0,0,0|1,1,1]=4 1104 B13R2.2121 CSc1ccc2nc(oc2c1)C 62a_200000210301_100010171164 [0,1,0,0,0,0|1,1,0]=3 1105 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_100009813144_200000210301 [0,1,0,0,0,0|1,1,0]=3 1106 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_200000210301_100009813144 [0,1,0,0,0,0|1,1,0]=3 1107 B13R2.2121 CSc1ccc2nc(sc2c1)Cl 62a_200000210301_100010163703 [0,1,0,0,0,0|1,1,0]=3 1108 B13R2.2121 CSc1ccc2nc(sc2c1)N 62a_100102524914_200000210301 [0,1,0,0,0,0|1,1,0]=3 1109 B13R2.2121 CSc1ccc2nc(sc2n1)N 62a_100000075896_200000210301 [0,1,0,0,0,0|2,1,0]=4 1110 B13R2.2121 CSc1ccc2nn(cc2c1)C 62a_100009817163_200000210301 [0,1,0,0,0,0|2,1,0]=4 1111 B13R2.2121 CSc1ccc2nn(cc2c1)C 62a_200000210301_100009817163 [0,1,0,0,0,0|2,1,0]=4 1112 B13R2.2121 CSc1ccc2oc(nc2c1)C 62a_200000210301_100009816932 [0,1,0,0,0,0|1,1,1]=4 1113 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_100000695401_200000210301 [0,1,0,0,0,0|2,1,0]=4 1114 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_200000210301_100000695401 [0,1,0,0,0,0|2,1,0]=4 1115 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_100009813953_200000210301 [0,1,0,0,0,0|1,1,1]=4 1116 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_200000210301_100009813953 [0,1,0,0,0,0|1,1,1]=4 1117 B13R2.2121 CSc1ccc2sc(nc2c1)N 62a_100011934045_200000210301 [0,1,0,0,0,0|1,1,1]=4 1118 B13R2.2121 CSc1ccn2nc(nc2c1)C 62a_100010063680_200000210301 [0,1,0,0,0,0|1,1,1]=4 1119 B13R2.2121 CSc1ccn2nc(nc2c1)C 62a_200000210301_100010063680 [0,1,0,0,0,0|1,1,1]=4 1120 B13R2.2121 CSc1ccn2nc(nc2c1)N 62a_100000757011_200000210301 [0,1,0,0,0,0|1,1,1]=4 1121 B13R2.2121 CSc1cnc2c(c1)NC(=O)C2 62a_200000210301_100010168558 [0,1,0,0,0,0|2,1,0]=4 1122 B13R2.2121 CSc1cnc2cc([nH]c2c1)C 62a_200000210301_100010168555 [0,1,0,0,0,0|2,1,0]=4 1123 B13R2.2121 CSc1cnc2nc([nH]c2c1)C 62a_200000210301_100000758206 [0,1,0,0,0,0|1,1,0]=3 1124 B13R2.2121 CSc1cnc2nc(oc2c1)C 62a_100010235748_200000210301 [0,1,0,0,0,0|2,1,0]=4 1125 B13R2.2121 CSc1cnc2nc(oc2c1)C 62a_200000210301_100010235748 [0,1,0,0,0,0|2,1,0]=4 1126 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 34a_100000073708_200025704644 [0,1,0,0,0,0|1,0,1]=3 1127 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 7a_100000073708_200025704644 [0,1,0,0,0,0|1,0,1]=3 1128 B13R2.2121 Cc1cc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011214893 [0,1,0,0,0,0|1,1,1]=4 1129 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_100000695401_200025704644 [0,1,0,0,0,0|2,1,0]=4 1130 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_200025704644_100000695401 [0,1,0,0,0,0|2,1,0]=4 1131 B13R2.2121 Cc1cc2ccc(cc2[nH]1)O[13CH3] 34a_100000058111_200025704644 [0,1,0,0,0,0|1,0,0]=2 1132 B13R2.2121 Cc1cc2ccc(cc2[nH]1)S[13CH3] 62a_200025704644_100010196937 [0,1,0,0,0,0|1,1,0]=3 1133 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 34a_100000095638_200025704644 [0,1,0,0,0,0|2,0,0]=3 1134 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 7a_100000095638_200025704644 [0,1,0,0,0,0|2,0,0]=3 1135 B13R2.2121 Cc1cc2ncc(cc2[nH]1)S[13CH3] 62a_200025704644_100010168555 [0,1,0,0,0,0|2,1,0]=4 1136 B13R2.2121 Cc1cn2cc(ccc2n1)S[13CH3] 62a_100000194050_200025704644 [0,1,0,0,0,0|2,1,0]=4 1137 B13R2.2121 Cc1cn2cc(ccc2n1)S[13CH3] 62a_200025704644_100000194050 [0,1,0,0,0,0|2,1,0]=4 1138 B13R2.2121 Cc1cn2ccc(cc2n1)O[13CH3] 34a_106256048495_200025704644 [0,1,0,0,0,0|2,0,1]=4 1139 B13R2.2121 Cc1nc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011264012 [0,1,0,0,0,0|0,1,2]=4 1140 B13R2.2121 Cc1nc2cc(ccc2o1)N[13CH3] 34a_100000195416_200025704644 [0,1,0,0,0,0|2,0,1]=4 1141 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 34a_100000102623_200025704644 [0,1,0,0,0,0|1,0,1]=3 1142 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 7a_100000102623_200025704644 [0,1,0,0,0,0|1,0,1]=3 1143 B13R2.2121 Cc1nc2cc(ccc2o1)S[13CH3] 62a_200025704644_100009816932 [0,1,0,0,0,0|1,1,1]=4 1144 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 34a_100000031546_200025704644 [0,1,0,0,0,0|1,0,1]=3 1145 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 7a_100000031546_200025704644 [0,1,0,0,0,0|1,0,1]=3 1146 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_100009813953_200025704644 [0,1,0,0,0,0|1,1,1]=4 1147 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_200025704644_100009813953 [0,1,0,0,0,0|1,1,1]=4 1148 B13R2.2121 Cc1nc2cc(ccn2n1)S[13CH3] 62a_100010063680_200025704644 [0,1,0,0,0,0|1,1,1]=4 1149 B13R2.2121 Cc1nc2cc(ccn2n1)S[13CH3] 62a_200025704644_100010063680 [0,1,0,0,0,0|1,1,1]=4 1150 B13R2.2121 Cc1nc2ccc(cc2o1)N[13CH3] 34a_100000736495_200025704644 [0,1,0,0,0,0|2,0,0]=3 1151 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 34a_100000116946_200025704644 [0,1,0,0,0,0|1,0,0]=2 1152 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 7a_100000116946_200025704644 [0,1,0,0,0,0|1,0,0]=2 1153 B13R2.2121 Cc1nc2ccc(cc2o1)S[13CH3] 62a_200025704644_100010171164 [0,1,0,0,0,0|1,1,0]=3 1154 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 34a_100000008955_200025704644 [0,1,0,0,0,0|1,0,0]=2 1155 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 7a_100000008955_200025704644 [0,1,0,0,0,0|1,0,0]=2 1156 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_100009813144_200025704644 [0,1,0,0,0,0|1,1,0]=3 1157 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_200025704644_100009813144 [0,1,0,0,0,0|1,1,0]=3 1158 B13R2.2121 Cc1nc2ccc(cn2n1)S[13CH3] 62a_100009815719_200025704644 [0,1,0,0,0,0|1,1,1]=4 1159 B13R2.2121 Cc1nc2ccc(cn2n1)S[13CH3] 62a_200025704644_100009815719 [0,1,0,0,0,0|1,1,1]=4 1160 B13R2.2121 Cc1nc2ccc(nc2[nH]1)S[13CH3] 62a_100010074185_200025704644 [0,1,0,0,0,0|1,1,0]=3 1161 B13R2.2121 Cc1nc2ncc(cc2[nH]1)S[13CH3] 62a_200025704644_100000758206 [0,1,0,0,0,0|1,1,0]=3 1162 B13R2.2121 Cc1nc2ncc(cc2o1)S[13CH3] 62a_100010235748_200025704644 [0,1,0,0,0,0|2,1,0]=4 1163 B13R2.2121 Cc1nc2ncc(cc2o1)S[13CH3] 62a_200025704644_100010235748 [0,1,0,0,0,0|2,1,0]=4 1164 B13R2.2121 Cn1cc2cc(ccc2n1)N[13CH3] 34a_100000067545_200025704644 [0,1,0,0,0,0|3,0,0]=4 1165 B13R2.2121 Cn1cc2cc(ccc2n1)O[13CH3] 34a_100000106843_200025704644 [0,1,0,0,0,0|2,0,0]=3 1166 B13R2.2121 Cn1cc2cc(ccc2n1)S[13CH3] 62a_100009817163_200025704644 [0,1,0,0,0,0|2,1,0]=4 1167 B13R2.2121 Cn1cc2cc(ccc2n1)S[13CH3] 62a_200025704644_100009817163 [0,1,0,0,0,0|2,1,0]=4 1168 B13R2.2121 O=Cc1ccc2nc(sc2c1)O 271570a_203496583355_200010272093 [0,1,0,0,0,0|3,0,0]=4 1169 B13R2.2121 [13CH3]Oc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200025704644 [0,1,0,0,0,0|1,0,1]=3 1170 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 34a_100000035078_200025704644 [0,1,0,0,0,0|2,0,0]=3 1171 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 7a_100000035078_200025704644 [0,1,0,0,0,0|2,0,0]=3 1172 B13R2.2121 [13CH3]Oc1ccc2nc(sc2c1)Br 7a_100010063415_200025704644 [0,1,0,0,0,0|1,0,0]=2 1173 B13R2.2121 [13CH3]Oc1ccc2nc(sc2c1)N 7a_100000012012_200025704644 [0,1,0,0,0,0|1,0,0]=2 1174 B13R2.2121 [13CH3]Oc1ccc2oc(nc2c1)Cl 34a_100010673232_200025704644 [0,1,0,0,0,0|1,0,1]=3 1175 B13R2.2121 [13CH3]Oc1ccc2oc(nc2c1)Cl 7a_100010673232_200025704644 [0,1,0,0,0,0|1,0,1]=3 1176 B13R2.2121 [13CH3]Oc1ccc2sc(nc2c1)N 7a_100000066538_200025704644 [0,1,0,0,0,0|1,0,1]=3 1177 B13R2.2121 [13CH3]Sc1cc2[nH]c(nc2cn1)O 62a_200025704644_100010516660 [0,1,0,0,0,0|1,1,0]=3 1178 B13R2.2121 [13CH3]Sc1cc2c(cn1)CC(=O)N2 62a_200025704644_100000089690 [0,1,0,0,0,0|2,1,0]=4 1179 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)[nH]c2c1 62a_200025704644_200011356815 [0,1,0,0,0,0|0,1,1]=3 1180 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)oc2c1 62a_200025704644_100000697996 [0,1,0,0,0,0|1,1,1]=4 1181 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(=O)C2 62a_100010185598_200025704644 [0,1,0,0,0,0|2,1,0]=4 1182 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(=O)N2 62a_200025704644_100000754858 [0,1,0,0,0,0|1,1,1]=4 1183 B13R2.2121 [13CH3]Sc1ccc2c(c1)NC(=O)C2 62a_200025704644_100000760487 [0,1,0,0,0,0|1,1,0]=3 1184 B13R2.2121 [13CH3]Sc1ccc2c(n1)NC(=O)C2 62a_200025704644_100000104062 [0,1,0,0,0,0|2,1,0]=4 1185 B13R2.2121 [13CH3]Sc1ccc2nc([nH]c2c1)Cl 62a_200025704644_100010204286 [0,1,0,0,0,0|0,1,0]=2 1186 B13R2.2121 [13CH3]Sc1ccc2nc(nn2c1)N 62a_100000766472_200025704644 [0,1,0,0,0,0|1,1,1]=4 1187 B13R2.2121 [13CH3]Sc1ccc2nc(sc2c1)Cl 62a_200025704644_100010163703 [0,1,0,0,0,0|1,1,0]=3 1188 B13R2.2121 [13CH3]Sc1ccc2nc(sc2c1)N 62a_100102524914_200025704644 [0,1,0,0,0,0|1,1,0]=3 1189 B13R2.2121 [13CH3]Sc1ccc2nc(sc2n1)N 62a_100000075896_200025704644 [0,1,0,0,0,0|2,1,0]=4 1190 B13R2.2121 [13CH3]Sc1ccc2sc(nc2c1)N 62a_100011934045_200025704644 [0,1,0,0,0,0|1,1,1]=4 1191 B13R2.2121 [13CH3]Sc1ccn2nc(nc2c1)N 62a_100000757011_200025704644 [0,1,0,0,0,0|1,1,1]=4 1192 B13R2.2121 [13CH3]Sc1cnc2c(c1)NC(=O)C2 62a_200025704644_100010168558 [0,1,0,0,0,0|2,1,0]=4 1193 B13R2.2130 C=Cc1ccc2c(c[nH]c2c1)C 271570a_100011290941_100010209589 [0,1,0,0,0,0|2,0,1]=4 1194 B13R2.2130 CNc1ccc2c(c1)ccn2C 34a_100011270241_200000210301 [0,1,0,0,0,0|2,0,1]=4 1195 B13R2.2130 CNc1ccc2c(c1)ncn2C 34a_100000186679_200000210301 [0,1,0,0,0,0|1,0,2]=4 1196 B13R2.2130 COc1cc2[nH]cc(c2cn1)O 271570a_203496583355_200010168631 [0,1,0,0,0,0|2,0,0]=3 1197 B13R2.2130 COc1ccc2c(c1)CCC2=O 34a_100000708912_200000210301 [0,1,0,0,0,0|2,0,1]=4 1198 B13R2.2130 COc1ccc2c(c1)CCC2=O 7a_100000708912_200000210301 [0,1,0,0,0,0|2,0,1]=4 1199 B13R2.2130 COc1ccc2c(c1)CNC2=O 34a_100000098542_200000210301 [0,1,0,0,0,0|3,0,0]=4 1200 B13R2.2130 COc1ccc2c(c1)COC2=O 7a_100000044543_200000210301 [0,1,0,0,0,0|3,0,0]=4 1201 B13R2.2130 COc1ccc2c(c1)cnn2C 34a_100009859523_200000210301 [0,1,0,0,0,0|2,0,1]=4 1202 B13R2.2130 COc1ccc2c(c1)cnn2C 7a_100009859523_200000210301 [0,1,0,0,0,0|2,0,1]=4 1203 B13R2.2130 COc1ccc2c(c1)ncn2C 34a_100000028553_200000210301 [0,1,0,0,0,0|0,0,2]=3 1204 B13R2.2130 COc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049672 [0,1,0,0,0,0|2,0,0]=3 1205 B13R2.2130 COc1ccc2c(noc2c1)C 34a_200000076027_200000210301 [0,1,0,0,0,0|3,0,0]=4 1206 B13R2.2130 COc1ccn2c(cnc2c1)O 271570a_203496583355_100010231830 [0,1,0,0,0,0|2,0,1]=4 1207 B13R2.2130 COc1cnc2c(c[nH]c2c1)O 271570a_203496583355_200010168573 [0,1,0,0,0,0|2,0,0]=3 1208 B13R2.2130 CSc1ccc2c(=O)[nH][nH]c2c1 62a_200000210301_100012353722 [0,1,0,0,0,0|2,1,0]=4 1209 B13R2.2130 CSc1ccc2c(c1)C=CC2=O 62a_100010210589_200000210301 [0,1,0,0,0,0|2,1,0]=4 1210 B13R2.2130 CSc1ccc2c(c1)C=CC2=O 62a_200000210301_100010210589 [0,1,0,0,0,0|2,1,0]=4 1211 B13R2.2130 CSc1ccc2c(c1)ccn2C 62a_200000210301_100011202928 [0,1,0,0,0,0|1,1,1]=4 1212 B13R2.2130 CSc1ccc2c(c1)ncn2C 62a_200000210301_100000718706 [0,1,0,0,0,0|0,1,2]=4 1213 B13R2.2130 CSc1ccc2c(c[nH]c2c1)C 62a_200000210301_100010209589 [0,1,0,0,0,0|1,1,0]=3 1214 B13R2.2130 CSc1ccc2c(coc2c1)C 62a_200000210301_100010775837 [0,1,0,0,0,0|2,1,0]=4 1215 B13R2.2130 CSc1ccc2c(n[nH]c2c1)C 62a_200000210301_100009816850 [0,1,0,0,0,0|2,1,0]=4 1216 B13R2.2130 Cc1c[nH]c2c1ccc(c2)S[13CH3] 62a_200025704644_100010209589 [0,1,0,0,0,0|1,1,0]=3 1217 B13R2.2130 Cc1coc2c1ccc(c2)S[13CH3] 62a_200025704644_100010775837 [0,1,0,0,0,0|2,1,0]=4 1218 B13R2.2130 Cc1n[nH]c2c1ccc(c2)S[13CH3] 62a_200025704644_100009816850 [0,1,0,0,0,0|2,1,0]=4 1219 B13R2.2130 Cc1noc2c1ccc(c2)O[13CH3] 34a_200000076027_200025704644 [0,1,0,0,0,0|3,0,0]=4 1220 B13R2.2130 Cn1ccc2c1ccc(c2)N[13CH3] 34a_100011270241_200025704644 [0,1,0,0,0,0|2,0,1]=4 1221 B13R2.2130 Cn1ccc2c1ccc(c2)S[13CH3] 62a_200025704644_100011202928 [0,1,0,0,0,0|1,1,1]=4 1222 B13R2.2130 Cn1cnc2c1ccc(c2)N[13CH3] 34a_100000186679_200025704644 [0,1,0,0,0,0|1,0,2]=4 1223 B13R2.2130 Cn1cnc2c1ccc(c2)O[13CH3] 34a_100000028553_200025704644 [0,1,0,0,0,0|0,0,2]=3 1224 B13R2.2130 Cn1cnc2c1ccc(c2)S[13CH3] 62a_200025704644_100000718706 [0,1,0,0,0,0|0,1,2]=4 1225 B13R2.2130 Cn1ncc2c1ccc(c2)O[13CH3] 34a_100009859523_200025704644 [0,1,0,0,0,0|2,0,1]=4 1226 B13R2.2130 Cn1ncc2c1ccc(c2)O[13CH3] 7a_100009859523_200025704644 [0,1,0,0,0,0|2,0,1]=4 1227 B13R2.2130 N#Cc1ccc2c(c[nH]c2c1)O 271570a_203496583355_200014310816 [0,1,0,0,0,0|3,0,0]=4 1228 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 34a_100000708912_200025704644 [0,1,0,0,0,0|2,0,1]=4 1229 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 7a_100000708912_200025704644 [0,1,0,0,0,0|2,0,1]=4 1230 B13R2.2130 [13CH3]Oc1ccc2c(c1)CNC2=O 34a_100000098542_200025704644 [0,1,0,0,0,0|3,0,0]=4 1231 B13R2.2130 [13CH3]Oc1ccc2c(c1)COC2=O 7a_100000044543_200025704644 [0,1,0,0,0,0|3,0,0]=4 1232 B13R2.2130 [13CH3]Sc1ccc2c(=O)[nH][nH]c2c1 62a_200025704644_100012353722 [0,1,0,0,0,0|2,1,0]=4 1233 B13R2.2130 [13CH3]Sc1ccc2c(c1)C=CC2=O 62a_100010210589_200025704644 [0,1,0,0,0,0|2,1,0]=4 1234 B13R2.2130 [13CH3]Sc1ccc2c(c1)C=CC2=O 62a_200025704644_100010210589 [0,1,0,0,0,0|2,1,0]=4 1235 B11R1.18 COCSc1[nH]cnc1C=O 62a_100000766300_100015192532 [0,0,1,0,0,0|2,0,1]=4 1236 B11R1.18 COCSc1[nH]cnc1C=O 62a_100015192532_100000766300 [0,0,1,0,0,0|2,0,1]=4 1237 B11R1.25 CCC(=O)C=Cc1c[nH]cn1 1458a_100102678534_100000210202 [0,0,1,0,0,0|2,0,0]=3 1238 B11R1.25 CCC(=O)C=Cc1cscn1 1458a_200000747928_100000210202 [0,0,1,0,0,0|3,0,0]=4 1239 B11R1.25 CNC(=O)C=Cc1c[nH]cn1 240690a_100102657272_100102678534 [0,0,1,0,0,0|2,0,0]=3 1240 B11R1.25 CNC(=O)C=Cc1cscn1 11a_106832991635_200000747928 [0,0,1,0,0,0|3,0,0]=4 1241 B11R1.25 CNC(=O)C=Cc1cscn1 1626a_100102657272_200000747928 [0,0,1,0,0,0|3,0,0]=4 1242 B11R1.25 CNC(=O)C=Cc1cscn1 240690a_100102657272_200000747928 [0,0,1,0,0,0|3,0,0]=4 1243 B11R1.25 COC(=O)CSc1c[nH]cn1 62a_100000747449_100000756875 [0,0,1,0,0,0|2,0,1]=4 1244 B11R1.25 COC(=O)CSc1c[nH]cn1 62a_100000756875_100000747449 [0,0,1,0,0,0|2,0,1]=4 1245 B11R1.25 O=C(C=Cc1c[nH]cn1)CF 1458a_100102678534_100015361967 [0,0,1,0,0,0|3,0,0]=4 1246 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_100016259036_200000210301 [0,0,1,0,0,0|2,1,0]=4 1247 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_200000210301_100016259036 [0,0,1,0,0,0|2,1,0]=4 1248 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_100016259036_200025704644 [0,0,1,0,0,0|2,1,0]=4 1249 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_100016259036 [0,0,1,0,0,0|2,1,0]=4 1250 B11R1.83 C=C=Cc1ccc(cc1)OC 271570a_100015277604_100000171711 [0,0,1,0,0,0|2,0,1]=4 1251 B11R1.83 C=CCc1ccc(cc1)OC 34a_100000078792_200000210301 [0,0,1,0,0,0|2,0,0]=3 1252 B11R1.83 C=CCc1ccc(cc1)OC 7a_100000078792_200000210301 [0,0,1,0,0,0|2,0,0]=3 1253 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 34a_100000078792_200025704644 [0,0,1,0,0,0|2,0,0]=3 1254 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 7a_100000078792_200025704644 [0,0,1,0,0,0|2,0,0]=3 1255 B11R1.83 C=COc1ccc(cc1)SC 62a_100000704263_200000210301 [0,0,1,0,0,0|2,1,0]=4 1256 B11R1.83 C=COc1ccc(cc1)SC 62a_200000210301_100000704263 [0,0,1,0,0,0|2,1,0]=4 1257 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_100000704263_200025704644 [0,0,1,0,0,0|2,1,0]=4 1258 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_200025704644_100000704263 [0,0,1,0,0,0|2,1,0]=4 1259 B11R1.83 CC=Cc1ccc(cc1)CC 271570a_100016259895_100011215824 [0,0,1,0,0,0|3,0,0]=4 1260 B11R1.83 CC=Cc1ccc(cc1)NC 271570a_100016259895_100000219623 [0,0,1,0,0,0|3,0,0]=4 1261 B11R1.83 CC=Cc1ccc(cc1)OC 271570a_100016259895_100000171711 [0,0,1,0,0,0|2,0,0]=3 1262 B11R1.83 CC=Cc1ccc(cc1)SC 271570a_100016259895_100011263217 [0,0,1,0,0,0|2,1,0]=4 1263 B11R1.83 CC=Cc1ccc(cn1)OC 271570a_100016259895_100000755202 [0,0,1,0,0,0|3,0,0]=4 1264 B11R1.83 CC=Cc1ccc(nc1)OC 271570a_100016259895_100000047065 [0,0,1,0,0,0|3,0,0]=4 1265 B11R1.83 CCCc1ccc(cc1)OC 34a_100000749406_200000210301 [0,0,1,0,0,0|2,0,1]=4 1266 B11R1.83 CCCc1ccc(cc1)OC 7a_100000749406_200000210301 [0,0,1,0,0,0|2,0,1]=4 1267 B11R1.83 CCCc1ccc(cc1)O[13CH3] 34a_100000749406_200025704644 [0,0,1,0,0,0|2,0,1]=4 1268 B11R1.83 CCCc1ccc(cc1)O[13CH3] 7a_100000749406_200025704644 [0,0,1,0,0,0|2,0,1]=4 1269 B11R1.83 CCNc1ccc(cc1)OC 34a_100000184247_100000210202 [0,0,1,0,0,0|1,0,2]=4 1270 B11R1.83 CCNc1ccc(cc1)OC 34a_100011337800_200000210301 [0,0,1,0,0,0|1,0,2]=4 1271 B11R1.83 CCNc1ccc(cc1)OC 7a_100011337800_200000210301 [0,0,1,0,0,0|1,0,2]=4 1272 B11R1.83 CCNc1ccc(cc1)O[13CH3] 34a_100011337800_200025704644 [0,0,1,0,0,0|1,0,2]=4 1273 B11R1.83 CCNc1ccc(cc1)O[13CH3] 7a_100011337800_200025704644 [0,0,1,0,0,0|1,0,2]=4 1274 B11R1.83 CCOc1ccc(cc1)OC 34a_100000185467_200000210301 [0,0,1,0,0,0|2,0,1]=4 1275 B11R1.83 CCOc1ccc(cc1)OC 34a_100000210503_100000210202 [0,0,1,0,0,0|2,0,1]=4 1276 B11R1.83 CCOc1ccc(cc1)O[13CH3] 34a_100000185467_200025704644 [0,0,1,0,0,0|2,0,1]=4 1277 B11R1.83 CCSc1ccc(cc1)OC 62a_100000210202_100000171711 [0,0,1,0,0,0|2,0,1]=4 1278 B11R1.83 CNCc1ccc(cc1)OC 207a_100102657272_100000169835 [0,0,1,0,0,0|3,0,0]=4 1279 B11R1.83 CNCc1ccc(cc1)OC 2230a_106832991635_100000742318 [0,0,1,0,0,0|3,0,0]=4 1280 B11R1.83 CNCc1ccc(cc1)OC 26a_100102657272_100000210503 [0,0,1,0,0,0|3,0,0]=4 1281 B11R1.83 CNCc1ccc(cc1)OC 270004a_106832991635_100000169835 [0,0,1,0,0,0|3,0,0]=4 1282 B11R1.83 CNCc1ccc(cc1)OC 34a_100000185587_200000210301 [0,0,1,0,0,0|3,0,0]=4 1283 B11R1.83 CNCc1ccc(cc1)OC 34a_100000207500_200000210301 [0,0,1,0,0,0|3,0,0]=4 1284 B11R1.83 CNCc1ccc(cc1)OC 34a_100102657272_100000742318 [0,0,1,0,0,0|3,0,0]=4 1285 B11R1.83 CNCc1ccc(cc1)OC 7a_106832991635_100000742318 [0,0,1,0,0,0|3,0,0]=4 1286 B11R1.83 CNCc1ccc(cc1)O[13CH3] 34a_100000207500_200025704644 [0,0,1,0,0,0|3,0,0]=4 1287 B11R1.83 CNc1ccc(cc1)N=[N+]=[N-] 2230a_100000032754_200000210301 [0,0,1,0,0,0|2,0,1]=4 1288 B11R1.83 COCc1ccc(cc1)OC 34a_100000173359_200000210301 [0,0,1,0,0,0|3,0,0]=4 1289 B11R1.83 COCc1ccc(cc1)OC 34a_100138415774_100000742318 [0,0,1,0,0,0|3,0,0]=4 1290 B11R1.83 COCc1ccc(cc1)OC 34a_200011995677_200000210301 [0,0,1,0,0,0|3,0,0]=4 1291 B11R1.83 COCc1ccc(cc1)OC 7a_200011995677_200000210301 [0,0,1,0,0,0|3,0,0]=4 1292 B11R1.83 COCc1ccc(cc1)O[13CH3] 34a_200011995677_200025704644 [0,0,1,0,0,0|3,0,0]=4 1293 B11R1.83 COCc1ccc(cc1)O[13CH3] 7a_200011995677_200025704644 [0,0,1,0,0,0|3,0,0]=4 1294 B11R1.83 COc1ccc(cc1)CC#N 34a_100000198970_200000210301 [0,0,1,0,0,0|1,0,2]=4 1295 B11R1.83 COc1ccc(cc1)CC#N 7a_100000198970_200000210301 [0,0,1,0,0,0|1,0,2]=4 1296 B11R1.83 COc1ccc(cc1)CCBr 34a_100009816426_200000210301 [0,0,1,0,0,0|2,0,1]=4 1297 B11R1.83 COc1ccc(cc1)CCBr 7a_100009816426_200000210301 [0,0,1,0,0,0|2,0,1]=4 1298 B11R1.83 COc1ccc(cc1)CCN 34a_100000743037_200000210301 [0,0,1,0,0,0|1,0,1]=3 1299 B11R1.83 COc1ccc(cc1)CCO 34a_100011215338_200000210301 [0,0,1,0,0,0|2,0,1]=4 1300 B11R1.83 COc1ccc(cc1)CCO 7a_100011215338_200000210301 [0,0,1,0,0,0|2,0,1]=4 1301 B11R1.83 COc1ccc(cc1)CN[13CH3] 34a_100000185587_200025704644 [0,0,1,0,0,0|3,0,0]=4 1302 B11R1.83 COc1ccc(cc1)CO[13CH3] 34a_100000173359_200025704644 [0,0,1,0,0,0|3,0,0]=4 1303 B11R1.83 COc1ccc(cc1)CSC 62a_200000210301_100000742318 [0,0,1,0,0,0|3,0,0]=4 1304 B11R1.83 COc1ccc(cc1)CS[13CH3] 62a_200025704644_100000742318 [0,0,1,0,0,0|3,0,0]=4 1305 B11R1.83 COc1ccc(cc1)NCF 34a_100000184247_100015361967 [0,0,1,0,0,0|1,0,2]=4 1306 B11R1.83 COc1ccc(cc1)OCF 34a_100000210503_100015361967 [0,0,1,0,0,0|2,0,1]=4 1307 B11R1.83 COc1ccc(cc1)SCF 62a_100015361967_100000171711 [0,0,1,0,0,0|2,0,1]=4 1308 B11R1.83 CSc1ccc(cc1)/C=C/Br 62a_200000210301_200016255901 [0,0,1,0,0,0|2,1,0]=4 1309 B11R1.83 CSc1ccc(cc1)/C=C/Br 62a_200016255901_200000210301 [0,0,1,0,0,0|2,1,0]=4 1310 B11R1.83 CSc1ccc(cc1)CC=O 62a_100011361690_200000210301 [0,0,1,0,0,0|2,1,0]=4 1311 B11R1.83 CSc1ccc(cc1)CC=O 62a_200000210301_100011361690 [0,0,1,0,0,0|2,1,0]=4 1312 B11R1.83 CSc1ccc(cc1)CCN 62a_100000755846_200000210301 [0,0,1,0,0,0|1,1,1]=4 1313 B11R1.83 CSc1ccc(cc1)CCN 62a_200000210301_100000755846 [0,0,1,0,0,0|1,1,1]=4 1314 B11R1.83 CSc1ccc(cc1)CNN 62a_100016993955_200000210301 [0,0,1,0,0,0|2,1,0]=4 1315 B11R1.83 CSc1ccc(cc1)CNN 62a_200000210301_100016993955 [0,0,1,0,0,0|2,1,0]=4 1316 B11R1.83 CSc1ccc(cc1)N=[N+]=[N-] 62a_200000210301_100000735661 [0,0,1,0,0,0|1,1,1]=4 1317 B11R1.83 [13CH3]Nc1ccc(cc1)N=[N+]=[N-] 2230a_100000032754_200025704644 [0,0,1,0,0,0|2,0,1]=4 1318 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 34a_100000198970_200025704644 [0,0,1,0,0,0|1,0,2]=4 1319 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 7a_100000198970_200025704644 [0,0,1,0,0,0|1,0,2]=4 1320 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 34a_100009816426_200025704644 [0,0,1,0,0,0|2,0,1]=4 1321 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 7a_100009816426_200025704644 [0,0,1,0,0,0|2,0,1]=4 1322 B11R1.83 [13CH3]Oc1ccc(cc1)CCN 34a_100000743037_200025704644 [0,0,1,0,0,0|1,0,1]=3 1323 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 34a_100011215338_200025704644 [0,0,1,0,0,0|2,0,1]=4 1324 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 7a_100011215338_200025704644 [0,0,1,0,0,0|2,0,1]=4 1325 B11R1.83 [13CH3]Sc1ccc(cc1)/C=C/Br 62a_200016255901_200025704644 [0,0,1,0,0,0|2,1,0]=4 1326 B11R1.83 [13CH3]Sc1ccc(cc1)/C=C/Br 62a_200025704644_200016255901 [0,0,1,0,0,0|2,1,0]=4 1327 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_100011361690_200025704644 [0,0,1,0,0,0|2,1,0]=4 1328 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_200025704644_100011361690 [0,0,1,0,0,0|2,1,0]=4 1329 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_100000755846_200025704644 [0,0,1,0,0,0|1,1,1]=4 1330 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_200025704644_100000755846 [0,0,1,0,0,0|1,1,1]=4 1331 B11R1.83 [13CH3]Sc1ccc(cc1)CNN 62a_100016993955_200025704644 [0,0,1,0,0,0|2,1,0]=4 1332 B11R1.83 [13CH3]Sc1ccc(cc1)CNN 62a_200025704644_100016993955 [0,0,1,0,0,0|2,1,0]=4 1333 B11R1.83 [13CH3]Sc1ccc(cc1)N=[N+]=[N-] 62a_200025704644_100000735661 [0,0,1,0,0,0|1,1,1]=4 1334 B11R1.180 CCCC=Cc1nc[nH]c1C 271570a_100016258520_100009816806 [0,0,1,0,0,0|1,0,2]=4 1335 B11R1.180 CCOC=Cc1nc[nH]c1C 271570a_100016256518_100009816806 [0,0,1,0,0,0|2,0,1]=4 1336 B11R1.180 COCC=Cc1nc[nH]c1C 271570a_100016286323_100009816806 [0,0,1,0,0,0|0,0,2]=3 1337 B11R1.180 COCC=Cc1ncsc1C 271570a_100016286323_100000732656 [0,0,1,0,0,0|1,0,2]=4 1338 B11R1.189 C=C=Cc1cccc(c1)OC 271570a_100015277604_100000170001 [0,0,1,0,0,0|2,0,1]=4 1339 B11R1.189 C=CCc1cccc(c1)SC 62a_100009816576_200000210301 [0,0,1,0,0,0|2,1,0]=4 1340 B11R1.189 C=CCc1cccc(c1)SC 62a_200000210301_100009816576 [0,0,1,0,0,0|2,1,0]=4 1341 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_100009816576_200025704644 [0,0,1,0,0,0|2,1,0]=4 1342 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_200025704644_100009816576 [0,0,1,0,0,0|2,1,0]=4 1343 B11R1.189 CC=Cc1cc(ccn1)OC 271570a_100016259895_100011216251 [0,0,1,0,0,0|3,0,0]=4 1344 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [0,0,1,0,0,0|3,0,0]=4 1345 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [0,0,1,0,0,0|3,0,0]=4 1346 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [0,0,1,0,0,0|2,0,0]=3 1347 B11R1.189 CC=Cc1cccc(c1)SC 271570a_100016259895_100011215954 [0,0,1,0,0,0|2,1,0]=4 1348 B11R1.189 CC=Cc1cccc(n1)OC 271570a_100016259895_100000760917 [0,0,1,0,0,0|3,0,0]=4 1349 B11R1.189 CC=Cc1ccnc(c1)OC 271570a_100016259895_100000117307 [0,0,1,0,0,0|3,0,0]=4 1350 B11R1.189 CC=Cc1cncc(c1)OC 271570a_100016259895_100000684773 [0,0,1,0,0,0|3,0,0]=4 1351 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [0,0,1,0,0,0|2,0,1]=4 1352 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [0,0,1,0,0,0|2,0,1]=4 1353 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [0,0,1,0,0,0|2,0,1]=4 1354 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [0,0,1,0,0,0|2,0,1]=4 1355 B11R1.189 CCNc1cccc(c1)CC 2230a_100000211250_100000210202 [0,0,1,0,0,0|2,0,1]=4 1356 B11R1.189 CCNc1cccc(c1)CC 34a_100000211250_100000210202 [0,0,1,0,0,0|2,0,1]=4 1357 B11R1.189 CCNc1cccc(c1)CC 7a_100000211250_100000210202 [0,0,1,0,0,0|2,0,1]=4 1358 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [0,0,1,0,0,0|1,0,1]=3 1359 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [0,0,1,0,0,0|1,0,1]=3 1360 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [0,0,1,0,0,0|1,0,1]=3 1361 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [0,0,1,0,0,0|1,0,1]=3 1362 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [0,0,1,0,0,0|1,0,1]=3 1363 B11R1.189 CCNc1cccc(c1)SC 2230a_100000210049_100000210202 [0,0,1,0,0,0|1,1,1]=4 1364 B11R1.189 CCNc1cccc(c1)SC 34a_100000210049_100000210202 [0,0,1,0,0,0|1,1,1]=4 1365 B11R1.189 CCNc1cccc(c1)SC 62a_200000210301_100000738899 [0,0,1,0,0,0|1,1,1]=4 1366 B11R1.189 CCNc1cccc(c1)S[13CH3] 62a_200025704644_100000738899 [0,0,1,0,0,0|1,1,1]=4 1367 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [0,0,1,0,0,0|2,0,1]=4 1368 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [0,0,1,0,0,0|2,0,1]=4 1369 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [0,0,1,0,0,0|2,0,1]=4 1370 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [0,0,1,0,0,0|2,0,1]=4 1371 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [0,0,1,0,0,0|2,0,1]=4 1372 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [0,0,1,0,0,0|2,0,1]=4 1373 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [0,0,1,0,0,0|2,0,1]=4 1374 B11R1.189 CCc1cccc(c1)NCF 34a_100000211250_100015361967 [0,0,1,0,0,0|2,0,1]=4 1375 B11R1.189 CCc1cccc(c1)NCF 7a_100000211250_100015361967 [0,0,1,0,0,0|2,0,1]=4 1376 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [0,0,1,0,0,0|3,0,0]=4 1377 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [0,0,1,0,0,0|3,0,0]=4 1378 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [0,0,1,0,0,0|3,0,0]=4 1379 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [0,0,1,0,0,0|3,0,0]=4 1380 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [0,0,1,0,0,0|3,0,0]=4 1381 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [0,0,1,0,0,0|3,0,0]=4 1382 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [0,0,1,0,0,0|3,0,0]=4 1383 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [0,0,1,0,0,0|3,0,0]=4 1384 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [0,0,1,0,0,0|3,0,0]=4 1385 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [0,0,1,0,0,0|3,0,0]=4 1386 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [0,0,1,0,0,0|3,0,0]=4 1387 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [0,0,1,0,0,0|3,0,0]=4 1388 B11R1.189 COc1cccc(c1)CC#N 7a_100000696680_200000210301 [0,0,1,0,0,0|1,0,2]=4 1389 B11R1.189 COc1cccc(c1)CCN 34a_100000747277_200000210301 [0,0,1,0,0,0|1,0,2]=4 1390 B11R1.189 COc1cccc(c1)CCO 34a_100011215281_200000210301 [0,0,1,0,0,0|2,0,1]=4 1391 B11R1.189 COc1cccc(c1)CCO 7a_100011215281_200000210301 [0,0,1,0,0,0|2,0,1]=4 1392 B11R1.189 COc1cccc(c1)CNN 34a_100000008902_200000210301 [0,0,1,0,0,0|2,0,1]=4 1393 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [0,0,1,0,0,0|3,0,0]=4 1394 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [0,0,1,0,0,0|3,0,0]=4 1395 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [0,0,1,0,0,0|3,0,0]=4 1396 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [0,0,1,0,0,0|3,0,0]=4 1397 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [0,0,1,0,0,0|3,0,0]=4 1398 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [0,0,1,0,0,0|3,0,0]=4 1399 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [0,0,1,0,0,0|3,0,0]=4 1400 B11R1.189 COc1cccc(c1)NCF 34a_100000210024_100015361967 [0,0,1,0,0,0|1,0,1]=3 1401 B11R1.189 COc1cccc(c1)OCF 34a_100000211255_100015361967 [0,0,1,0,0,0|2,0,1]=4 1402 B11R1.189 COc1cccc(c1)OCF 7a_100000211255_100015361967 [0,0,1,0,0,0|2,0,1]=4 1403 B11R1.189 COc1cccc(c1)SCF 62a_100015361967_100000170001 [0,0,1,0,0,0|2,0,1]=4 1404 B11R1.189 CSc1cccc(c1)CC=O 62a_200000210301_200000698211 [0,0,1,0,0,0|2,1,0]=4 1405 B11R1.189 CSc1cccc(c1)CC=O 62a_200000698211_200000210301 [0,0,1,0,0,0|2,1,0]=4 1406 B11R1.189 CSc1cccc(c1)NC#N 62a_200000210301_100011685342 [0,0,1,0,0,0|0,1,2]=4 1407 B11R1.189 CSc1cccc(c1)NCF 34a_100000210049_100015361967 [0,0,1,0,0,0|1,1,1]=4 1408 B11R1.189 [13CH3]Oc1cccc(c1)CC#N 7a_100000696680_200025704644 [0,0,1,0,0,0|1,0,2]=4 1409 B11R1.189 [13CH3]Oc1cccc(c1)CCN 34a_100000747277_200025704644 [0,0,1,0,0,0|1,0,2]=4 1410 B11R1.189 [13CH3]Oc1cccc(c1)CCO 34a_100011215281_200025704644 [0,0,1,0,0,0|2,0,1]=4 1411 B11R1.189 [13CH3]Oc1cccc(c1)CCO 7a_100011215281_200025704644 [0,0,1,0,0,0|2,0,1]=4 1412 B11R1.189 [13CH3]Oc1cccc(c1)CNN 34a_100000008902_200025704644 [0,0,1,0,0,0|2,0,1]=4 1413 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200000698211_200025704644 [0,0,1,0,0,0|2,1,0]=4 1414 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200025704644_200000698211 [0,0,1,0,0,0|2,1,0]=4 1415 B11R1.189 [13CH3]Sc1cccc(c1)NC#N 62a_200025704644_100011685342 [0,0,1,0,0,0|0,1,2]=4 1416 B11R1.279 C=Cc1ccc(cc1Br)CC 271570a_100011290941_200009997437 [0,0,1,0,0,0|3,0,0]=4 1417 B11R1.279 C=Cc1ccc(cc1Br)OC 271570a_100011290941_100012349170 [0,0,1,0,0,0|2,0,0]=3 1418 B11R1.279 C=Cc1ccc(cc1C)NC 271570a_100011290941_100102888905 [0,0,1,0,0,0|3,0,0]=4 1419 B11R1.279 C=Cc1ccc(cc1C)OC 271570a_100011290941_100000759875 [0,0,1,0,0,0|2,0,0]=3 1420 B11R1.279 C=Cc1ccc(cc1F)CC 271570a_100011290941_200010339503 [0,0,1,0,0,0|3,0,0]=4 1421 B11R1.279 C=Cc1ccc(cc1F)NC 271570a_100011290941_100012285320 [0,0,1,0,0,0|3,0,0]=4 1422 B11R1.279 C=Cc1ccc(cc1F)OC 271570a_100011290941_100000753793 [0,0,1,0,0,0|2,0,0]=3 1423 B11R1.279 C=Cc1ccc(cc1F)SC 271570a_100011290941_100009816902 [0,0,1,0,0,0|2,1,0]=4 1424 B11R1.279 C=Cc1ccc(cc1F)SC 62a_100011935271_200000210301 [0,0,1,0,0,0|2,1,0]=4 1425 B11R1.279 C=Cc1ccc(cc1F)SC 62a_200000210301_100011935271 [0,0,1,0,0,0|2,1,0]=4 1426 B11R1.279 C=Cc1ccc(cc1F)S[13CH3] 62a_100011935271_200025704644 [0,0,1,0,0,0|2,1,0]=4 1427 B11R1.279 C=Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100011935271 [0,0,1,0,0,0|2,1,0]=4 1428 B11R1.279 C=Cc1ccc(cc1N)C#N 271570a_100011290941_100012001879 [0,0,1,0,0,0|3,0,0]=4 1429 B11R1.279 C=Cc1ccc(cc1N)CO 271570a_100011290941_100012347568 [0,0,1,0,0,0|3,0,0]=4 1430 B11R1.279 C=Cc1ccc(cc1N)OC 271570a_100011290941_100000748021 [0,0,1,0,0,0|1,0,0]=2 1431 B11R1.279 C=Cc1ccc(cc1O)OC 271570a_100011290941_100000719091 [0,0,1,0,0,0|2,0,0]=3 1432 B11R1.279 C=Cc1ccc(nc1C)OC 271570a_100011290941_100000766551 [0,0,1,0,0,0|3,0,0]=4 1433 B11R1.279 C=Cc1ccc(nc1F)OC 271570a_100011290941_100010067559 [0,0,1,0,0,0|3,0,0]=4 1434 B11R1.279 C=Cc1ccc(nc1N)OC 271570a_100011290941_100010187629 [0,0,1,0,0,0|2,0,0]=3 1435 B11R1.279 C=Cc1cnc(cc1C)OC 271570a_100011290941_100011934368 [0,0,1,0,0,0|3,0,0]=4 1436 B11R1.279 C=Cc1cnc(cc1F)OC 271570a_100011290941_100010136277 [0,0,1,0,0,0|3,0,0]=4 1437 B11R1.279 C=Cc1cnc(cc1N)OC 271570a_100011290941_100010254562 [0,0,1,0,0,0|2,0,0]=3 1438 B11R1.279 C=Cc1cnc(cc1O)OC 271570a_100011290941_100010738159 [0,0,1,0,0,0|3,0,0]=4 1439 B11R1.279 C=Cc1cnc(nc1N)OC 271570a_100011290941_100010218985 [0,0,1,0,0,0|3,0,0]=4 1440 B11R1.279 C=Cc1ncc(cc1C)OC 271570a_100011290941_200009851512 [0,0,1,0,0,0|3,0,0]=4 1441 B11R1.279 C=Cc1ncc(cc1N)OC 271570a_100011290941_100010074831 [0,0,1,0,0,0|2,0,0]=3 1442 B11R1.279 C=Cc1ncc(nc1N)OC 271570a_100011290941_100009955223 [0,0,1,0,0,0|3,0,0]=4 1443 B11R1.279 CCc1ccc(c(c1)N)OC 34a_100000765835_200000210301 [0,0,1,0,0,0|2,0,1]=4 1444 B11R1.279 CCc1ccc(c(c1)N)OC 7a_100000765835_200000210301 [0,0,1,0,0,0|2,0,1]=4 1445 B11R1.279 CCc1ccc(c(c1)N)O[13CH3] 34a_100000765835_200025704644 [0,0,1,0,0,0|2,0,1]=4 1446 B11R1.279 CCc1ccc(c(c1)N)O[13CH3] 7a_100000765835_200025704644 [0,0,1,0,0,0|2,0,1]=4 1447 B11R1.279 CCc1ccc(cc1Cl)OC 34a_100009886192_200000210301 [0,0,1,0,0,0|2,0,1]=4 1448 B11R1.279 CCc1ccc(cc1Cl)OC 7a_100009886192_200000210301 [0,0,1,0,0,0|2,0,1]=4 1449 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 34a_100009886192_200025704644 [0,0,1,0,0,0|2,0,1]=4 1450 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 7a_100009886192_200025704644 [0,0,1,0,0,0|2,0,1]=4 1451 B11R1.279 CCc1ccc(cc1N)SC 62a_100012354963_200000210301 [0,0,1,0,0,0|1,1,1]=4 1452 B11R1.279 CCc1ccc(cc1N)SC 62a_200000210301_100012354963 [0,0,1,0,0,0|1,1,1]=4 1453 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_100012354963_200025704644 [0,0,1,0,0,0|1,1,1]=4 1454 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_200025704644_100012354963 [0,0,1,0,0,0|1,1,1]=4 1455 B11R1.279 CNc1ccc(cc1Br)OC 34a_100015195136_200000210301 [0,0,1,0,0,0|1,0,2]=4 1456 B11R1.279 CNc1ccc(cc1C)OC 34a_100000750285_200000210301 [0,0,1,0,0,0|1,0,2]=4 1457 B11R1.279 CNc1ccc(cc1C)OC 34a_100161107805_200000210301 [0,0,1,0,0,0|1,0,2]=4 1458 B11R1.279 CNc1ccc(cc1C)OC 7a_100161107805_200000210301 [0,0,1,0,0,0|1,0,2]=4 1459 B11R1.279 CNc1ccc(cc1C)O[13CH3] 34a_100161107805_200025704644 [0,0,1,0,0,0|1,0,2]=4 1460 B11R1.279 CNc1ccc(cc1C)O[13CH3] 7a_100161107805_200025704644 [0,0,1,0,0,0|1,0,2]=4 1461 B11R1.279 CNc1ccc(cc1Cl)OC 34a_100000747055_200000210301 [0,0,1,0,0,0|1,0,2]=4 1462 B11R1.279 CNc1ccc(cc1F)OC 34a_100011299463_200000210301 [0,0,1,0,0,0|1,0,2]=4 1463 B11R1.279 CNc1ccc(cc1I)OC 34a_100000049804_200000210301 [0,0,1,0,0,0|1,0,2]=4 1464 B11R1.279 CNc1ccc(cc1N)SC 62a_100000741790_200000210301 [0,0,1,0,0,0|0,1,2]=4 1465 B11R1.279 CNc1ccc(cc1N)S[13CH3] 62a_100000741790_200025704644 [0,0,1,0,0,0|0,1,2]=4 1466 B11R1.279 CNc1ccc(cc1O)OC 34a_100016989039_200000210301 [0,0,1,0,0,0|1,0,2]=4 1467 B11R1.279 COc1cc(c(cn1)SC)N 62a_100010254562_200000210301 [0,0,1,0,0,0|2,0,1]=4 1468 B11R1.279 COc1cc(c(cn1)SC)N 62a_200000210301_100010254562 [0,0,1,0,0,0|2,0,1]=4 1469 B11R1.279 COc1cc(c(cn1)S[13CH3])N 62a_100010254562_200025704644 [0,0,1,0,0,0|2,0,1]=4 1470 B11R1.279 COc1cc(c(cn1)S[13CH3])N 62a_200025704644_100010254562 [0,0,1,0,0,0|2,0,1]=4 1471 B11R1.279 COc1ccc(c(c1)Br)C#N 34a_100012184851_200000210301 [0,0,1,0,0,0|3,0,0]=4 1472 B11R1.279 COc1ccc(c(c1)Br)C#N 7a_100012184851_200000210301 [0,0,1,0,0,0|3,0,0]=4 1473 B11R1.279 COc1ccc(c(c1)Br)CO 34a_100010146404_200000210301 [0,0,1,0,0,0|3,0,0]=4 1474 B11R1.279 COc1ccc(c(c1)Br)CO 7a_100010146404_200000210301 [0,0,1,0,0,0|3,0,0]=4 1475 B11R1.279 COc1ccc(c(c1)Br)N[13CH3] 34a_100015195136_200025704644 [0,0,1,0,0,0|1,0,2]=4 1476 B11R1.279 COc1ccc(c(c1)Br)OC 34a_100000685887_200000210301 [0,0,1,0,0,0|2,0,1]=4 1477 B11R1.279 COc1ccc(c(c1)Br)OC 34a_100010234764_200000210301 [0,0,1,0,0,0|2,0,1]=4 1478 B11R1.279 COc1ccc(c(c1)Br)OC 7a_100000685887_200000210301 [0,0,1,0,0,0|2,0,1]=4 1479 B11R1.279 COc1ccc(c(c1)Br)OC 7a_100010234764_200000210301 [0,0,1,0,0,0|2,0,1]=4 1480 B11R1.279 COc1ccc(c(c1)Br)O[13CH3] 34a_100000685887_200025704644 [0,0,1,0,0,0|2,0,1]=4 1481 B11R1.279 COc1ccc(c(c1)Br)O[13CH3] 7a_100000685887_200025704644 [0,0,1,0,0,0|2,0,1]=4 1482 B11R1.279 COc1ccc(c(c1)Br)SC 62a_100012349170_200000210301 [0,0,1,0,0,0|2,0,1]=4 1483 B11R1.279 COc1ccc(c(c1)Br)SC 62a_200000210301_100012349170 [0,0,1,0,0,0|2,0,1]=4 1484 B11R1.279 COc1ccc(c(c1)Br)S[13CH3] 62a_100012349170_200025704644 [0,0,1,0,0,0|2,0,1]=4 1485 B11R1.279 COc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100012349170 [0,0,1,0,0,0|2,0,1]=4 1486 B11R1.279 COc1ccc(c(c1)C)C#N 34a_100000720286_200000210301 [0,0,1,0,0,0|3,0,0]=4 1487 B11R1.279 COc1ccc(c(c1)C)C#N 7a_100000720286_200000210301 [0,0,1,0,0,0|3,0,0]=4 1488 B11R1.279 COc1ccc(c(c1)C)N[13CH3] 34a_100000750285_200025704644 [0,0,1,0,0,0|1,0,2]=4 1489 B11R1.279 COc1ccc(c(c1)C)OC 34a_100000759738_200000210301 [0,0,1,0,0,0|2,0,1]=4 1490 B11R1.279 COc1ccc(c(c1)C)OC 34a_100012002223_200000210301 [0,0,1,0,0,0|2,0,1]=4 1491 B11R1.279 COc1ccc(c(c1)C)OC 7a_100000759738_200000210301 [0,0,1,0,0,0|2,0,1]=4 1492 B11R1.279 COc1ccc(c(c1)C)OC 7a_100012002223_200000210301 [0,0,1,0,0,0|2,0,1]=4 1493 B11R1.279 COc1ccc(c(c1)C)O[13CH3] 34a_100012002223_200025704644 [0,0,1,0,0,0|2,0,1]=4 1494 B11R1.279 COc1ccc(c(c1)C)O[13CH3] 7a_100012002223_200025704644 [0,0,1,0,0,0|2,0,1]=4 1495 B11R1.279 COc1ccc(c(c1)C)SC 34a_100000030144_200000210301 [0,0,1,0,0,0|2,0,1]=4 1496 B11R1.279 COc1ccc(c(c1)C)SC 62a_100000759875_200000210301 [0,0,1,0,0,0|2,0,1]=4 1497 B11R1.279 COc1ccc(c(c1)C)SC 62a_200000210301_100000759875 [0,0,1,0,0,0|2,0,1]=4 1498 B11R1.279 COc1ccc(c(c1)C)S[13CH3] 62a_100000759875_200025704644 [0,0,1,0,0,0|2,0,1]=4 1499 B11R1.279 COc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000759875 [0,0,1,0,0,0|2,0,1]=4 1500 B11R1.279 COc1ccc(c(c1)Cl)C#N 34a_100000716493_200000210301 [0,0,1,0,0,0|3,0,0]=4 1501 B11R1.279 COc1ccc(c(c1)Cl)C#N 7a_100000716493_200000210301 [0,0,1,0,0,0|3,0,0]=4 1502 B11R1.279 COc1ccc(c(c1)Cl)CN 34a_200161156549_200000210301 [0,0,1,0,0,0|3,0,0]=4 1503 B11R1.279 COc1ccc(c(c1)Cl)CO 34a_200000075811_200000210301 [0,0,1,0,0,0|3,0,0]=4 1504 B11R1.279 COc1ccc(c(c1)Cl)CO 7a_200000075811_200000210301 [0,0,1,0,0,0|3,0,0]=4 1505 B11R1.279 COc1ccc(c(c1)Cl)N[13CH3] 34a_100000747055_200025704644 [0,0,1,0,0,0|1,0,2]=4 1506 B11R1.279 COc1ccc(c(c1)Cl)OC 34a_100000038596_200000210301 [0,0,1,0,0,0|2,0,1]=4 1507 B11R1.279 COc1ccc(c(c1)Cl)OC 34a_200009861682_200000210301 [0,0,1,0,0,0|2,0,1]=4 1508 B11R1.279 COc1ccc(c(c1)Cl)OC 7a_100000038596_200000210301 [0,0,1,0,0,0|2,0,1]=4 1509 B11R1.279 COc1ccc(c(c1)Cl)OC 7a_200009861682_200000210301 [0,0,1,0,0,0|2,0,1]=4 1510 B11R1.279 COc1ccc(c(c1)Cl)O[13CH3] 34a_100000038596_200025704644 [0,0,1,0,0,0|2,0,1]=4 1511 B11R1.279 COc1ccc(c(c1)Cl)O[13CH3] 7a_100000038596_200025704644 [0,0,1,0,0,0|2,0,1]=4 1512 B11R1.279 COc1ccc(c(c1)F)C#N 34a_100000753931_200000210301 [0,0,1,0,0,0|3,0,0]=4 1513 B11R1.279 COc1ccc(c(c1)F)C#N 7a_100000753931_200000210301 [0,0,1,0,0,0|3,0,0]=4 1514 B11R1.279 COc1ccc(c(c1)F)CO 34a_100000084598_200000210301 [0,0,1,0,0,0|3,0,0]=4 1515 B11R1.279 COc1ccc(c(c1)F)CO 7a_100000084598_200000210301 [0,0,1,0,0,0|3,0,0]=4 1516 B11R1.279 COc1ccc(c(c1)F)N[13CH3] 34a_100011299463_200025704644 [0,0,1,0,0,0|1,0,2]=4 1517 B11R1.279 COc1ccc(c(c1)F)OC 34a_100000036999_200000210301 [0,0,1,0,0,0|2,0,1]=4 1518 B11R1.279 COc1ccc(c(c1)F)OC 34a_100000746305_200000210301 [0,0,1,0,0,0|2,0,1]=4 1519 B11R1.279 COc1ccc(c(c1)F)OC 7a_100000036999_200000210301 [0,0,1,0,0,0|2,0,1]=4 1520 B11R1.279 COc1ccc(c(c1)F)OC 7a_100000746305_200000210301 [0,0,1,0,0,0|2,0,1]=4 1521 B11R1.279 COc1ccc(c(c1)F)O[13CH3] 34a_100000036999_200025704644 [0,0,1,0,0,0|2,0,1]=4 1522 B11R1.279 COc1ccc(c(c1)F)O[13CH3] 7a_100000036999_200025704644 [0,0,1,0,0,0|2,0,1]=4 1523 B11R1.279 COc1ccc(c(c1)F)SC 62a_100000753793_200000210301 [0,0,1,0,0,0|2,0,1]=4 1524 B11R1.279 COc1ccc(c(c1)F)SC 62a_200000210301_100000753793 [0,0,1,0,0,0|2,0,1]=4 1525 B11R1.279 COc1ccc(c(c1)F)S[13CH3] 62a_100000753793_200025704644 [0,0,1,0,0,0|2,0,1]=4 1526 B11R1.279 COc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000753793 [0,0,1,0,0,0|2,0,1]=4 1527 B11R1.279 COc1ccc(c(c1)I)N[13CH3] 34a_100000049804_200025704644 [0,0,1,0,0,0|1,0,2]=4 1528 B11R1.279 COc1ccc(c(c1)I)OC 34a_100010084122_200000210301 [0,0,1,0,0,0|2,0,1]=4 1529 B11R1.279 COc1ccc(c(c1)I)OC 7a_100010084122_200000210301 [0,0,1,0,0,0|2,0,1]=4 1530 B11R1.279 COc1ccc(c(c1)N)OC 34a_100000188146_200000210301 [0,0,1,0,0,0|1,0,1]=3 1531 B11R1.279 COc1ccc(c(c1)N)O[13CH3] 34a_100000188146_200025704644 [0,0,1,0,0,0|1,0,1]=3 1532 B11R1.279 COc1ccc(c(c1)N)SC 62a_100000748021_200000210301 [0,0,1,0,0,0|1,0,1]=3 1533 B11R1.279 COc1ccc(c(c1)N)SC 62a_200000210301_100000748021 [0,0,1,0,0,0|1,0,1]=3 1534 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_100000748021_200025704644 [0,0,1,0,0,0|1,0,1]=3 1535 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100000748021 [0,0,1,0,0,0|1,0,1]=3 1536 B11R1.279 COc1ccc(c(c1)O)C#N 271570a_203496583355_100012355471 [0,0,1,0,0,0|3,0,0]=4 1537 B11R1.279 COc1ccc(c(c1)O)C=O 271570a_203496583355_100000723261 [0,0,1,0,0,0|3,0,0]=4 1538 B11R1.279 COc1ccc(c(c1)O)CO 271570a_203496583355_100011982768 [0,0,1,0,0,0|3,0,0]=4 1539 B11R1.279 COc1ccc(c(c1)O)N[13CH3] 34a_100016989039_200025704644 [0,0,1,0,0,0|1,0,2]=4 1540 B11R1.279 COc1ccc(c(c1)O)OC 271570a_203496583355_100011215452 [0,0,1,0,0,0|2,0,1]=4 1541 B11R1.279 COc1ccc(c(c1)O)SC 62a_200000210301_100000719091 [0,0,1,0,0,0|2,0,1]=4 1542 B11R1.279 COc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100000719091 [0,0,1,0,0,0|2,0,1]=4 1543 B11R1.279 COc1ccc(c(n1)N)SC 62a_100010187629_200000210301 [0,0,1,0,0,0|2,0,1]=4 1544 B11R1.279 COc1ccc(c(n1)N)S[13CH3] 62a_100010187629_200025704644 [0,0,1,0,0,0|2,0,1]=4 1545 B11R1.279 COc1ccc(cc1Br)O[13CH3] 34a_100010234764_200025704644 [0,0,1,0,0,0|2,0,1]=4 1546 B11R1.279 COc1ccc(cc1Br)O[13CH3] 7a_100010234764_200025704644 [0,0,1,0,0,0|2,0,1]=4 1547 B11R1.279 COc1ccc(cc1C)O[13CH3] 34a_100000759738_200025704644 [0,0,1,0,0,0|2,0,1]=4 1548 B11R1.279 COc1ccc(cc1C)O[13CH3] 7a_100000759738_200025704644 [0,0,1,0,0,0|2,0,1]=4 1549 B11R1.279 COc1ccc(cc1Cl)O[13CH3] 34a_200009861682_200025704644 [0,0,1,0,0,0|2,0,1]=4 1550 B11R1.279 COc1ccc(cc1Cl)O[13CH3] 7a_200009861682_200025704644 [0,0,1,0,0,0|2,0,1]=4 1551 B11R1.279 COc1ccc(cc1F)O[13CH3] 34a_100000746305_200025704644 [0,0,1,0,0,0|2,0,1]=4 1552 B11R1.279 COc1ccc(cc1F)O[13CH3] 7a_100000746305_200025704644 [0,0,1,0,0,0|2,0,1]=4 1553 B11R1.279 COc1ccc(cc1I)O[13CH3] 34a_100010084122_200025704644 [0,0,1,0,0,0|2,0,1]=4 1554 B11R1.279 COc1ccc(cc1I)O[13CH3] 7a_100010084122_200025704644 [0,0,1,0,0,0|2,0,1]=4 1555 B11R1.279 COc1ccc(cc1N)SC 62a_100011249504_200000210301 [0,0,1,0,0,0|1,1,1]=4 1556 B11R1.279 COc1ccc(cc1N)SC 62a_200000210301_100011249504 [0,0,1,0,0,0|1,1,1]=4 1557 B11R1.279 COc1ccc(cc1N)S[13CH3] 62a_100011249504_200025704644 [0,0,1,0,0,0|1,1,1]=4 1558 B11R1.279 COc1ccc(cc1N)S[13CH3] 62a_200025704644_100011249504 [0,0,1,0,0,0|1,1,1]=4 1559 B11R1.279 COc1cnc(c(c1)N)SC 62a_100010074831_200000210301 [0,0,1,0,0,0|2,0,1]=4 1560 B11R1.279 COc1cnc(c(c1)N)SC 62a_200000210301_100010074831 [0,0,1,0,0,0|2,0,1]=4 1561 B11R1.279 COc1cnc(c(c1)N)S[13CH3] 62a_100010074831_200025704644 [0,0,1,0,0,0|2,0,1]=4 1562 B11R1.279 COc1cnc(c(c1)N)S[13CH3] 62a_200025704644_100010074831 [0,0,1,0,0,0|2,0,1]=4 1563 B11R1.279 CSc1ccc(c(c1)N)C#N 62a_200000210301_100000699244 [0,0,1,0,0,0|2,1,0]=4 1564 B11R1.279 CSc1ccc(c(c1)N)C=O 62a_100009814810_200000210301 [0,0,1,0,0,0|2,1,0]=4 1565 B11R1.279 CSc1ccc(c(c1)N)CO 62a_100000718831_200000210301 [0,0,1,0,0,0|2,1,0]=4 1566 B11R1.279 CSc1ccc(c(c1)N)CO 62a_200000210301_100000718831 [0,0,1,0,0,0|2,1,0]=4 1567 B11R1.279 CSc1ccc(cc1C)O[13CH3] 34a_100000030144_200025704644 [0,0,1,0,0,0|2,0,1]=4 1568 B11R1.279 Cc1cc(ccc1C#N)O[13CH3] 34a_100000720286_200025704644 [0,0,1,0,0,0|3,0,0]=4 1569 B11R1.279 Cc1cc(ccc1C#N)O[13CH3] 7a_100000720286_200025704644 [0,0,1,0,0,0|3,0,0]=4 1570 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)C#N 34a_100012184851_200025704644 [0,0,1,0,0,0|3,0,0]=4 1571 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)C#N 7a_100012184851_200025704644 [0,0,1,0,0,0|3,0,0]=4 1572 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)CO 34a_100010146404_200025704644 [0,0,1,0,0,0|3,0,0]=4 1573 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)CO 7a_100010146404_200025704644 [0,0,1,0,0,0|3,0,0]=4 1574 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)C#N 34a_100000716493_200025704644 [0,0,1,0,0,0|3,0,0]=4 1575 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)C#N 7a_100000716493_200025704644 [0,0,1,0,0,0|3,0,0]=4 1576 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CN 34a_200161156549_200025704644 [0,0,1,0,0,0|3,0,0]=4 1577 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CO 34a_200000075811_200025704644 [0,0,1,0,0,0|3,0,0]=4 1578 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CO 7a_200000075811_200025704644 [0,0,1,0,0,0|3,0,0]=4 1579 B11R1.279 [13CH3]Oc1ccc(c(c1)F)C#N 34a_100000753931_200025704644 [0,0,1,0,0,0|3,0,0]=4 1580 B11R1.279 [13CH3]Oc1ccc(c(c1)F)C#N 7a_100000753931_200025704644 [0,0,1,0,0,0|3,0,0]=4 1581 B11R1.279 [13CH3]Oc1ccc(c(c1)F)CO 34a_100000084598_200025704644 [0,0,1,0,0,0|3,0,0]=4 1582 B11R1.279 [13CH3]Oc1ccc(c(c1)F)CO 7a_100000084598_200025704644 [0,0,1,0,0,0|3,0,0]=4 1583 B11R1.279 [13CH3]Sc1ccc(c(c1)N)C#N 62a_200025704644_100000699244 [0,0,1,0,0,0|2,1,0]=4 1584 B11R1.279 [13CH3]Sc1ccc(c(c1)N)C=O 62a_100009814810_200025704644 [0,0,1,0,0,0|2,1,0]=4 1585 B11R1.279 [13CH3]Sc1ccc(c(c1)N)CO 62a_100000718831_200025704644 [0,0,1,0,0,0|2,1,0]=4 1586 B11R1.279 [13CH3]Sc1ccc(c(c1)N)CO 62a_200025704644_100000718831 [0,0,1,0,0,0|2,1,0]=4 1587 B11R1.280 C=Cc1cc(ccc1Br)OC 271570a_100011290941_100009992028 [0,0,1,0,0,0|2,0,0]=3 1588 B11R1.280 C=Cc1cc(ccc1C)NC 271570a_100011290941_100000707694 [0,0,1,0,0,0|3,0,0]=4 1589 B11R1.280 C=Cc1cc(ccc1C)OC 271570a_100011290941_100012349166 [0,0,1,0,0,0|2,0,0]=3 1590 B11R1.280 C=Cc1cc(ccc1Cl)OC 271570a_100011290941_100011356938 [0,0,1,0,0,0|2,0,0]=3 1591 B11R1.280 C=Cc1cc(ccc1F)CC 271570a_100011290941_200010244628 [0,0,1,0,0,0|3,0,0]=4 1592 B11R1.280 C=Cc1cc(ccc1F)OC 271570a_100011290941_100000699733 [0,0,1,0,0,0|2,0,0]=3 1593 B11R1.280 C=Cc1cc(ccc1F)SC 271570a_100011290941_200010708804 [0,0,1,0,0,0|2,1,0]=4 1594 B11R1.280 C=Cc1cc(ccc1F)SC 62a_100000688377_200000210301 [0,0,1,0,0,0|2,1,0]=4 1595 B11R1.280 C=Cc1cc(ccc1F)SC 62a_200000210301_100000688377 [0,0,1,0,0,0|2,1,0]=4 1596 B11R1.280 C=Cc1cc(ccc1F)S[13CH3] 62a_100000688377_200025704644 [0,0,1,0,0,0|2,1,0]=4 1597 B11R1.280 C=Cc1cc(ccc1F)S[13CH3] 62a_200025704644_100000688377 [0,0,1,0,0,0|2,1,0]=4 1598 B11R1.280 C=Cc1cc(ccc1N)CC 271570a_100011290941_100012339725 [0,0,1,0,0,0|2,0,1]=4 1599 B11R1.280 C=Cc1cc(ccc1N)OC 271570a_100011290941_100015195136 [0,0,1,0,0,0|1,0,1]=3 1600 B11R1.280 C=Cc1cc(ccc1O)CC 271570a_100011290941_100012339963 [0,0,1,0,0,0|3,0,0]=4 1601 B11R1.280 C=Cc1cc(ccc1O)OC 271570a_100011290941_100000685887 [0,0,1,0,0,0|2,0,0]=3 1602 B11R1.280 C=Cc1cc(cnc1F)OC 271570a_100011290941_100010068374 [0,0,1,0,0,0|3,0,0]=4 1603 B11R1.280 C=Cc1cc(ncc1C)OC 271570a_100011290941_100010068546 [0,0,1,0,0,0|3,0,0]=4 1604 B11R1.280 C=Cc1cc(ncc1Cl)OC 271570a_100011290941_100010068019 [0,0,1,0,0,0|3,0,0]=4 1605 B11R1.280 C=Cc1cc(ncc1F)OC 271570a_100011290941_100010160775 [0,0,1,0,0,0|3,0,0]=4 1606 B11R1.280 C=Cc1nc(ccc1N)OC 271570a_100011290941_100000069805 [0,0,1,0,0,0|2,0,1]=4 1607 B11R1.280 CCc1cc(ccc1Cl)OC 34a_100000212063_200000210301 [0,0,1,0,0,0|2,0,1]=4 1608 B11R1.280 CCc1cc(ccc1Cl)OC 7a_100000212063_200000210301 [0,0,1,0,0,0|2,0,1]=4 1609 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 34a_100000212063_200025704644 [0,0,1,0,0,0|2,0,1]=4 1610 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 7a_100000212063_200025704644 [0,0,1,0,0,0|2,0,1]=4 1611 B11R1.280 CCc1cc(ccc1O)OC 271570a_203496583355_100000720562 [0,0,1,0,0,0|2,0,1]=4 1612 B11R1.280 CCc1ccc(c(c1)NC)C 2230a_200012022522_200000210301 [0,0,1,0,0,0|2,0,1]=4 1613 B11R1.280 CCc1ccc(c(c1)NC)C 34a_200012022522_200000210301 [0,0,1,0,0,0|2,0,1]=4 1614 B11R1.280 CCc1ccc(c(c1)NC)C 7a_200012022522_200000210301 [0,0,1,0,0,0|2,0,1]=4 1615 B11R1.280 CCc1ccc(c(c1)NC)O 34a_100000765835_200000210301 [0,0,1,0,0,0|2,0,1]=4 1616 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 2230a_200012022522_200025704644 [0,0,1,0,0,0|2,0,1]=4 1617 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 34a_200012022522_200025704644 [0,0,1,0,0,0|2,0,1]=4 1618 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 7a_200012022522_200025704644 [0,0,1,0,0,0|2,0,1]=4 1619 B11R1.280 CCc1ccc(c(c1)N[13CH3])O 34a_100000765835_200025704644 [0,0,1,0,0,0|2,0,1]=4 1620 B11R1.280 CNc1cc(ccc1Br)OC 34a_100000748603_200000210301 [0,0,1,0,0,0|1,0,1]=3 1621 B11R1.280 CNc1cc(ccc1C)OC 2230a_100000760359_200000210301 [0,0,1,0,0,0|1,0,1]=3 1622 B11R1.280 CNc1cc(ccc1C)OC 34a_100000760359_200000210301 [0,0,1,0,0,0|1,0,1]=3 1623 B11R1.280 CNc1cc(ccc1C)SC 62a_100020629602_200000210301 [0,0,1,0,0,0|1,1,1]=4 1624 B11R1.280 CNc1cc(ccc1C)SC 62a_200000210301_100020629602 [0,0,1,0,0,0|1,1,1]=4 1625 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_100020629602_200025704644 [0,0,1,0,0,0|1,1,1]=4 1626 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_200025704644_100020629602 [0,0,1,0,0,0|1,1,1]=4 1627 B11R1.280 CNc1cc(ccc1Cl)OC 34a_100000745576_200000210301 [0,0,1,0,0,0|1,0,1]=3 1628 B11R1.280 CNc1cc(ccc1F)OC 34a_100000764331_200000210301 [0,0,1,0,0,0|1,0,1]=3 1629 B11R1.280 CNc1cc(ccc1F)SC 62a_100011314990_200000210301 [0,0,1,0,0,0|1,1,1]=4 1630 B11R1.280 CNc1cc(ccc1F)SC 62a_200000210301_100011314990 [0,0,1,0,0,0|1,1,1]=4 1631 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_100011314990_200025704644 [0,0,1,0,0,0|1,1,1]=4 1632 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_200025704644_100011314990 [0,0,1,0,0,0|1,1,1]=4 1633 B11R1.280 CNc1cc(ccc1I)OC 34a_100000748021_200000210301 [0,0,1,0,0,0|1,0,1]=3 1634 B11R1.280 CNc1cc(ccc1N)SC 62a_100000694363_200000210301 [0,0,1,0,0,0|0,1,2]=4 1635 B11R1.280 CNc1cc(ccc1N)S[13CH3] 62a_100000694363_200025704644 [0,0,1,0,0,0|0,1,2]=4 1636 B11R1.280 CNc1cc(ccc1O)OC 34a_100000188146_200000210301 [0,0,1,0,0,0|1,0,1]=3 1637 B11R1.280 COc1cc(ccc1Br)O[13CH3] 34a_100011827694_200025704644 [0,0,1,0,0,0|2,0,1]=4 1638 B11R1.280 COc1cc(ccc1Br)O[13CH3] 7a_100011827694_200025704644 [0,0,1,0,0,0|2,0,1]=4 1639 B11R1.280 COc1cc(ccc1C)O[13CH3] 34a_100009865632_200025704644 [0,0,1,0,0,0|2,0,1]=4 1640 B11R1.280 COc1cc(ccc1C)O[13CH3] 7a_100009865632_200025704644 [0,0,1,0,0,0|2,0,1]=4 1641 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 34a_100012186310_200025704644 [0,0,1,0,0,0|2,0,1]=4 1642 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 7a_100012186310_200025704644 [0,0,1,0,0,0|2,0,1]=4 1643 B11R1.280 COc1cc(ccc1F)O[13CH3] 34a_100012001760_200025704644 [0,0,1,0,0,0|2,0,1]=4 1644 B11R1.280 COc1cc(ccc1F)O[13CH3] 7a_100012001760_200025704644 [0,0,1,0,0,0|2,0,1]=4 1645 B11R1.280 COc1cc(ccc1N)O[13CH3] 34a_100015326901_200025704644 [0,0,1,0,0,0|1,0,2]=4 1646 B11R1.280 COc1cc(ccc1N)O[13CH3] 7a_100015326901_200025704644 [0,0,1,0,0,0|1,0,2]=4 1647 B11R1.280 COc1ccc(c(c1)C#N)Br 34a_100009818209_200000210301 [0,0,1,0,0,0|3,0,0]=4 1648 B11R1.280 COc1ccc(c(c1)C#N)Br 7a_100009818209_200000210301 [0,0,1,0,0,0|3,0,0]=4 1649 B11R1.280 COc1ccc(c(c1)C#N)Cl 34a_100000092820_200000210301 [0,0,1,0,0,0|3,0,0]=4 1650 B11R1.280 COc1ccc(c(c1)C#N)Cl 7a_100000092820_200000210301 [0,0,1,0,0,0|3,0,0]=4 1651 B11R1.280 COc1ccc(c(c1)C#N)F 34a_100000070142_200000210301 [0,0,1,0,0,0|3,0,0]=4 1652 B11R1.280 COc1ccc(c(c1)C#N)F 7a_100000070142_200000210301 [0,0,1,0,0,0|3,0,0]=4 1653 B11R1.280 COc1ccc(c(c1)C#N)N 34a_200011997737_200000210301 [0,0,1,0,0,0|2,0,1]=4 1654 B11R1.280 COc1ccc(c(c1)C#N)N 7a_200011997737_200000210301 [0,0,1,0,0,0|2,0,1]=4 1655 B11R1.280 COc1ccc(c(c1)C#N)O 271570a_203496583355_100000748272 [0,0,1,0,0,0|3,0,0]=4 1656 B11R1.280 COc1ccc(c(c1)C=O)O 271570a_203496583355_100000691568 [0,0,1,0,0,0|3,0,0]=4 1657 B11R1.280 COc1ccc(c(c1)CN)C 34a_200009844824_200000210301 [0,0,1,0,0,0|3,0,0]=4 1658 B11R1.280 COc1ccc(c(c1)CN)O 271570a_203496583355_100000741592 [0,0,1,0,0,0|3,0,0]=4 1659 B11R1.280 COc1ccc(c(c1)CO)Br 34a_100012351483_200000210301 [0,0,1,0,0,0|3,0,0]=4 1660 B11R1.280 COc1ccc(c(c1)CO)Br 7a_100012351483_200000210301 [0,0,1,0,0,0|3,0,0]=4 1661 B11R1.280 COc1ccc(c(c1)CO)C 34a_100009878257_200000210301 [0,0,1,0,0,0|3,0,0]=4 1662 B11R1.280 COc1ccc(c(c1)CO)C 7a_100009878257_200000210301 [0,0,1,0,0,0|3,0,0]=4 1663 B11R1.280 COc1ccc(c(c1)CO)Cl 34a_100000091669_200000210301 [0,0,1,0,0,0|3,0,0]=4 1664 B11R1.280 COc1ccc(c(c1)CO)Cl 7a_100000091669_200000210301 [0,0,1,0,0,0|3,0,0]=4 1665 B11R1.280 COc1ccc(c(c1)CO)O 271570a_203496583355_200011273942 [0,0,1,0,0,0|3,0,0]=4 1666 B11R1.280 COc1ccc(c(c1)N[13CH3])Br 34a_100000748603_200025704644 [0,0,1,0,0,0|1,0,1]=3 1667 B11R1.280 COc1ccc(c(c1)N[13CH3])C 2230a_100000760359_200025704644 [0,0,1,0,0,0|1,0,1]=3 1668 B11R1.280 COc1ccc(c(c1)N[13CH3])C 34a_100000760359_200025704644 [0,0,1,0,0,0|1,0,1]=3 1669 B11R1.280 COc1ccc(c(c1)N[13CH3])Cl 34a_100000745576_200025704644 [0,0,1,0,0,0|1,0,1]=3 1670 B11R1.280 COc1ccc(c(c1)N[13CH3])F 34a_100000764331_200025704644 [0,0,1,0,0,0|1,0,1]=3 1671 B11R1.280 COc1ccc(c(c1)N[13CH3])I 34a_100000748021_200025704644 [0,0,1,0,0,0|1,0,1]=3 1672 B11R1.280 COc1ccc(c(c1)N[13CH3])O 34a_100000188146_200025704644 [0,0,1,0,0,0|1,0,1]=3 1673 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100000719091_200000210301 [0,0,1,0,0,0|2,0,1]=4 1674 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100011827694_200000210301 [0,0,1,0,0,0|2,0,1]=4 1675 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100000719091_200000210301 [0,0,1,0,0,0|2,0,1]=4 1676 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100011827694_200000210301 [0,0,1,0,0,0|2,0,1]=4 1677 B11R1.280 COc1ccc(c(c1)OC)C 34a_100009865632_200000210301 [0,0,1,0,0,0|2,0,1]=4 1678 B11R1.280 COc1ccc(c(c1)OC)C 34a_100012179981_200000210301 [0,0,1,0,0,0|2,0,1]=4 1679 B11R1.280 COc1ccc(c(c1)OC)C 7a_100009865632_200000210301 [0,0,1,0,0,0|2,0,1]=4 1680 B11R1.280 COc1ccc(c(c1)OC)C 7a_100012179981_200000210301 [0,0,1,0,0,0|2,0,1]=4 1681 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100011516019_200000210301 [0,0,1,0,0,0|2,0,1]=4 1682 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100012186310_200000210301 [0,0,1,0,0,0|2,0,1]=4 1683 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100011516019_200000210301 [0,0,1,0,0,0|2,0,1]=4 1684 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100012186310_200000210301 [0,0,1,0,0,0|2,0,1]=4 1685 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012001760_200000210301 [0,0,1,0,0,0|2,0,1]=4 1686 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012178750_200000210301 [0,0,1,0,0,0|2,0,1]=4 1687 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012001760_200000210301 [0,0,1,0,0,0|2,0,1]=4 1688 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012178750_200000210301 [0,0,1,0,0,0|2,0,1]=4 1689 B11R1.280 COc1ccc(c(c1)OC)I 34a_100010168831_200000210301 [0,0,1,0,0,0|2,0,1]=4 1690 B11R1.280 COc1ccc(c(c1)OC)I 7a_100010168831_200000210301 [0,0,1,0,0,0|2,0,1]=4 1691 B11R1.280 COc1ccc(c(c1)OC)N 34a_100015326901_200000210301 [0,0,1,0,0,0|1,0,2]=4 1692 B11R1.280 COc1ccc(c(c1)OC)N 34a_100016989039_200000210301 [0,0,1,0,0,0|1,0,2]=4 1693 B11R1.280 COc1ccc(c(c1)OC)N 7a_100015326901_200000210301 [0,0,1,0,0,0|1,0,2]=4 1694 B11R1.280 COc1ccc(c(c1)OC)N 7a_100016989039_200000210301 [0,0,1,0,0,0|1,0,2]=4 1695 B11R1.280 COc1ccc(c(c1)OC)O 271570a_203496583355_100000750026 [0,0,1,0,0,0|2,0,1]=4 1696 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 34a_100000719091_200025704644 [0,0,1,0,0,0|2,0,1]=4 1697 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 7a_100000719091_200025704644 [0,0,1,0,0,0|2,0,1]=4 1698 B11R1.280 COc1ccc(c(c1)O[13CH3])C 34a_100012179981_200025704644 [0,0,1,0,0,0|2,0,1]=4 1699 B11R1.280 COc1ccc(c(c1)O[13CH3])C 7a_100012179981_200025704644 [0,0,1,0,0,0|2,0,1]=4 1700 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 34a_100011516019_200025704644 [0,0,1,0,0,0|2,0,1]=4 1701 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 7a_100011516019_200025704644 [0,0,1,0,0,0|2,0,1]=4 1702 B11R1.280 COc1ccc(c(c1)O[13CH3])F 34a_100012178750_200025704644 [0,0,1,0,0,0|2,0,1]=4 1703 B11R1.280 COc1ccc(c(c1)O[13CH3])F 7a_100012178750_200025704644 [0,0,1,0,0,0|2,0,1]=4 1704 B11R1.280 COc1ccc(c(c1)O[13CH3])I 34a_100010168831_200025704644 [0,0,1,0,0,0|2,0,1]=4 1705 B11R1.280 COc1ccc(c(c1)O[13CH3])I 7a_100010168831_200025704644 [0,0,1,0,0,0|2,0,1]=4 1706 B11R1.280 COc1ccc(c(c1)O[13CH3])N 34a_100016989039_200025704644 [0,0,1,0,0,0|1,0,2]=4 1707 B11R1.280 COc1ccc(c(c1)O[13CH3])N 7a_100016989039_200025704644 [0,0,1,0,0,0|1,0,2]=4 1708 B11R1.280 COc1ccc(c(c1)SC)Br 62a_100009992028_200000210301 [0,0,1,0,0,0|2,0,1]=4 1709 B11R1.280 COc1ccc(c(c1)SC)Br 62a_200000210301_100009992028 [0,0,1,0,0,0|2,0,1]=4 1710 B11R1.280 COc1ccc(c(c1)SC)C 62a_100012349166_200000210301 [0,0,1,0,0,0|2,0,1]=4 1711 B11R1.280 COc1ccc(c(c1)SC)C 62a_200000210301_100012349166 [0,0,1,0,0,0|2,0,1]=4 1712 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_100011356938_200000210301 [0,0,1,0,0,0|2,0,1]=4 1713 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_200000210301_100011356938 [0,0,1,0,0,0|2,0,1]=4 1714 B11R1.280 COc1ccc(c(c1)SC)F 62a_100000699733_200000210301 [0,0,1,0,0,0|2,0,1]=4 1715 B11R1.280 COc1ccc(c(c1)SC)F 62a_200000210301_100000699733 [0,0,1,0,0,0|2,0,1]=4 1716 B11R1.280 COc1ccc(c(c1)SC)N 62a_100015195136_200000210301 [0,0,1,0,0,0|1,0,2]=4 1717 B11R1.280 COc1ccc(c(c1)SC)N 62a_200000210301_100015195136 [0,0,1,0,0,0|1,0,2]=4 1718 B11R1.280 COc1ccc(c(c1)SC)O 62a_200000210301_100000685887 [0,0,1,0,0,0|2,0,1]=4 1719 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_100009992028_200025704644 [0,0,1,0,0,0|2,0,1]=4 1720 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100009992028 [0,0,1,0,0,0|2,0,1]=4 1721 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_100012349166_200025704644 [0,0,1,0,0,0|2,0,1]=4 1722 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_200025704644_100012349166 [0,0,1,0,0,0|2,0,1]=4 1723 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_100011356938_200025704644 [0,0,1,0,0,0|2,0,1]=4 1724 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011356938 [0,0,1,0,0,0|2,0,1]=4 1725 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_100000699733_200025704644 [0,0,1,0,0,0|2,0,1]=4 1726 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000699733 [0,0,1,0,0,0|2,0,1]=4 1727 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_100015195136_200025704644 [0,0,1,0,0,0|1,0,2]=4 1728 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_200025704644_100015195136 [0,0,1,0,0,0|1,0,2]=4 1729 B11R1.280 COc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000685887 [0,0,1,0,0,0|2,0,1]=4 1730 B11R1.280 CSc1ccc(c(c1)NN)F 62a_100020610843_200000210301 [0,0,1,0,0,0|2,1,0]=4 1731 B11R1.280 CSc1ccc(c(c1)NN)F 62a_200000210301_100020610843 [0,0,1,0,0,0|2,1,0]=4 1732 B11R1.280 Cc1ccc(cc1CN)O[13CH3] 34a_200009844824_200025704644 [0,0,1,0,0,0|3,0,0]=4 1733 B11R1.280 Cc1ccc(cc1CO)O[13CH3] 34a_100009878257_200025704644 [0,0,1,0,0,0|3,0,0]=4 1734 B11R1.280 Cc1ccc(cc1CO)O[13CH3] 7a_100009878257_200025704644 [0,0,1,0,0,0|3,0,0]=4 1735 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Br 34a_100009818209_200025704644 [0,0,1,0,0,0|3,0,0]=4 1736 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Br 7a_100009818209_200025704644 [0,0,1,0,0,0|3,0,0]=4 1737 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Cl 34a_100000092820_200025704644 [0,0,1,0,0,0|3,0,0]=4 1738 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Cl 7a_100000092820_200025704644 [0,0,1,0,0,0|3,0,0]=4 1739 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)F 34a_100000070142_200025704644 [0,0,1,0,0,0|3,0,0]=4 1740 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)F 7a_100000070142_200025704644 [0,0,1,0,0,0|3,0,0]=4 1741 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)N 34a_200011997737_200025704644 [0,0,1,0,0,0|2,0,1]=4 1742 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)N 7a_200011997737_200025704644 [0,0,1,0,0,0|2,0,1]=4 1743 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Br 34a_100012351483_200025704644 [0,0,1,0,0,0|3,0,0]=4 1744 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Br 7a_100012351483_200025704644 [0,0,1,0,0,0|3,0,0]=4 1745 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Cl 34a_100000091669_200025704644 [0,0,1,0,0,0|3,0,0]=4 1746 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Cl 7a_100000091669_200025704644 [0,0,1,0,0,0|3,0,0]=4 1747 B11R1.280 [13CH3]Sc1ccc(c(c1)NN)F 62a_100020610843_200025704644 [0,0,1,0,0,0|2,1,0]=4 1748 B11R1.280 [13CH3]Sc1ccc(c(c1)NN)F 62a_200025704644_100020610843 [0,0,1,0,0,0|2,1,0]=4 1749 B11R2.190 CSc1ccc2c(c1)CC2 62a_100009818592_200000210301 [0,0,0,0,1,0|1,1,1]=4 1750 B11R2.190 CSc1ccc2c(c1)CC2 62a_200000210301_100009818592 [0,0,0,0,1,0|1,1,1]=4 1751 B11R2.190 [13CH3]Sc1ccc2c(c1)CC2 62a_100009818592_200025704644 [0,0,0,0,1,0|1,1,1]=4 1752 B11R2.190 [13CH3]Sc1ccc2c(c1)CC2 62a_200025704644_100009818592 [0,0,0,0,1,0|1,1,1]=4 1753 B13R2.57 C=Cc1ccc2cnccc2c1 271570a_100011290941_100009816743 [0,0,0,0,0,1|2,0,1]=4 1754 B13R2.57 C=Cc1ccc2cncnc2c1 271570a_100011290941_100010185614 [0,0,0,0,0,1|1,0,2]=4 1755 B13R2.57 C=Cc1ccc2ncccc2c1 271570a_100011290941_100000754243 [0,0,0,0,0,1|2,0,1]=4 1756 B13R2.57 C=Cc1ccc2nccnc2c1 271570a_100011290941_100011219451 [0,0,0,0,0,1|1,0,2]=4 1757 B13R2.57 C=Cc1ccc2ncncc2c1 271570a_100011290941_100009989443 [0,0,0,0,0,1|1,0,2]=4 1758 B13R2.57 C=Cc1ccc2nnccc2c1 271570a_100011290941_100010209549 [0,0,0,0,0,1|2,0,1]=4 1759 B13R2.57 CNc1cc2nccnc2cn1 27a_100102657272_100000070204 [0,0,0,0,0,1|2,0,1]=4 1760 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [0,0,0,0,0,1|3,0,0]=4 1761 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [0,0,0,0,0,1|3,0,0]=4 1762 B13R2.57 CNc1ccc2cccnc2c1 34a_100102887122_200000210301 [0,0,0,0,0,1|2,0,1]=4 1763 B13R2.57 CNc1ccc2cnccc2c1 34a_100000039641_200000210301 [0,0,0,0,0,1|2,0,0]=3 1764 B13R2.57 CNc1ccc2cncnc2c1 27a_100102657272_100010185614 [0,0,0,0,0,1|1,0,1]=3 1765 B13R2.57 CNc1ccc2ncccc2c1 34a_100011198106_200000210301 [0,0,0,0,0,1|2,0,0]=3 1766 B13R2.57 CNc1ccc2ncccc2n1 27a_100102657272_100000073381 [0,0,0,0,0,1|3,0,0]=4 1767 B13R2.57 CNc1ccc2nccnc2c1 27a_100102657272_100011219451 [0,0,0,0,0,1|1,0,1]=3 1768 B13R2.57 CNc1ccc2nccnc2c1 34a_100011219565_200000210301 [0,0,0,0,0,1|1,0,1]=3 1769 B13R2.57 CNc1ccc2nccnc2n1 27a_100102657272_100012351543 [0,0,0,0,0,1|2,0,1]=4 1770 B13R2.57 CNc1cnc2nccnc2c1 27a_100102657272_100000753224 [0,0,0,0,0,1|2,0,1]=4 1771 B13R2.57 COc1ccc2c(c1)CCCC2 34a_100000186212_200000210301 [0,0,0,0,0,1|2,0,1]=4 1772 B13R2.57 COc1ccc2c(c1)CCCC2 7a_100000186212_200000210301 [0,0,0,0,0,1|2,0,1]=4 1773 B13R2.57 COc1ccc2c(c1)CCCN2 34a_100000070867_200000210301 [0,0,0,0,0,1|1,0,2]=4 1774 B13R2.57 COc1ccc2c(c1)CCNC2 34a_100000077532_200000210301 [0,0,0,0,0,1|1,0,2]=4 1775 B13R2.57 COc1ccc2c(c1)CCOC2 34a_100009841951_200000210301 [0,0,0,0,0,1|2,0,1]=4 1776 B13R2.57 COc1ccc2c(c1)CCOC2 7a_100009841951_200000210301 [0,0,0,0,0,1|2,0,1]=4 1777 B13R2.57 COc1ccc2c(c1)CNCC2 34a_100015185785_200000210301 [0,0,0,0,0,1|1,0,1]=3 1778 B13R2.57 COc1ccc2c(c1)NCCC2 34a_106638131596_200000210301 [0,0,0,0,0,1|1,0,1]=3 1779 B13R2.57 COc1ccc2c(c1)NCCO2 34a_100020636358_200000210301 [0,0,0,0,0,1|1,0,1]=3 1780 B13R2.57 COc1ccc2c(c1)OCCO2 34a_100000234341_200000210301 [0,0,0,0,0,1|2,0,1]=4 1781 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [0,0,0,0,0,1|2,0,0]=3 1782 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [0,0,0,0,0,1|2,0,0]=3 1783 B13R2.57 COc1ccc2cccnc2c1 34a_100011216045_200000210301 [0,0,0,0,0,1|1,0,1]=3 1784 B13R2.57 COc1ccc2ccncc2c1 7a_100000752006_200000210301 [0,0,0,0,0,1|1,0,1]=3 1785 B13R2.57 COc1ccc2cnccc2c1 34a_100000046372_200000210301 [0,0,0,0,0,1|1,0,0]=2 1786 B13R2.57 COc1ccc2cnccc2c1 7a_100000046372_200000210301 [0,0,0,0,0,1|1,0,0]=2 1787 B13R2.57 COc1ccc2ncccc2c1 34a_100011215586_200000210301 [0,0,0,0,0,1|1,0,0]=2 1788 B13R2.57 COc1ccc2ncccc2c1 7a_100011215586_200000210301 [0,0,0,0,0,1|1,0,0]=2 1789 B13R2.57 COc1ccc2nccnc2c1 34a_100000694412_200000210301 [0,0,0,0,0,1|0,0,1]=2 1790 B13R2.57 COc1cnc2ccccc2c1 34a_100011934006_200000210301 [0,0,0,0,0,1|3,0,0]=4 1791 B13R2.57 COc1cnc2ccccc2c1 7a_100011934006_200000210301 [0,0,0,0,0,1|3,0,0]=4 1792 B13R2.57 CSc1cc2nccnc2cn1 62a_100010370699_200000210301 [0,0,0,0,0,1|1,1,1]=4 1793 B13R2.57 CSc1cc2nccnc2cn1 62a_200000210301_100010370699 [0,0,0,0,0,1|1,1,1]=4 1794 B13R2.57 CSc1ccc2c(c1)CNCC2 62a_100015189961_200000210301 [0,0,0,0,0,1|1,1,1]=4 1795 B13R2.57 CSc1ccc2c(c1)CNCC2 62a_200000210301_100015189961 [0,0,0,0,0,1|1,1,1]=4 1796 B13R2.57 CSc1ccc2c(c1)NCCC2 62a_100010196366_200000210301 [0,0,0,0,0,1|1,1,1]=4 1797 B13R2.57 CSc1ccc2c(c1)NCCC2 62a_200000210301_100010196366 [0,0,0,0,0,1|1,1,1]=4 1798 B13R2.57 CSc1ccc2c(c1)NCCO2 62a_200000210301_100000708519 [0,0,0,0,0,1|1,1,1]=4 1799 B13R2.57 CSc1ccc2c(c1)NCCS2 62a_200000210301_100013243616 [0,0,0,0,0,1|1,1,1]=4 1800 B13R2.57 CSc1ccc2ccccc2c1 62a_200000210301_100000233703 [0,0,0,0,0,1|2,1,0]=4 1801 B13R2.57 CSc1ccc2cccnc2c1 62a_200000210301_100009816655 [0,0,0,0,0,1|1,1,1]=4 1802 B13R2.57 CSc1ccc2ccncc2c1 62a_100000686496_200000210301 [0,0,0,0,0,1|1,1,1]=4 1803 B13R2.57 CSc1ccc2ccncc2c1 62a_200000210301_100000686496 [0,0,0,0,0,1|1,1,1]=4 1804 B13R2.57 CSc1ccc2cnccc2c1 62a_100009816743_200000210301 [0,0,0,0,0,1|1,1,0]=3 1805 B13R2.57 CSc1ccc2cnccc2c1 62a_200000210301_100009816743 [0,0,0,0,0,1|1,1,0]=3 1806 B13R2.57 CSc1ccc2cncnc2c1 62a_100010185614_200000210301 [0,0,0,0,0,1|0,1,1]=3 1807 B13R2.57 CSc1ccc2cncnc2c1 62a_200000210301_100010185614 [0,0,0,0,0,1|0,1,1]=3 1808 B13R2.57 CSc1ccc2cnncc2c1 62a_100010198781_200000210301 [0,0,0,0,0,1|2,1,0]=4 1809 B13R2.57 CSc1ccc2cnncc2c1 62a_200000210301_100010198781 [0,0,0,0,0,1|2,1,0]=4 1810 B13R2.57 CSc1ccc2ncccc2c1 62a_100011215947_200000210301 [0,0,0,0,0,1|1,1,0]=3 1811 B13R2.57 CSc1ccc2ncccc2c1 62a_200000210301_100011215947 [0,0,0,0,0,1|1,1,0]=3 1812 B13R2.57 CSc1ccc2ncccc2n1 62a_200000210301_100000073381 [0,0,0,0,0,1|2,1,0]=4 1813 B13R2.57 CSc1ccc2nccnc2c1 62a_100011219451_200000210301 [0,0,0,0,0,1|0,1,1]=3 1814 B13R2.57 CSc1ccc2nccnc2c1 62a_200000210301_100011219451 [0,0,0,0,0,1|0,1,1]=3 1815 B13R2.57 CSc1ccc2nccnc2n1 62a_100012351543_200000210301 [0,0,0,0,0,1|1,1,1]=4 1816 B13R2.57 CSc1ccc2nccnc2n1 62a_200000210301_100012351543 [0,0,0,0,0,1|1,1,1]=4 1817 B13R2.57 CSc1ccc2ncncc2c1 62a_100009989443_200000210301 [0,0,0,0,0,1|0,1,1]=3 1818 B13R2.57 CSc1ccc2ncncc2c1 62a_200000210301_100009989443 [0,0,0,0,0,1|0,1,1]=3 1819 B13R2.57 CSc1ccc2nnccc2c1 62a_100010209549_200000210301 [0,0,0,0,0,1|1,1,0]=3 1820 B13R2.57 CSc1ccc2nnccc2c1 62a_200000210301_100010209549 [0,0,0,0,0,1|1,1,0]=3 1821 B13R2.57 CSc1cnc2nccnc2c1 62a_100000753224_200000210301 [0,0,0,0,0,1|1,1,1]=4 1822 B13R2.57 CSc1cnc2nccnc2c1 62a_200000210301_100000753224 [0,0,0,0,0,1|1,1,1]=4 1823 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [0,0,0,0,0,1|3,0,0]=4 1824 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [0,0,0,0,0,1|3,0,0]=4 1825 B13R2.57 [13CH3]Nc1ccc2cccnc2c1 34a_100102887122_200025704644 [0,0,0,0,0,1|2,0,1]=4 1826 B13R2.57 [13CH3]Nc1ccc2cnccc2c1 34a_100000039641_200025704644 [0,0,0,0,0,1|2,0,0]=3 1827 B13R2.57 [13CH3]Nc1ccc2ncccc2c1 34a_100011198106_200025704644 [0,0,0,0,0,1|2,0,0]=3 1828 B13R2.57 [13CH3]Nc1ccc2nccnc2c1 34a_100011219565_200025704644 [0,0,0,0,0,1|1,0,1]=3 1829 B13R2.57 [13CH3]Oc1ccc2c(c1)CCCC2 34a_100000186212_200025704644 [0,0,0,0,0,1|2,0,1]=4 1830 B13R2.57 [13CH3]Oc1ccc2c(c1)CCCC2 7a_100000186212_200025704644 [0,0,0,0,0,1|2,0,1]=4 1831 B13R2.57 [13CH3]Oc1ccc2c(c1)CCCN2 34a_100000070867_200025704644 [0,0,0,0,0,1|1,0,2]=4 1832 B13R2.57 [13CH3]Oc1ccc2c(c1)CCNC2 34a_100000077532_200025704644 [0,0,0,0,0,1|1,0,2]=4 1833 B13R2.57 [13CH3]Oc1ccc2c(c1)CCOC2 34a_100009841951_200025704644 [0,0,0,0,0,1|2,0,1]=4 1834 B13R2.57 [13CH3]Oc1ccc2c(c1)CCOC2 7a_100009841951_200025704644 [0,0,0,0,0,1|2,0,1]=4 1835 B13R2.57 [13CH3]Oc1ccc2c(c1)CNCC2 34a_100015185785_200025704644 [0,0,0,0,0,1|1,0,1]=3 1836 B13R2.57 [13CH3]Oc1ccc2c(c1)NCCC2 34a_106638131596_200025704644 [0,0,0,0,0,1|1,0,1]=3 1837 B13R2.57 [13CH3]Oc1ccc2c(c1)NCCO2 34a_100020636358_200025704644 [0,0,0,0,0,1|1,0,1]=3 1838 B13R2.57 [13CH3]Oc1ccc2c(c1)OCCO2 34a_100000234341_200025704644 [0,0,0,0,0,1|2,0,1]=4 1839 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [0,0,0,0,0,1|2,0,0]=3 1840 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [0,0,0,0,0,1|2,0,0]=3 1841 B13R2.57 [13CH3]Oc1ccc2cccnc2c1 34a_100011216045_200025704644 [0,0,0,0,0,1|1,0,1]=3 1842 B13R2.57 [13CH3]Oc1ccc2ccncc2c1 7a_100000752006_200025704644 [0,0,0,0,0,1|1,0,1]=3 1843 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 34a_100000046372_200025704644 [0,0,0,0,0,1|1,0,0]=2 1844 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 7a_100000046372_200025704644 [0,0,0,0,0,1|1,0,0]=2 1845 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 34a_100011215586_200025704644 [0,0,0,0,0,1|1,0,0]=2 1846 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 7a_100011215586_200025704644 [0,0,0,0,0,1|1,0,0]=2 1847 B13R2.57 [13CH3]Oc1ccc2nccnc2c1 34a_100000694412_200025704644 [0,0,0,0,0,1|0,0,1]=2 1848 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 34a_100011934006_200025704644 [0,0,0,0,0,1|3,0,0]=4 1849 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 7a_100011934006_200025704644 [0,0,0,0,0,1|3,0,0]=4 1850 B13R2.57 [13CH3]Sc1cc2nccnc2cn1 62a_100010370699_200025704644 [0,0,0,0,0,1|1,1,1]=4 1851 B13R2.57 [13CH3]Sc1cc2nccnc2cn1 62a_200025704644_100010370699 [0,0,0,0,0,1|1,1,1]=4 1852 B13R2.57 [13CH3]Sc1ccc2c(c1)CNCC2 62a_100015189961_200025704644 [0,0,0,0,0,1|1,1,1]=4 1853 B13R2.57 [13CH3]Sc1ccc2c(c1)CNCC2 62a_200025704644_100015189961 [0,0,0,0,0,1|1,1,1]=4 1854 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCC2 62a_100010196366_200025704644 [0,0,0,0,0,1|1,1,1]=4 1855 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCC2 62a_200025704644_100010196366 [0,0,0,0,0,1|1,1,1]=4 1856 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCO2 62a_200025704644_100000708519 [0,0,0,0,0,1|1,1,1]=4 1857 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCS2 62a_200025704644_100013243616 [0,0,0,0,0,1|1,1,1]=4 1858 B13R2.57 [13CH3]Sc1ccc2ccccc2c1 62a_200025704644_100000233703 [0,0,0,0,0,1|2,1,0]=4 1859 B13R2.57 [13CH3]Sc1ccc2cccnc2c1 62a_200025704644_100009816655 [0,0,0,0,0,1|1,1,1]=4 1860 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_100000686496_200025704644 [0,0,0,0,0,1|1,1,1]=4 1861 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_200025704644_100000686496 [0,0,0,0,0,1|1,1,1]=4 1862 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_100009816743_200025704644 [0,0,0,0,0,1|1,1,0]=3 1863 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_200025704644_100009816743 [0,0,0,0,0,1|1,1,0]=3 1864 B13R2.57 [13CH3]Sc1ccc2cncnc2c1 62a_100010185614_200025704644 [0,0,0,0,0,1|0,1,1]=3 1865 B13R2.57 [13CH3]Sc1ccc2cncnc2c1 62a_200025704644_100010185614 [0,0,0,0,0,1|0,1,1]=3 1866 B13R2.57 [13CH3]Sc1ccc2cnncc2c1 62a_100010198781_200025704644 [0,0,0,0,0,1|2,1,0]=4 1867 B13R2.57 [13CH3]Sc1ccc2cnncc2c1 62a_200025704644_100010198781 [0,0,0,0,0,1|2,1,0]=4 1868 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_100011215947_200025704644 [0,0,0,0,0,1|1,1,0]=3 1869 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_200025704644_100011215947 [0,0,0,0,0,1|1,1,0]=3 1870 B13R2.57 [13CH3]Sc1ccc2ncccc2n1 62a_200025704644_100000073381 [0,0,0,0,0,1|2,1,0]=4 1871 B13R2.57 [13CH3]Sc1ccc2nccnc2c1 62a_100011219451_200025704644 [0,0,0,0,0,1|0,1,1]=3 1872 B13R2.57 [13CH3]Sc1ccc2nccnc2c1 62a_200025704644_100011219451 [0,0,0,0,0,1|0,1,1]=3 1873 B13R2.57 [13CH3]Sc1ccc2nccnc2n1 62a_100012351543_200025704644 [0,0,0,0,0,1|1,1,1]=4 1874 B13R2.57 [13CH3]Sc1ccc2nccnc2n1 62a_200025704644_100012351543 [0,0,0,0,0,1|1,1,1]=4 1875 B13R2.57 [13CH3]Sc1ccc2ncncc2c1 62a_100009989443_200025704644 [0,0,0,0,0,1|0,1,1]=3 1876 B13R2.57 [13CH3]Sc1ccc2ncncc2c1 62a_200025704644_100009989443 [0,0,0,0,0,1|0,1,1]=3 1877 B13R2.57 [13CH3]Sc1ccc2nnccc2c1 62a_100010209549_200025704644 [0,0,0,0,0,1|1,1,0]=3 1878 B13R2.57 [13CH3]Sc1ccc2nnccc2c1 62a_200025704644_100010209549 [0,0,0,0,0,1|1,1,0]=3 1879 B13R2.57 [13CH3]Sc1cnc2nccnc2c1 62a_100000753224_200025704644 [0,0,0,0,0,1|1,1,1]=4 1880 B13R2.57 [13CH3]Sc1cnc2nccnc2c1 62a_200025704644_100000753224 [0,0,0,0,0,1|1,1,1]=4 1881 B10R1.21 CCCC=Cc1c[nH]cn1 271570a_100016258520_100000756875 [1,0,1,0,0,0|1,0,1]=4 1882 B10R1.21 CCOC=Cc1c[nH]cn1 271570a_100016256518_100000756875 [1,0,1,0,0,0|2,0,0]=4 1883 B10R1.21 COCC=Cc1c[nH]cn1 271570a_100016286323_100000756875 [1,0,1,0,0,0|0,0,1]=3 1884 B10R1.21 COCC=Cc1cscn1 271570a_100016286323_100000751502 [1,0,1,0,0,0|1,0,1]=4 1885 B10R1.21 COCC=Cc1nc[nH]n1 271570a_100016286323_100000761765 [1,0,1,0,0,0|1,0,1]=4 1886 B10R1.66 C=C(C)CSc1c[nH]cn1 62a_100000748629_100000756875 [1,0,1,0,0,0|1,0,1]=4 1887 B10R1.66 C=C(C)CSc1c[nH]cn1 62a_100000756875_100000211660 [1,0,1,0,0,0|1,0,1]=4 1888 B10R1.66 CC(=O)C=Cc1c[nH]cn1 1458a_100102678534_200000210301 [1,0,1,0,0,0|1,0,0]=3 1889 B10R1.66 CC(=O)C=Cc1cscn1 1458a_200000747928_200000210301 [1,0,1,0,0,0|2,0,0]=4 1890 B10R1.66 CC(C)C=Cc1c[nH]cn1 271570a_100016257149_100000756875 [1,0,1,0,0,0|0,0,2]=4 1891 B10R1.66 CC(O)C=Cc1c[nH]cn1 271570a_200011019289_100000756875 [1,0,1,0,0,0|0,0,2]=4 1892 B10R1.66 [13CH3]C(=O)C=Cc1c[nH]cn1 1458a_100102678534_200025704644 [1,0,1,0,0,0|1,0,0]=3 1893 B10R1.66 [13CH3]C(=O)C=Cc1cscn1 1458a_200000747928_200025704644 [1,0,1,0,0,0|2,0,0]=4 1894 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,0,1,0,0,0|2,0,0]=4 1895 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,0,1,0,0,0|2,0,0]=4 1896 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,0,1,0,0,0|2,0,0]=4 1897 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,0,1,0,0,0|1,0,1]=4 1898 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,0,1,0,0,0|2,0,0]=4 1899 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,0,1,0,0,0|2,0,0]=4 1900 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,0,1,0,0,0|2,0,0]=4 1901 B10R1.1 [N-]=[N+]=Nc1ccc(cc1)O 271570a_203496583355_100000735661 [1,0,1,0,0,0|1,0,1]=4 1902 B10R1.3 C=Cc1ccc(cc1)CC 271570a_100011290941_100011215824 [1,0,1,0,0,0|2,0,0]=4 1903 B10R1.3 C=Cc1ccc(cc1)NC 271570a_100011290941_100000219623 [1,0,1,0,0,0|2,0,0]=4 1904 B10R1.3 C=Cc1ccc(cc1)NC 34a_100011218248_200000210301 [1,0,1,0,0,0|2,0,0]=4 1905 B10R1.3 C=Cc1ccc(cc1)N[13CH3] 34a_100011218248_200025704644 [1,0,1,0,0,0|2,0,0]=4 1906 B10R1.3 C=Cc1ccc(cc1)OC 271570a_100011290941_100000171711 [1,0,1,0,0,0|1,0,0]=3 1907 B10R1.3 C=Cc1ccc(cc1)OC 34a_100000189437_200000210301 [1,0,1,0,0,0|1,0,0]=3 1908 B10R1.3 C=Cc1ccc(cc1)OC 7a_100000189437_200000210301 [1,0,1,0,0,0|1,0,0]=3 1909 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 34a_100000189437_200025704644 [1,0,1,0,0,0|1,0,0]=3 1910 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 7a_100000189437_200025704644 [1,0,1,0,0,0|1,0,0]=3 1911 B10R1.3 C=Cc1ccc(cc1)SC 271570a_100011290941_100011263217 [1,0,1,0,0,0|1,1,0]=4 1912 B10R1.3 C=Cc1ccc(cc1)SC 62a_100000748128_200000210301 [1,0,1,0,0,0|1,1,0]=4 1913 B10R1.3 C=Cc1ccc(cc1)SC 62a_200000210301_100000748128 [1,0,1,0,0,0|1,1,0]=4 1914 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_100000748128_200025704644 [1,0,1,0,0,0|1,1,0]=4 1915 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000748128 [1,0,1,0,0,0|1,1,0]=4 1916 B10R1.3 C=Cc1ccc(cn1)OC 271570a_100011290941_100000755202 [1,0,1,0,0,0|2,0,0]=4 1917 B10R1.3 C=Cc1ccc(nc1)OC 271570a_100011290941_100000047065 [1,0,1,0,0,0|2,0,0]=4 1918 B10R1.3 CCc1ccc(cc1)OC 34a_100000211359_200000210301 [1,0,1,0,0,0|1,0,1]=4 1919 B10R1.3 CCc1ccc(cc1)OC 7a_100000211359_200000210301 [1,0,1,0,0,0|1,0,1]=4 1920 B10R1.3 CCc1ccc(cc1)O[13CH3] 34a_100000211359_200025704644 [1,0,1,0,0,0|1,0,1]=4 1921 B10R1.3 CCc1ccc(cc1)O[13CH3] 7a_100000211359_200025704644 [1,0,1,0,0,0|1,0,1]=4 1922 B10R1.3 CNc1ccc(cc1)OC 34a_100000182112_200000210301 [1,0,1,0,0,0|0,0,2]=4 1923 B10R1.3 CNc1ccc(cc1)OC 34a_100000184247_200000210301 [1,0,1,0,0,0|0,0,2]=4 1924 B10R1.3 CNc1ccc(cc1)O[13CH3] 34a_100000182112_200025704644 [1,0,1,0,0,0|0,0,2]=4 1925 B10R1.3 COc1ccc(cc1)C#N 34a_100000210344_200000210301 [1,0,1,0,0,0|0,0,2]=4 1926 B10R1.3 COc1ccc(cc1)C#N 7a_100000210344_200000210301 [1,0,1,0,0,0|0,0,2]=4 1927 B10R1.3 COc1ccc(cc1)CN 34a_100000185549_200000210301 [1,0,1,0,0,0|0,0,1]=3 1928 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [1,0,1,0,0,0|1,0,1]=4 1929 B10R1.3 COc1ccc(cc1)N[13CH3] 34a_100000184247_200025704644 [1,0,1,0,0,0|0,0,2]=4 1930 B10R1.3 COc1ccc(cc1)OC 34a_100000210503_200000210301 [1,0,1,0,0,0|1,0,1]=4 1931 B10R1.3 COc1ccc(cc1)O[13CH3] 34a_100000210503_200025704644 [1,0,1,0,0,0|1,0,1]=4 1932 B10R1.3 COc1ccc(cc1)SC 34a_100000211864_200000210301 [1,0,1,0,0,0|1,0,1]=4 1933 B10R1.3 COc1ccc(cc1)SC 62a_200000210301_100000171711 [1,0,1,0,0,0|1,0,1]=4 1934 B10R1.3 COc1ccc(cc1)S[13CH3] 62a_200025704644_100000171711 [1,0,1,0,0,0|1,0,1]=4 1935 B10R1.3 COc1ccc(cn1)CN 34a_100000757128_200000210301 [1,0,1,0,0,0|1,0,1]=4 1936 B10R1.3 COc1ccc(nc1)CN 34a_100020605196_200000210301 [1,0,1,0,0,0|1,0,1]=4 1937 B10R1.3 CSc1ccc(cc1)C=O 62a_100000188517_200000210301 [1,0,1,0,0,0|1,1,0]=4 1938 B10R1.3 CSc1ccc(cc1)C=O 62a_200000210301_100000188517 [1,0,1,0,0,0|1,1,0]=4 1939 B10R1.3 CSc1ccc(cc1)CN 62a_100016989417_200000210301 [1,0,1,0,0,0|0,1,1]=4 1940 B10R1.3 CSc1ccc(cc1)CN 62a_200000210301_100016989417 [1,0,1,0,0,0|0,1,1]=4 1941 B10R1.3 CSc1ccc(cc1)NN 62a_100016988836_200000210301 [1,0,1,0,0,0|0,1,1]=4 1942 B10R1.3 CSc1ccc(cc1)NN 62a_200000210301_100016988836 [1,0,1,0,0,0|0,1,1]=4 1943 B10R1.3 CSc1ccc(cc1)O[13CH3] 34a_100000211864_200025704644 [1,0,1,0,0,0|1,0,1]=4 1944 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 34a_100000210344_200025704644 [1,0,1,0,0,0|0,0,2]=4 1945 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 7a_100000210344_200025704644 [1,0,1,0,0,0|0,0,2]=4 1946 B10R1.3 [13CH3]Oc1ccc(cc1)CN 34a_100000185549_200025704644 [1,0,1,0,0,0|0,0,1]=3 1947 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [1,0,1,0,0,0|1,0,1]=4 1948 B10R1.3 [13CH3]Oc1ccc(cn1)CN 34a_100000757128_200025704644 [1,0,1,0,0,0|1,0,1]=4 1949 B10R1.3 [13CH3]Oc1ccc(nc1)CN 34a_100020605196_200025704644 [1,0,1,0,0,0|1,0,1]=4 1950 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_100000188517_200025704644 [1,0,1,0,0,0|1,1,0]=4 1951 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_200025704644_100000188517 [1,0,1,0,0,0|1,1,0]=4 1952 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_100016989417_200025704644 [1,0,1,0,0,0|0,1,1]=4 1953 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_200025704644_100016989417 [1,0,1,0,0,0|0,1,1]=4 1954 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_100016988836_200025704644 [1,0,1,0,0,0|0,1,1]=4 1955 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_200025704644_100016988836 [1,0,1,0,0,0|0,1,1]=4 1956 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,0,1,0,0,0|2,0,0]=4 1957 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,0,1,0,0,0|2,0,0]=4 1958 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,0,1,0,0,0|2,0,0]=4 1959 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,0,1,0,0,0|1,0,1]=4 1960 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,0,1,0,0,0|1,0,1]=4 1961 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,0,1,0,0,0|1,0,1]=4 1962 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,0,1,0,0,0|1,0,1]=4 1963 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [1,0,1,0,0,0|1,0,1]=4 1964 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,0,1,0,0,0|2,0,0]=4 1965 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [1,0,1,0,0,0|1,0,1]=4 1966 B10R1.172 C#Cc1cccc(c1)OC 34a_100011216014_200000210301 [1,0,1,0,0,0|1,0,1]=4 1967 B10R1.172 C#Cc1cccc(c1)OC 7a_100011216014_200000210301 [1,0,1,0,0,0|1,0,1]=4 1968 B10R1.172 C#Cc1cccc(c1)O[13CH3] 34a_100011216014_200025704644 [1,0,1,0,0,0|1,0,1]=4 1969 B10R1.172 C#Cc1cccc(c1)O[13CH3] 7a_100011216014_200025704644 [1,0,1,0,0,0|1,0,1]=4 1970 B10R1.172 C=Cc1cc(ccn1)OC 271570a_100011290941_100011216251 [1,0,1,0,0,0|2,0,0]=4 1971 B10R1.172 C=Cc1cccc(c1)CC 271570a_100011290941_100000684523 [1,0,1,0,0,0|2,0,0]=4 1972 B10R1.172 C=Cc1cccc(c1)NC 271570a_100011290941_100000219648 [1,0,1,0,0,0|2,0,0]=4 1973 B10R1.172 C=Cc1cccc(c1)NC 34a_100011827668_200000210301 [1,0,1,0,0,0|2,0,0]=4 1974 B10R1.172 C=Cc1cccc(c1)N[13CH3] 34a_100011827668_200025704644 [1,0,1,0,0,0|2,0,0]=4 1975 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [1,0,1,0,0,0|1,0,0]=3 1976 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [1,0,1,0,0,0|1,0,0]=3 1977 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [1,0,1,0,0,0|1,0,0]=3 1978 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [1,0,1,0,0,0|1,0,0]=3 1979 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [1,0,1,0,0,0|1,0,0]=3 1980 B10R1.172 C=Cc1cccc(c1)SC 271570a_100011290941_100011215954 [1,0,1,0,0,0|1,1,0]=4 1981 B10R1.172 C=Cc1cccc(c1)SC 62a_100011215241_200000210301 [1,0,1,0,0,0|1,1,0]=4 1982 B10R1.172 C=Cc1cccc(c1)SC 62a_200000210301_100011215241 [1,0,1,0,0,0|1,1,0]=4 1983 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_100011215241_200025704644 [1,0,1,0,0,0|1,1,0]=4 1984 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215241 [1,0,1,0,0,0|1,1,0]=4 1985 B10R1.172 C=Cc1cccc(n1)OC 271570a_100011290941_100000760917 [1,0,1,0,0,0|2,0,0]=4 1986 B10R1.172 C=Cc1ccnc(c1)OC 271570a_100011290941_100000117307 [1,0,1,0,0,0|2,0,0]=4 1987 B10R1.172 C=Cc1cncc(c1)OC 271570a_100011290941_100000684773 [1,0,1,0,0,0|2,0,0]=4 1988 B10R1.172 CCc1cccc(c1)NC 2230a_100000211250_200000210301 [1,0,1,0,0,0|1,0,1]=4 1989 B10R1.172 CCc1cccc(c1)NC 34a_100000211250_200000210301 [1,0,1,0,0,0|1,0,1]=4 1990 B10R1.172 CCc1cccc(c1)NC 7a_100000211250_200000210301 [1,0,1,0,0,0|1,0,1]=4 1991 B10R1.172 CCc1cccc(c1)N[13CH3] 2230a_100000211250_200025704644 [1,0,1,0,0,0|1,0,1]=4 1992 B10R1.172 CCc1cccc(c1)N[13CH3] 34a_100000211250_200025704644 [1,0,1,0,0,0|1,0,1]=4 1993 B10R1.172 CCc1cccc(c1)N[13CH3] 7a_100000211250_200025704644 [1,0,1,0,0,0|1,0,1]=4 1994 B10R1.172 CCc1cccc(c1)OC 34a_100000211550_200000210301 [1,0,1,0,0,0|1,0,1]=4 1995 B10R1.172 CCc1cccc(c1)OC 7a_100000211550_200000210301 [1,0,1,0,0,0|1,0,1]=4 1996 B10R1.172 CCc1cccc(c1)O[13CH3] 34a_100000211550_200025704644 [1,0,1,0,0,0|1,0,1]=4 1997 B10R1.172 CCc1cccc(c1)O[13CH3] 7a_100000211550_200025704644 [1,0,1,0,0,0|1,0,1]=4 1998 B10R1.172 CNc1cccc(c1)OC 34a_100000210024_200000210301 [1,0,1,0,0,0|0,0,1]=3 1999 B10R1.172 CNc1cccc(c1)OC 34a_100000756613_200000210301 [1,0,1,0,0,0|0,0,1]=3 2000 B10R1.172 CNc1cccc(c1)OC 7a_100000756613_200000210301 [1,0,1,0,0,0|0,0,1]=3 2001 B10R1.172 CNc1cccc(c1)O[13CH3] 34a_100000756613_200025704644 [1,0,1,0,0,0|0,0,1]=3 2002 B10R1.172 CNc1cccc(c1)O[13CH3] 7a_100000756613_200025704644 [1,0,1,0,0,0|0,0,1]=3 2003 B10R1.172 CNc1cccc(c1)SC 2230a_100000210049_200000210301 [1,0,1,0,0,0|0,1,1]=4 2004 B10R1.172 CNc1cccc(c1)SC 34a_100000210049_200000210301 [1,0,1,0,0,0|0,1,1]=4 2005 B10R1.172 CNc1cccc(c1)SC 62a_100000219648_200000210301 [1,0,1,0,0,0|0,1,1]=4 2006 B10R1.172 CNc1cccc(c1)SC 62a_200000210301_100000219648 [1,0,1,0,0,0|0,1,1]=4 2007 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_100000219648_200025704644 [1,0,1,0,0,0|0,1,1]=4 2008 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_200025704644_100000219648 [1,0,1,0,0,0|0,1,1]=4 2009 B10R1.172 COc1cccc(c1)C#N 34a_100000184713_200000210301 [1,0,1,0,0,0|0,0,2]=4 2010 B10R1.172 COc1cccc(c1)C#N 7a_100000184713_200000210301 [1,0,1,0,0,0|0,0,2]=4 2011 B10R1.172 COc1cccc(c1)CBr 34a_100011660834_200000210301 [1,0,1,0,0,0|1,0,1]=4 2012 B10R1.172 COc1cccc(c1)CBr 7a_100011660834_200000210301 [1,0,1,0,0,0|1,0,1]=4 2013 B10R1.172 COc1cccc(c1)CCl 34a_100000084143_200000210301 [1,0,1,0,0,0|1,0,1]=4 2014 B10R1.172 COc1cccc(c1)CCl 7a_100000084143_200000210301 [1,0,1,0,0,0|1,0,1]=4 2015 B10R1.172 COc1cccc(c1)CN 34a_100000743036_200000210301 [1,0,1,0,0,0|0,0,2]=4 2016 B10R1.172 COc1cccc(c1)CO 34a_100011214949_200000210301 [1,0,1,0,0,0|1,0,1]=4 2017 B10R1.172 COc1cccc(c1)CO 7a_100011214949_200000210301 [1,0,1,0,0,0|1,0,1]=4 2018 B10R1.172 COc1cccc(c1)N[13CH3] 34a_100000210024_200025704644 [1,0,1,0,0,0|0,0,1]=3 2019 B10R1.172 COc1cccc(c1)OC 34a_100000211255_200000210301 [1,0,1,0,0,0|1,0,1]=4 2020 B10R1.172 COc1cccc(c1)OC 7a_100000211255_200000210301 [1,0,1,0,0,0|1,0,1]=4 2021 B10R1.172 COc1cccc(c1)O[13CH3] 34a_100000211255_200025704644 [1,0,1,0,0,0|1,0,1]=4 2022 B10R1.172 COc1cccc(c1)O[13CH3] 7a_100000211255_200025704644 [1,0,1,0,0,0|1,0,1]=4 2023 B10R1.172 COc1cccc(c1)SC 34a_100011265683_200000210301 [1,0,1,0,0,0|1,0,1]=4 2024 B10R1.172 COc1cccc(c1)SC 62a_200000210301_100000170001 [1,0,1,0,0,0|1,0,1]=4 2025 B10R1.172 COc1cccc(c1)SC 7a_100011265683_200000210301 [1,0,1,0,0,0|1,0,1]=4 2026 B10R1.172 COc1cccc(c1)S[13CH3] 62a_200025704644_100000170001 [1,0,1,0,0,0|1,0,1]=4 2027 B10R1.172 CSc1cccc(c1)C=O 62a_100000014684_200000210301 [1,0,1,0,0,0|1,1,0]=4 2028 B10R1.172 CSc1cccc(c1)C=O 62a_200000210301_100000014684 [1,0,1,0,0,0|1,1,0]=4 2029 B10R1.172 CSc1cccc(c1)NN 62a_100000217339_200000210301 [1,0,1,0,0,0|0,1,1]=4 2030 B10R1.172 CSc1cccc(c1)NN 62a_200000210301_100000217339 [1,0,1,0,0,0|0,1,1]=4 2031 B10R1.172 CSc1cccc(c1)N[13CH3] 2230a_100000210049_200025704644 [1,0,1,0,0,0|0,1,1]=4 2032 B10R1.172 CSc1cccc(c1)N[13CH3] 34a_100000210049_200025704644 [1,0,1,0,0,0|0,1,1]=4 2033 B10R1.172 CSc1cccc(c1)O[13CH3] 34a_100011265683_200025704644 [1,0,1,0,0,0|1,0,1]=4 2034 B10R1.172 CSc1cccc(c1)O[13CH3] 7a_100011265683_200025704644 [1,0,1,0,0,0|1,0,1]=4 2035 B10R1.172 [13CH3]Oc1cccc(c1)C#N 34a_100000184713_200025704644 [1,0,1,0,0,0|0,0,2]=4 2036 B10R1.172 [13CH3]Oc1cccc(c1)C#N 7a_100000184713_200025704644 [1,0,1,0,0,0|0,0,2]=4 2037 B10R1.172 [13CH3]Oc1cccc(c1)CBr 34a_100011660834_200025704644 [1,0,1,0,0,0|1,0,1]=4 2038 B10R1.172 [13CH3]Oc1cccc(c1)CBr 7a_100011660834_200025704644 [1,0,1,0,0,0|1,0,1]=4 2039 B10R1.172 [13CH3]Oc1cccc(c1)CCl 34a_100000084143_200025704644 [1,0,1,0,0,0|1,0,1]=4 2040 B10R1.172 [13CH3]Oc1cccc(c1)CCl 7a_100000084143_200025704644 [1,0,1,0,0,0|1,0,1]=4 2041 B10R1.172 [13CH3]Oc1cccc(c1)CN 34a_100000743036_200025704644 [1,0,1,0,0,0|0,0,2]=4 2042 B10R1.172 [13CH3]Oc1cccc(c1)CO 34a_100011214949_200025704644 [1,0,1,0,0,0|1,0,1]=4 2043 B10R1.172 [13CH3]Oc1cccc(c1)CO 7a_100011214949_200025704644 [1,0,1,0,0,0|1,0,1]=4 2044 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_100000014684_200025704644 [1,0,1,0,0,0|1,1,0]=4 2045 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_200025704644_100000014684 [1,0,1,0,0,0|1,1,0]=4 2046 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_100000217339_200025704644 [1,0,1,0,0,0|0,1,1]=4 2047 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_200025704644_100000217339 [1,0,1,0,0,0|0,1,1]=4 2048 B10R1.64 CC(=Cc1[nH]cnc1Cl)C 271570a_100102525489_100010200774 [1,0,1,0,0,0|1,0,1]=4 2049 B10R1.25 C=Cc1ccc(cc1Br)C 271570a_100011290941_100009813563 [1,0,1,0,0,0|2,0,0]=4 2050 B10R1.25 C=Cc1ccc(cc1Br)O 271570a_100011290941_100000701344 [1,0,1,0,0,0|2,0,0]=4 2051 B10R1.25 C=Cc1ccc(cc1C)C 271570a_100011290941_100011217332 [1,0,1,0,0,0|2,0,0]=4 2052 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [1,0,1,0,0,0|2,0,0]=4 2053 B10R1.25 C=Cc1ccc(cc1Cl)C 271570a_100011290941_100011263221 [1,0,1,0,0,0|2,0,0]=4 2054 B10R1.25 C=Cc1ccc(cc1Cl)O 271570a_100011290941_100000047559 [1,0,1,0,0,0|2,0,0]=4 2055 B10R1.25 C=Cc1ccc(cc1F)C 271570a_100011290941_100011216119 [1,0,1,0,0,0|2,0,0]=4 2056 B10R1.25 C=Cc1ccc(cc1F)O 271570a_100011290941_100000755031 [1,0,1,0,0,0|2,0,0]=4 2057 B10R1.25 C=Cc1ccc(cc1N)Br 271570a_100011290941_100000743836 [1,0,1,0,0,0|2,0,0]=4 2058 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [1,0,1,0,0,0|1,0,0]=3 2059 B10R1.25 C=Cc1ccc(cc1N)Cl 271570a_100011290941_100000761886 [1,0,1,0,0,0|2,0,0]=4 2060 B10R1.25 C=Cc1ccc(cc1N)F 271570a_100011290941_100011218093 [1,0,1,0,0,0|2,0,0]=4 2061 B10R1.25 C=Cc1ccc(cc1N)N 271570a_100011290941_200012175722 [1,0,1,0,0,0|2,0,0]=4 2062 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [1,0,1,0,0,0|1,0,0]=3 2063 B10R1.25 C=Cc1ccc(cc1O)C 271570a_100011290941_100012002257 [1,0,1,0,0,0|2,0,0]=4 2064 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [1,0,1,0,0,0|2,0,0]=4 2065 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [1,0,1,0,0,0|2,0,0]=4 2066 B10R1.25 C=Cc1cnc(cc1N)C 271570a_100011290941_100009817891 [1,0,1,0,0,0|2,0,0]=4 2067 B10R1.25 C=Cc1ncc(cc1N)C 271570a_100011290941_100000733613 [1,0,1,0,0,0|2,0,0]=4 2068 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [1,0,1,0,0,0|1,0,1]=4 2069 B10R1.25 CNc1ccc(cc1N)O 271570a_203496583355_100000741790 [1,0,1,0,0,0|0,0,2]=4 2070 B10R1.25 COc1ccc(cc1N)C 34a_100011215204_200000210301 [1,0,1,0,0,0|1,0,1]=4 2071 B10R1.25 COc1ccc(cc1N)C 7a_100011215204_200000210301 [1,0,1,0,0,0|1,0,1]=4 2072 B10R1.25 COc1ccc(cc1N)O 271570a_203496583355_100000743470 [1,0,1,0,0,0|1,0,1]=4 2073 B10R1.25 CSc1ccc(cc1N)C 62a_100011216686_200000210301 [1,0,1,0,0,0|1,0,1]=4 2074 B10R1.25 CSc1ccc(cc1N)C 62a_200000210301_100011216686 [1,0,1,0,0,0|1,0,1]=4 2075 B10R1.25 CSc1ccc(cc1N)O 62a_100011999798_200000210301 [1,0,1,0,0,0|1,0,1]=4 2076 B10R1.25 CSc1ccc(cc1N)O 62a_200000210301_100011999798 [1,0,1,0,0,0|1,0,1]=4 2077 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 34a_100011215204_200025704644 [1,0,1,0,0,0|1,0,1]=4 2078 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 7a_100011215204_200025704644 [1,0,1,0,0,0|1,0,1]=4 2079 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_100011216686_200025704644 [1,0,1,0,0,0|1,0,1]=4 2080 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011216686 [1,0,1,0,0,0|1,0,1]=4 2081 B10R1.25 N#Cc1ccc(cc1N)O 271570a_203496583355_100000699244 [1,0,1,0,0,0|2,0,0]=4 2082 B10R1.25 Nc1cc(ccc1C=O)O 271570a_203496583355_100009814810 [1,0,1,0,0,0|2,0,0]=4 2083 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [1,0,1,0,0,0|2,0,0]=4 2084 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_100011999798_200025704644 [1,0,1,0,0,0|1,0,1]=4 2085 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_200025704644_100011999798 [1,0,1,0,0,0|1,0,1]=4 2086 B10R1.176 COc1cc(c(cn1)O)N 271570a_203496583355_100010254562 [1,0,1,0,0,0|2,0,0]=4 2087 B10R1.176 COc1ccc(c(c1)Br)C 34a_100011380479_200000210301 [1,0,1,0,0,0|1,0,1]=4 2088 B10R1.176 COc1ccc(c(c1)Br)C 7a_100011380479_200000210301 [1,0,1,0,0,0|1,0,1]=4 2089 B10R1.176 COc1ccc(c(c1)Br)Cl 34a_100011933957_200000210301 [1,0,1,0,0,0|2,0,0]=4 2090 B10R1.176 COc1ccc(c(c1)Br)Cl 7a_100011933957_200000210301 [1,0,1,0,0,0|2,0,0]=4 2091 B10R1.176 COc1ccc(c(c1)Br)F 34a_100000693481_200000210301 [1,0,1,0,0,0|2,0,0]=4 2092 B10R1.176 COc1ccc(c(c1)Br)F 7a_100000693481_200000210301 [1,0,1,0,0,0|2,0,0]=4 2093 B10R1.176 COc1ccc(c(c1)Br)I 34a_100000701344_200000210301 [1,0,1,0,0,0|2,0,0]=4 2094 B10R1.176 COc1ccc(c(c1)Br)I 7a_100000701344_200000210301 [1,0,1,0,0,0|2,0,0]=4 2095 B10R1.176 COc1ccc(c(c1)Br)N 34a_100012001276_200000210301 [1,0,1,0,0,0|1,0,1]=4 2096 B10R1.176 COc1ccc(c(c1)Br)N 7a_100012001276_200000210301 [1,0,1,0,0,0|1,0,1]=4 2097 B10R1.176 COc1ccc(c(c1)Br)O 271570a_203496583355_100012349170 [1,0,1,0,0,0|2,0,0]=4 2098 B10R1.176 COc1ccc(c(c1)C)Br 34a_100000690111_200000210301 [1,0,1,0,0,0|1,0,1]=4 2099 B10R1.176 COc1ccc(c(c1)C)Br 7a_100000690111_200000210301 [1,0,1,0,0,0|1,0,1]=4 2100 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [1,0,1,0,0,0|1,0,1]=4 2101 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [1,0,1,0,0,0|1,0,1]=4 2102 B10R1.176 COc1ccc(c(c1)C)Cl 34a_100000211092_200000210301 [1,0,1,0,0,0|1,0,1]=4 2103 B10R1.176 COc1ccc(c(c1)C)Cl 7a_100000211092_200000210301 [1,0,1,0,0,0|1,0,1]=4 2104 B10R1.176 COc1ccc(c(c1)C)F 34a_100000751312_200000210301 [1,0,1,0,0,0|1,0,1]=4 2105 B10R1.176 COc1ccc(c(c1)C)F 7a_100000751312_200000210301 [1,0,1,0,0,0|1,0,1]=4 2106 B10R1.176 COc1ccc(c(c1)C)I 34a_100000729255_200000210301 [1,0,1,0,0,0|1,0,1]=4 2107 B10R1.176 COc1ccc(c(c1)C)I 7a_100000729255_200000210301 [1,0,1,0,0,0|1,0,1]=4 2108 B10R1.176 COc1ccc(c(c1)C)N 34a_100000756630_200000210301 [1,0,1,0,0,0|0,0,2]=4 2109 B10R1.176 COc1ccc(c(c1)C)N 7a_100000756630_200000210301 [1,0,1,0,0,0|0,0,2]=4 2110 B10R1.176 COc1ccc(c(c1)C)O 271570a_203496583355_100000759875 [1,0,1,0,0,0|1,0,1]=4 2111 B10R1.176 COc1ccc(c(c1)Cl)Br 34a_100011215161_200000210301 [1,0,1,0,0,0|2,0,0]=4 2112 B10R1.176 COc1ccc(c(c1)Cl)Br 7a_100011215161_200000210301 [1,0,1,0,0,0|2,0,0]=4 2113 B10R1.176 COc1ccc(c(c1)Cl)C 34a_100011265682_200000210301 [1,0,1,0,0,0|1,0,1]=4 2114 B10R1.176 COc1ccc(c(c1)Cl)C 7a_100011265682_200000210301 [1,0,1,0,0,0|1,0,1]=4 2115 B10R1.176 COc1ccc(c(c1)Cl)Cl 34a_100000211054_200000210301 [1,0,1,0,0,0|2,0,0]=4 2116 B10R1.176 COc1ccc(c(c1)Cl)Cl 7a_100000211054_200000210301 [1,0,1,0,0,0|2,0,0]=4 2117 B10R1.176 COc1ccc(c(c1)Cl)F 34a_100000211030_200000210301 [1,0,1,0,0,0|2,0,0]=4 2118 B10R1.176 COc1ccc(c(c1)Cl)F 7a_100000211030_200000210301 [1,0,1,0,0,0|2,0,0]=4 2119 B10R1.176 COc1ccc(c(c1)Cl)I 34a_100000047559_200000210301 [1,0,1,0,0,0|2,0,0]=4 2120 B10R1.176 COc1ccc(c(c1)Cl)I 7a_100000047559_200000210301 [1,0,1,0,0,0|2,0,0]=4 2121 B10R1.176 COc1ccc(c(c1)Cl)N 34a_100011215599_200000210301 [1,0,1,0,0,0|1,0,1]=4 2122 B10R1.176 COc1ccc(c(c1)Cl)N 7a_100011215599_200000210301 [1,0,1,0,0,0|1,0,1]=4 2123 B10R1.176 COc1ccc(c(c1)F)Br 34a_100000755031_200000210301 [1,0,1,0,0,0|2,0,0]=4 2124 B10R1.176 COc1ccc(c(c1)F)Br 7a_100000755031_200000210301 [1,0,1,0,0,0|2,0,0]=4 2125 B10R1.176 COc1ccc(c(c1)F)C 34a_100000722560_200000210301 [1,0,1,0,0,0|1,0,1]=4 2126 B10R1.176 COc1ccc(c(c1)F)C 7a_100000722560_200000210301 [1,0,1,0,0,0|1,0,1]=4 2127 B10R1.176 COc1ccc(c(c1)F)Cl 34a_100000691581_200000210301 [1,0,1,0,0,0|2,0,0]=4 2128 B10R1.176 COc1ccc(c(c1)F)Cl 7a_100000691581_200000210301 [1,0,1,0,0,0|2,0,0]=4 2129 B10R1.176 COc1ccc(c(c1)F)F 34a_100000181275_200000210301 [1,0,1,0,0,0|2,0,0]=4 2130 B10R1.176 COc1ccc(c(c1)F)F 7a_100000181275_200000210301 [1,0,1,0,0,0|2,0,0]=4 2131 B10R1.176 COc1ccc(c(c1)F)I 34a_100009990212_200000210301 [1,0,1,0,0,0|2,0,0]=4 2132 B10R1.176 COc1ccc(c(c1)F)I 7a_100009990212_200000210301 [1,0,1,0,0,0|2,0,0]=4 2133 B10R1.176 COc1ccc(c(c1)F)N 34a_100000759473_200000210301 [1,0,1,0,0,0|1,0,1]=4 2134 B10R1.176 COc1ccc(c(c1)F)N 7a_100000759473_200000210301 [1,0,1,0,0,0|1,0,1]=4 2135 B10R1.176 COc1ccc(c(c1)F)O 271570a_203496583355_100000753793 [1,0,1,0,0,0|2,0,0]=4 2136 B10R1.176 COc1ccc(c(c1)I)Br 34a_100012339312_200000210301 [1,0,1,0,0,0|2,0,0]=4 2137 B10R1.176 COc1ccc(c(c1)I)Br 7a_100012339312_200000210301 [1,0,1,0,0,0|2,0,0]=4 2138 B10R1.176 COc1ccc(c(c1)I)Cl 34a_100000049588_200000210301 [1,0,1,0,0,0|2,0,0]=4 2139 B10R1.176 COc1ccc(c(c1)I)Cl 7a_100000049588_200000210301 [1,0,1,0,0,0|2,0,0]=4 2140 B10R1.176 COc1ccc(c(c1)I)N 34a_100010084370_200000210301 [1,0,1,0,0,0|1,0,1]=4 2141 B10R1.176 COc1ccc(c(c1)I)N 7a_100010084370_200000210301 [1,0,1,0,0,0|1,0,1]=4 2142 B10R1.176 COc1ccc(c(c1)N)Br 34a_100011999798_200000210301 [1,0,1,0,0,0|1,0,0]=3 2143 B10R1.176 COc1ccc(c(c1)N)Br 7a_100011999798_200000210301 [1,0,1,0,0,0|1,0,0]=3 2144 B10R1.176 COc1ccc(c(c1)N)C 34a_100011216113_200000210301 [1,0,1,0,0,0|0,0,1]=3 2145 B10R1.176 COc1ccc(c(c1)N)C 7a_100011216113_200000210301 [1,0,1,0,0,0|0,0,1]=3 2146 B10R1.176 COc1ccc(c(c1)N)Cl 34a_100011934297_200000210301 [1,0,1,0,0,0|1,0,0]=3 2147 B10R1.176 COc1ccc(c(c1)N)F 34a_100012017239_200000210301 [1,0,1,0,0,0|1,0,0]=3 2148 B10R1.176 COc1ccc(c(c1)N)F 7a_100012017239_200000210301 [1,0,1,0,0,0|1,0,0]=3 2149 B10R1.176 COc1ccc(c(c1)N)N 34a_100025771000_200000210301 [1,0,1,0,0,0|0,0,1]=3 2150 B10R1.176 COc1ccc(c(c1)N)O 271570a_203496583355_100000748021 [1,0,1,0,0,0|1,0,0]=3 2151 B10R1.176 COc1ccc(c(c1)O)Br 271570a_203496583355_100009992028 [1,0,1,0,0,0|2,0,0]=4 2152 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [1,0,1,0,0,0|1,0,1]=4 2153 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [1,0,1,0,0,0|2,0,0]=4 2154 B10R1.176 COc1ccc(c(c1)O)F 271570a_203496583355_100000699733 [1,0,1,0,0,0|2,0,0]=4 2155 B10R1.176 COc1ccc(c(c1)O)N 271570a_203496583355_100015195136 [1,0,1,0,0,0|1,0,1]=4 2156 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000685887 [1,0,1,0,0,0|2,0,0]=4 2157 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000719091 [1,0,1,0,0,0|2,0,0]=4 2158 B10R1.176 COc1ccc(c(n1)N)O 271570a_203496583355_100010187629 [1,0,1,0,0,0|2,0,0]=4 2159 B10R1.176 COc1cnc(c(c1)N)O 271570a_203496583355_100010074831 [1,0,1,0,0,0|2,0,0]=4 2160 B10R1.176 CSc1ccc(c(c1)N)Br 62a_100000750456_200000210301 [1,0,1,0,0,0|1,1,0]=4 2161 B10R1.176 CSc1ccc(c(c1)N)Br 62a_200000210301_100000750456 [1,0,1,0,0,0|1,1,0]=4 2162 B10R1.176 CSc1ccc(c(c1)N)C 62a_100000761890_200000210301 [1,0,1,0,0,0|0,1,1]=4 2163 B10R1.176 CSc1ccc(c(c1)N)C 62a_200000210301_100000761890 [1,0,1,0,0,0|0,1,1]=4 2164 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000210301_200000761891 [1,0,1,0,0,0|1,1,0]=4 2165 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000761891_200000210301 [1,0,1,0,0,0|1,1,0]=4 2166 B10R1.176 CSc1ccc(c(c1)N)F 62a_100000740924_200000210301 [1,0,1,0,0,0|1,1,0]=4 2167 B10R1.176 CSc1ccc(c(c1)N)F 62a_200000210301_100000740924 [1,0,1,0,0,0|1,1,0]=4 2168 B10R1.176 CSc1ccc(c(c1)N)N 62a_100000741789_200000210301 [1,0,1,0,0,0|0,1,1]=4 2169 B10R1.176 CSc1ccc(c(c1)N)N 62a_200000210301_100011534411 [1,0,1,0,0,0|0,1,1]=4 2170 B10R1.176 CSc1ccc(c(c1)N)O 62a_100000752626_200000210301 [1,0,1,0,0,0|1,1,0]=4 2171 B10R1.176 CSc1ccc(c(c1)N)O 62a_200000210301_100000752626 [1,0,1,0,0,0|1,1,0]=4 2172 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 34a_100000690111_200025704644 [1,0,1,0,0,0|1,0,1]=4 2173 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 7a_100000690111_200025704644 [1,0,1,0,0,0|1,0,1]=4 2174 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 34a_100000211092_200025704644 [1,0,1,0,0,0|1,0,1]=4 2175 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 7a_100000211092_200025704644 [1,0,1,0,0,0|1,0,1]=4 2176 B10R1.176 Cc1cc(ccc1F)O[13CH3] 34a_100000751312_200025704644 [1,0,1,0,0,0|1,0,1]=4 2177 B10R1.176 Cc1cc(ccc1F)O[13CH3] 7a_100000751312_200025704644 [1,0,1,0,0,0|1,0,1]=4 2178 B10R1.176 Cc1cc(ccc1I)O[13CH3] 34a_100000729255_200025704644 [1,0,1,0,0,0|1,0,1]=4 2179 B10R1.176 Cc1cc(ccc1I)O[13CH3] 7a_100000729255_200025704644 [1,0,1,0,0,0|1,0,1]=4 2180 B10R1.176 Cc1cc(ccc1N)O[13CH3] 34a_100000756630_200025704644 [1,0,1,0,0,0|0,0,2]=4 2181 B10R1.176 Cc1cc(ccc1N)O[13CH3] 7a_100000756630_200025704644 [1,0,1,0,0,0|0,0,2]=4 2182 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 34a_100011380479_200025704644 [1,0,1,0,0,0|1,0,1]=4 2183 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 7a_100011380479_200025704644 [1,0,1,0,0,0|1,0,1]=4 2184 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [1,0,1,0,0,0|1,0,1]=4 2185 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [1,0,1,0,0,0|1,0,1]=4 2186 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 34a_100011265682_200025704644 [1,0,1,0,0,0|1,0,1]=4 2187 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 7a_100011265682_200025704644 [1,0,1,0,0,0|1,0,1]=4 2188 B10R1.176 Cc1ccc(cc1F)O[13CH3] 34a_100000722560_200025704644 [1,0,1,0,0,0|1,0,1]=4 2189 B10R1.176 Cc1ccc(cc1F)O[13CH3] 7a_100000722560_200025704644 [1,0,1,0,0,0|1,0,1]=4 2190 B10R1.176 Cc1ccc(cc1N)O[13CH3] 34a_100011216113_200025704644 [1,0,1,0,0,0|0,0,1]=3 2191 B10R1.176 Cc1ccc(cc1N)O[13CH3] 7a_100011216113_200025704644 [1,0,1,0,0,0|0,0,1]=3 2192 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_100000761890_200025704644 [1,0,1,0,0,0|0,1,1]=4 2193 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_200025704644_100000761890 [1,0,1,0,0,0|0,1,1]=4 2194 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 34a_100011933957_200025704644 [1,0,1,0,0,0|2,0,0]=4 2195 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 7a_100011933957_200025704644 [1,0,1,0,0,0|2,0,0]=4 2196 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 34a_100000693481_200025704644 [1,0,1,0,0,0|2,0,0]=4 2197 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 7a_100000693481_200025704644 [1,0,1,0,0,0|2,0,0]=4 2198 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 34a_100000701344_200025704644 [1,0,1,0,0,0|2,0,0]=4 2199 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 7a_100000701344_200025704644 [1,0,1,0,0,0|2,0,0]=4 2200 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 34a_100012001276_200025704644 [1,0,1,0,0,0|1,0,1]=4 2201 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 7a_100012001276_200025704644 [1,0,1,0,0,0|1,0,1]=4 2202 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 34a_100011215161_200025704644 [1,0,1,0,0,0|2,0,0]=4 2203 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 7a_100011215161_200025704644 [1,0,1,0,0,0|2,0,0]=4 2204 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 34a_100000211054_200025704644 [1,0,1,0,0,0|2,0,0]=4 2205 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 7a_100000211054_200025704644 [1,0,1,0,0,0|2,0,0]=4 2206 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 34a_100000211030_200025704644 [1,0,1,0,0,0|2,0,0]=4 2207 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 7a_100000211030_200025704644 [1,0,1,0,0,0|2,0,0]=4 2208 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 34a_100000047559_200025704644 [1,0,1,0,0,0|2,0,0]=4 2209 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 7a_100000047559_200025704644 [1,0,1,0,0,0|2,0,0]=4 2210 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 34a_100011215599_200025704644 [1,0,1,0,0,0|1,0,1]=4 2211 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 7a_100011215599_200025704644 [1,0,1,0,0,0|1,0,1]=4 2212 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 34a_100000755031_200025704644 [1,0,1,0,0,0|2,0,0]=4 2213 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 7a_100000755031_200025704644 [1,0,1,0,0,0|2,0,0]=4 2214 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 34a_100000691581_200025704644 [1,0,1,0,0,0|2,0,0]=4 2215 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 7a_100000691581_200025704644 [1,0,1,0,0,0|2,0,0]=4 2216 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 34a_100000181275_200025704644 [1,0,1,0,0,0|2,0,0]=4 2217 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 7a_100000181275_200025704644 [1,0,1,0,0,0|2,0,0]=4 2218 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 34a_100009990212_200025704644 [1,0,1,0,0,0|2,0,0]=4 2219 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 7a_100009990212_200025704644 [1,0,1,0,0,0|2,0,0]=4 2220 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 34a_100000759473_200025704644 [1,0,1,0,0,0|1,0,1]=4 2221 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 7a_100000759473_200025704644 [1,0,1,0,0,0|1,0,1]=4 2222 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 34a_100012339312_200025704644 [1,0,1,0,0,0|2,0,0]=4 2223 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 7a_100012339312_200025704644 [1,0,1,0,0,0|2,0,0]=4 2224 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 34a_100000049588_200025704644 [1,0,1,0,0,0|2,0,0]=4 2225 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 7a_100000049588_200025704644 [1,0,1,0,0,0|2,0,0]=4 2226 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 34a_100010084370_200025704644 [1,0,1,0,0,0|1,0,1]=4 2227 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 7a_100010084370_200025704644 [1,0,1,0,0,0|1,0,1]=4 2228 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 34a_100011999798_200025704644 [1,0,1,0,0,0|1,0,0]=3 2229 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 7a_100011999798_200025704644 [1,0,1,0,0,0|1,0,0]=3 2230 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Cl 34a_100011934297_200025704644 [1,0,1,0,0,0|1,0,0]=3 2231 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 34a_100012017239_200025704644 [1,0,1,0,0,0|1,0,0]=3 2232 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 7a_100012017239_200025704644 [1,0,1,0,0,0|1,0,0]=3 2233 B10R1.176 [13CH3]Oc1ccc(c(c1)N)N 34a_100025771000_200025704644 [1,0,1,0,0,0|0,0,1]=3 2234 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_100000750456_200025704644 [1,0,1,0,0,0|1,1,0]=4 2235 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_200025704644_100000750456 [1,0,1,0,0,0|1,1,0]=4 2236 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200000761891_200025704644 [1,0,1,0,0,0|1,1,0]=4 2237 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200025704644_200000761891 [1,0,1,0,0,0|1,1,0]=4 2238 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_100000740924_200025704644 [1,0,1,0,0,0|1,1,0]=4 2239 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_200025704644_100000740924 [1,0,1,0,0,0|1,1,0]=4 2240 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_100000741789_200025704644 [1,0,1,0,0,0|0,1,1]=4 2241 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_200025704644_100011534411 [1,0,1,0,0,0|0,1,1]=4 2242 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_100000752626_200025704644 [1,0,1,0,0,0|1,1,0]=4 2243 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_200025704644_100000752626 [1,0,1,0,0,0|1,1,0]=4 2244 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [1,0,1,0,0,0|2,0,0]=4 2245 B10R1.30 C=Cc1cc(ccc1Br)O 271570a_100011290941_100012339312 [1,0,1,0,0,0|2,0,0]=4 2246 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [1,0,1,0,0,0|2,0,0]=4 2247 B10R1.30 C=Cc1cc(ccc1C)O 271570a_100011290941_100011380479 [1,0,1,0,0,0|2,0,0]=4 2248 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [1,0,1,0,0,0|2,0,0]=4 2249 B10R1.30 C=Cc1cc(ccc1Cl)O 271570a_100011290941_100000049588 [1,0,1,0,0,0|2,0,0]=4 2250 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [1,0,1,0,0,0|2,0,0]=4 2251 B10R1.30 C=Cc1cc(ccc1F)O 271570a_100011290941_100000693481 [1,0,1,0,0,0|2,0,0]=4 2252 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [1,0,1,0,0,0|1,0,1]=4 2253 B10R1.30 C=Cc1cc(ccc1N)O 271570a_100011290941_100012001276 [1,0,1,0,0,0|1,0,1]=4 2254 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [1,0,1,0,0,0|2,0,0]=4 2255 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [1,0,1,0,0,0|2,0,0]=4 2256 B10R1.30 CNc1cc(ccc1Br)C 34a_100000745044_200000210301 [1,0,1,0,0,0|1,0,1]=4 2257 B10R1.30 CNc1cc(ccc1Br)O 34a_100011999798_200000210301 [1,0,1,0,0,0|1,0,1]=4 2258 B10R1.30 CNc1cc(ccc1C)C 2230a_100000185781_200000210301 [1,0,1,0,0,0|1,0,1]=4 2259 B10R1.30 CNc1cc(ccc1C)C 34a_100000185781_200000210301 [1,0,1,0,0,0|1,0,1]=4 2260 B10R1.30 CNc1cc(ccc1C)C 7a_100000185781_200000210301 [1,0,1,0,0,0|1,0,1]=4 2261 B10R1.30 CNc1cc(ccc1C)O 271570a_203496583355_100020629602 [1,0,1,0,0,0|1,0,1]=4 2262 B10R1.30 CNc1cc(ccc1C)O 34a_100011216113_200000210301 [1,0,1,0,0,0|1,0,1]=4 2263 B10R1.30 CNc1cc(ccc1Cl)C 34a_100011215360_200000210301 [1,0,1,0,0,0|1,0,1]=4 2264 B10R1.30 CNc1cc(ccc1Cl)O 34a_100011934297_200000210301 [1,0,1,0,0,0|1,0,1]=4 2265 B10R1.30 CNc1cc(ccc1F)C 34a_100000211285_200000210301 [1,0,1,0,0,0|1,0,1]=4 2266 B10R1.30 CNc1cc(ccc1F)O 271570a_203496583355_100011314990 [1,0,1,0,0,0|1,0,1]=4 2267 B10R1.30 CNc1cc(ccc1F)O 34a_100012017239_200000210301 [1,0,1,0,0,0|1,0,1]=4 2268 B10R1.30 CNc1cc(ccc1I)C 34a_100011216686_200000210301 [1,0,1,0,0,0|1,0,1]=4 2269 B10R1.30 CNc1cc(ccc1N)O 271570a_203496583355_100000694363 [1,0,1,0,0,0|0,0,2]=4 2270 B10R1.30 CNc1cc(ccc1O)C 34a_100011215204_200000210301 [1,0,1,0,0,0|1,0,1]=4 2271 B10R1.30 Cc1ccc(c(c1)N[13CH3])Br 34a_100000745044_200025704644 [1,0,1,0,0,0|1,0,1]=4 2272 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 2230a_100000185781_200025704644 [1,0,1,0,0,0|1,0,1]=4 2273 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 34a_100000185781_200025704644 [1,0,1,0,0,0|1,0,1]=4 2274 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 7a_100000185781_200025704644 [1,0,1,0,0,0|1,0,1]=4 2275 B10R1.30 Cc1ccc(c(c1)N[13CH3])Cl 34a_100011215360_200025704644 [1,0,1,0,0,0|1,0,1]=4 2276 B10R1.30 Cc1ccc(c(c1)N[13CH3])F 34a_100000211285_200025704644 [1,0,1,0,0,0|1,0,1]=4 2277 B10R1.30 Cc1ccc(c(c1)N[13CH3])I 34a_100011216686_200025704644 [1,0,1,0,0,0|1,0,1]=4 2278 B10R1.30 Cc1ccc(c(c1)N[13CH3])O 34a_100011215204_200025704644 [1,0,1,0,0,0|1,0,1]=4 2279 B10R1.30 Cc1ccc(cc1N[13CH3])O 34a_100011216113_200025704644 [1,0,1,0,0,0|1,0,1]=4 2280 B10R1.30 NNc1cc(ccc1F)O 271570a_203496583355_100020610843 [1,0,1,0,0,0|2,0,0]=4 2281 B10R1.30 [13CH3]Nc1cc(ccc1Br)O 34a_100011999798_200025704644 [1,0,1,0,0,0|1,0,1]=4 2282 B10R1.30 [13CH3]Nc1cc(ccc1Cl)O 34a_100011934297_200025704644 [1,0,1,0,0,0|1,0,1]=4 2283 B10R1.30 [13CH3]Nc1cc(ccc1F)O 34a_100012017239_200025704644 [1,0,1,0,0,0|1,0,1]=4 2284 B12R1.51 CCCC(=O)C=Cc1c[nH]cn1 1458a_100102678534_100000210303 [0,1,1,0,0,0|2,0,0]=4 2285 B12R1.51 CCNC(=O)C=Cc1c[nH]cn1 240690a_100015525214_100102678534 [0,1,1,0,0,0|2,0,0]=4 2286 B12R1.51 CCOC(=O)C=Cc1c[nH]cn1 271570a_100010199719_100000756875 [0,1,1,0,0,0|1,0,0]=3 2287 B12R1.51 CCOC(=O)C=Cc1cscn1 271570a_100010199719_100000751502 [0,1,1,0,0,0|2,0,0]=4 2288 B12R1.51 CCOC(=O)C=Cc1nc[nH]n1 271570a_100010199719_100000761765 [0,1,1,0,0,0|2,0,0]=4 2289 B12R1.51 CNNC(=O)C=Cc1c[nH]cn1 22a_100016993582_100102678534 [0,1,1,0,0,0|2,0,0]=4 2290 B12R1.51 O=C(C=Cc1c[nH]cn1)CCF 1458a_100102678534_100011217306 [0,1,1,0,0,0|2,0,0]=4 2291 B12R1.51 O=C(C=Cc1c[nH]cn1)CCO 1458a_100102678534_100000211926 [0,1,1,0,0,0|2,0,0]=4 2292 B12R1.264 CC(C)C(=O)C=Cc1c[nH]cn1 1458a_100102678534_100000210206 [0,1,1,0,0,0|2,0,0]=4 2293 B12R1.264 CN(C)C(=O)C=Cc1c[nH]cn1 240690a_100102631434_100102678534 [0,1,1,0,0,0|2,0,0]=4 2294 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [0,1,1,0,0,0|2,0,0]=4 2295 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [0,1,1,0,0,0|2,0,0]=4 2296 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000184395_200025704644 [0,1,1,0,0,0|1,0,1]=4 2297 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 7a_100000184395_200025704644 [0,1,1,0,0,0|1,0,1]=4 2298 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [0,1,1,0,0,0|1,0,1]=4 2299 B12R1.4 CNc1ccc(cc1)CC(=O)N 2230a_100000738315_200000210301 [0,1,1,0,0,0|2,0,0]=4 2300 B12R1.4 CNc1ccc(cc1)CC(=O)N 34a_100000738315_200000210301 [0,1,1,0,0,0|2,0,0]=4 2301 B12R1.4 COc1ccc(cc1)C=C(C)C 271570a_100102525489_100000171711 [0,1,1,0,0,0|2,0,0]=4 2302 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [0,1,1,0,0,0|2,0,0]=4 2303 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [0,1,1,0,0,0|2,0,0]=4 2304 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [0,1,1,0,0,0|2,0,0]=4 2305 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [0,1,1,0,0,0|1,0,0]=3 2306 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [0,1,1,0,0,0|2,0,0]=4 2307 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [0,1,1,0,0,0|1,0,1]=4 2308 B12R1.4 COc1ccc(cc1)NC(=O)C 11a_100000184247_100015343762 [0,1,1,0,0,0|1,0,1]=4 2309 B12R1.4 COc1ccc(cc1)NC(=O)C 1626a_100000184247_100015343762 [0,1,1,0,0,0|1,0,1]=4 2310 B12R1.4 COc1ccc(cc1)NC(=O)C 22a_100000184247_100000070787 [0,1,1,0,0,0|1,0,1]=4 2311 B12R1.4 COc1ccc(cc1)NC(=O)C 34a_100000184395_200000210301 [0,1,1,0,0,0|1,0,1]=4 2312 B12R1.4 COc1ccc(cc1)NC(=O)C 527a_100000184247_100103153847 [0,1,1,0,0,0|1,0,1]=4 2313 B12R1.4 COc1ccc(cc1)NC(=O)C 7a_100000184395_200000210301 [0,1,1,0,0,0|1,0,1]=4 2314 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_100000162331_200000210301 [0,1,1,0,0,0|1,1,0]=4 2315 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_200000210301_100000162331 [0,1,1,0,0,0|1,1,0]=4 2316 B12R1.4 CSc1ccc(cc1)NC(=O)N 62a_200000210301_100000198584 [0,1,1,0,0,0|0,1,1]=4 2317 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 2230a_100000738315_200025704644 [0,1,1,0,0,0|2,0,0]=4 2318 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 34a_100000738315_200025704644 [0,1,1,0,0,0|2,0,0]=4 2319 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [0,1,1,0,0,0|1,0,0]=3 2320 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_100000162331_200025704644 [0,1,1,0,0,0|1,1,0]=4 2321 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_200025704644_100000162331 [0,1,1,0,0,0|1,1,0]=4 2322 B12R1.4 [13CH3]Sc1ccc(cc1)NC(=O)N 62a_200025704644_100000198584 [0,1,1,0,0,0|0,1,1]=4 2323 B12R1.5 CC(CN)c1ccc(cc1)O[13CH3] 34a_200015188644_200025704644 [0,1,1,0,0,0|1,0,1]=4 2324 B12R1.5 COc1ccc(cc1)C(=O)NN 34a_100000185078_200000210301 [0,1,1,0,0,0|2,0,0]=4 2325 B12R1.5 COc1ccc(cc1)C(C)CN 34a_200015188644_200000210301 [0,1,1,0,0,0|1,0,1]=4 2326 B12R1.5 COc1ccc(cc1)C(O)CN 34a_100000067596_200000210301 [0,1,1,0,0,0|1,0,1]=4 2327 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)NN 34a_100000185078_200025704644 [0,1,1,0,0,0|2,0,0]=4 2328 B12R1.5 [13CH3]Oc1ccc(cc1)C(O)CN 34a_100000067596_200025704644 [0,1,1,0,0,0|1,0,1]=4 2329 B12R1.71 C=CCNc1ccc(cc1)OC 34a_100000184247_100015514636 [0,1,1,0,0,0|1,0,1]=4 2330 B12R1.71 C=CCOc1ccc(cc1)OC 34a_100000210503_100015514636 [0,1,1,0,0,0|2,0,0]=4 2331 B12R1.71 C=CCSc1ccc(cc1)OC 62a_100000210623_100000171711 [0,1,1,0,0,0|2,0,0]=4 2332 B12R1.71 CC=NNc1ccc(cc1)CC 4a_100015204395_200000210099 [0,1,1,0,0,0|2,0,0]=4 2333 B12R1.71 CC=NNc1ccc(cc1)OC 4a_100000005221_200000210099 [0,1,1,0,0,0|1,0,0]=3 2334 B12R1.71 CC=NNc1ccc(cc1)SC 4a_100000006515_200000210099 [0,1,1,0,0,0|1,1,0]=4 2335 B12R1.71 CC=NNc1ccc(nc1)OC 4a_100102564821_200000210099 [0,1,1,0,0,0|2,0,0]=4 2336 B12R1.71 CNCCc1ccc(cc1)OC 2230a_100000210796_200000210301 [0,1,1,0,0,0|1,0,1]=4 2337 B12R1.71 CNCCc1ccc(cc1)OC 2230a_106832991635_100011713689 [0,1,1,0,0,0|1,0,1]=4 2338 B12R1.71 CNCCc1ccc(cc1)OC 270004a_106832991635_100011242372 [0,1,1,0,0,0|1,0,1]=4 2339 B12R1.71 CNCCc1ccc(cc1)OC 34a_100000210796_200000210301 [0,1,1,0,0,0|1,0,1]=4 2340 B12R1.71 CNCCc1ccc(cc1)OC 34a_100016989440_200000210301 [0,1,1,0,0,0|1,0,1]=4 2341 B12R1.71 CNCCc1ccc(cc1)OC 34a_100102657272_100000184700 [0,1,1,0,0,0|1,0,1]=4 2342 B12R1.71 CNCCc1ccc(cc1)OC 7a_106832991635_100000184700 [0,1,1,0,0,0|1,0,1]=4 2343 B12R1.71 CNCCc1ccc(cc1)O[13CH3] 34a_100016989440_200025704644 [0,1,1,0,0,0|1,0,1]=4 2344 B12R1.71 COc1ccc(cc1)CCN[13CH3] 2230a_100000210796_200025704644 [0,1,1,0,0,0|1,0,1]=4 2345 B12R1.71 COc1ccc(cc1)CCN[13CH3] 34a_100000210796_200025704644 [0,1,1,0,0,0|1,0,1]=4 2346 B12R1.71 COc1ccc(cc1)NCC=O 34a_100000184247_200009817547 [0,1,1,0,0,0|1,0,1]=4 2347 B12R1.71 COc1ccc(cc1)OCC=O 34a_100000210503_200009817547 [0,1,1,0,0,0|2,0,0]=4 2348 B12R1.71 COc1ccc(cc1)SCC=O 62a_200015260668_100000171711 [0,1,1,0,0,0|2,0,0]=4 2349 B12R1.114 CC=Cc1ccc(cc1Br)OC 271570a_100016259895_100012349170 [0,1,1,0,0,0|2,0,0]=4 2350 B12R1.114 CC=Cc1ccc(cc1C)OC 271570a_100016259895_100000759875 [0,1,1,0,0,0|2,0,0]=4 2351 B12R1.114 CC=Cc1ccc(cc1F)OC 271570a_100016259895_100000753793 [0,1,1,0,0,0|2,0,0]=4 2352 B12R1.114 CC=Cc1ccc(cc1N)OC 271570a_100016259895_100000748021 [0,1,1,0,0,0|2,0,0]=4 2353 B12R1.114 CC=Cc1ccc(cc1O)OC 271570a_100016259895_100000719091 [0,1,1,0,0,0|2,0,0]=4 2354 B12R1.116 C=CCc1ccc(cc1)OCC 34a_100000078792_100000210202 [0,1,1,0,0,0|2,0,0]=4 2355 B12R1.116 C=CCc1ccc(cc1)OCC 7a_100000078792_100000210202 [0,1,1,0,0,0|2,0,0]=4 2356 B12R1.116 C=CCc1ccc(cc1)OCF 34a_100000078792_100015361967 [0,1,1,0,0,0|2,0,0]=4 2357 B12R1.116 C=CCc1ccc(cc1)OCF 7a_100000078792_100015361967 [0,1,1,0,0,0|2,0,0]=4 2358 B12R1.116 CC=Cc1ccc(cc1)COC 271570a_100016259895_100011493685 [0,1,1,0,0,0|2,0,0]=4 2359 B12R1.116 CC=Cc1ccc(cc1)OCC 271570a_100016259895_100000169946 [0,1,1,0,0,0|2,0,0]=4 2360 B12R1.116 CCOc1ccc(cc1)CCN 34a_100000743037_100000210202 [0,1,1,0,0,0|1,0,1]=4 2361 B12R1.116 NCCc1ccc(cc1)OCF 34a_100000743037_100015361967 [0,1,1,0,0,0|1,0,1]=4 2362 B12R1.288 CC=Cc1ccc(c(c1)Br)OC 271570a_100016259895_100011249507 [0,1,1,0,0,0|2,0,0]=4 2363 B12R1.288 CC=Cc1ccc(c(c1)C)OC 271570a_100016259895_100011219705 [0,1,1,0,0,0|2,0,0]=4 2364 B12R1.288 CC=Cc1ccc(c(c1)Cl)OC 271570a_100016259895_100012355395 [0,1,1,0,0,0|2,0,0]=4 2365 B12R1.288 CC=Cc1ccc(c(c1)F)OC 271570a_100016259895_100000185480 [0,1,1,0,0,0|2,0,0]=4 2366 B12R1.288 CC=Cc1ccc(c(c1)N)OC 271570a_100016259895_100000743470 [0,1,1,0,0,0|2,0,0]=4 2367 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [0,1,1,0,0,0|2,0,0]=4 2368 B12R1.288 COc1ccc(cc1O)CCN 271570a_203496583355_103549771065 [0,1,1,0,0,0|1,0,1]=4 2369 B12R1.41 CC=Cc1cc(cc(c1)OC)Br 271570a_100016259895_100010141301 [0,1,1,0,0,0|2,0,0]=4 2370 B12R1.41 CC=Cc1cc(cc(c1)OC)C 271570a_100016259895_100010187550 [0,1,1,0,0,0|2,0,0]=4 2371 B12R1.41 CC=Cc1cc(cc(c1)OC)Cl 271570a_100016259895_100010147680 [0,1,1,0,0,0|2,0,0]=4 2372 B12R1.41 CC=Cc1cc(cc(c1)OC)F 271570a_100016259895_100011934182 [0,1,1,0,0,0|2,0,0]=4 2373 B12R1.41 CC=Cc1cc(cc(c1)OC)N 271570a_100016259895_100000750983 [0,1,1,0,0,0|2,0,0]=4 2374 B12R1.41 CC=Cc1cc(cc(c1)OC)O 271570a_100016259895_100010068927 [0,1,1,0,0,0|2,0,0]=4 2375 B12R1.41 CCNc1cc(cc(c1)OC)Br 34a_100000750983_100000210202 [0,1,1,0,0,0|1,0,1]=4 2376 B12R1.41 CCNc1cc(cc(c1)OC)Br 7a_100000750983_100000210202 [0,1,1,0,0,0|1,0,1]=4 2377 B12R1.41 CCNc1cc(cc(c1)OC)C 2230a_100012001870_100000210202 [0,1,1,0,0,0|1,0,1]=4 2378 B12R1.41 CCNc1cc(cc(c1)OC)C 34a_100012001870_100000210202 [0,1,1,0,0,0|1,0,1]=4 2379 B12R1.41 CCNc1cc(cc(c1)OC)C 7a_100012001870_100000210202 [0,1,1,0,0,0|1,0,1]=4 2380 B12R1.41 CCNc1cc(cc(c1)OC)Cl 2230a_100000051436_100000210202 [0,1,1,0,0,0|1,0,1]=4 2381 B12R1.41 CCNc1cc(cc(c1)OC)Cl 34a_100000051436_100000210202 [0,1,1,0,0,0|1,0,1]=4 2382 B12R1.41 CCNc1cc(cc(c1)OC)Cl 7a_100000051436_100000210202 [0,1,1,0,0,0|1,0,1]=4 2383 B12R1.41 CCNc1cc(cc(c1)OC)F 2230a_100000687699_100000210202 [0,1,1,0,0,0|1,0,1]=4 2384 B12R1.41 CCNc1cc(cc(c1)OC)F 34a_100000687699_100000210202 [0,1,1,0,0,0|1,0,1]=4 2385 B12R1.41 CCNc1cc(cc(c1)OC)F 7a_100000687699_100000210202 [0,1,1,0,0,0|1,0,1]=4 2386 B12R1.41 CCNc1cc(cc(c1)OC)O 34a_200000692186_100000210202 [0,1,1,0,0,0|1,0,1]=4 2387 B12R1.41 COc1cc(cc(c1)NCF)Br 34a_100000750983_100015361967 [0,1,1,0,0,0|1,0,1]=4 2388 B12R1.41 COc1cc(cc(c1)NCF)Br 7a_100000750983_100015361967 [0,1,1,0,0,0|1,0,1]=4 2389 B12R1.41 COc1cc(cc(c1)NCF)C 34a_100012001870_100015361967 [0,1,1,0,0,0|1,0,1]=4 2390 B12R1.41 COc1cc(cc(c1)NCF)C 7a_100012001870_100015361967 [0,1,1,0,0,0|1,0,1]=4 2391 B12R1.41 COc1cc(cc(c1)NCF)Cl 34a_100000051436_100015361967 [0,1,1,0,0,0|1,0,1]=4 2392 B12R1.41 COc1cc(cc(c1)NCF)Cl 7a_100000051436_100015361967 [0,1,1,0,0,0|1,0,1]=4 2393 B12R1.41 COc1cc(cc(c1)NCF)F 34a_100000687699_100015361967 [0,1,1,0,0,0|1,0,1]=4 2394 B12R1.41 COc1cc(cc(c1)NCF)F 7a_100000687699_100015361967 [0,1,1,0,0,0|1,0,1]=4 2395 B12R1.41 COc1cc(cc(c1)NCF)O 34a_200000692186_100015361967 [0,1,1,0,0,0|1,0,1]=4 2396 B12R1.270 CC=Cc1cc(ccc1Br)OC 271570a_100016259895_100009992028 [0,1,1,0,0,0|2,0,0]=4 2397 B12R1.270 CC=Cc1cc(ccc1C)OC 271570a_100016259895_100012349166 [0,1,1,0,0,0|2,0,0]=4 2398 B12R1.270 CC=Cc1cc(ccc1Cl)OC 271570a_100016259895_100011356938 [0,1,1,0,0,0|2,0,0]=4 2399 B12R1.270 CC=Cc1cc(ccc1F)OC 271570a_100016259895_100000699733 [0,1,1,0,0,0|2,0,0]=4 2400 B12R1.270 CC=Cc1cc(ccc1N)OC 271570a_100016259895_100015195136 [0,1,1,0,0,0|2,0,0]=4 2401 B12R1.270 CC=Cc1cc(ccc1O)OC 271570a_100016259895_100000685887 [0,1,1,0,0,0|2,0,0]=4 2402 B12R1.270 CCNc1cc(ccc1Br)OC 34a_100000748603_100000210202 [0,1,1,0,0,0|1,0,1]=4 2403 B12R1.270 CCNc1cc(ccc1C)OC 2230a_100000760359_100000210202 [0,1,1,0,0,0|1,0,1]=4 2404 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000211784_200000210301 [0,1,1,0,0,0|1,0,1]=4 2405 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000760359_100000210202 [0,1,1,0,0,0|1,0,1]=4 2406 B12R1.270 CCNc1cc(ccc1C)OC 7a_100000211784_200000210301 [0,1,1,0,0,0|1,0,1]=4 2407 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 34a_100000211784_200025704644 [0,1,1,0,0,0|1,0,1]=4 2408 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 7a_100000211784_200025704644 [0,1,1,0,0,0|1,0,1]=4 2409 B12R1.270 CCNc1cc(ccc1Cl)OC 34a_100000745576_100000210202 [0,1,1,0,0,0|1,0,1]=4 2410 B12R1.270 CCNc1cc(ccc1F)OC 34a_100000764331_100000210202 [0,1,1,0,0,0|1,0,1]=4 2411 B12R1.270 CCNc1cc(ccc1I)OC 34a_100000748021_100000210202 [0,1,1,0,0,0|1,0,1]=4 2412 B12R1.270 CCNc1cc(ccc1O)OC 34a_100000188146_100000210202 [0,1,1,0,0,0|1,0,1]=4 2413 B12R1.270 COc1ccc(c(c1)NCF)Br 34a_100000748603_100015361967 [0,1,1,0,0,0|1,0,1]=4 2414 B12R1.270 COc1ccc(c(c1)NCF)C 34a_100000760359_100015361967 [0,1,1,0,0,0|1,0,1]=4 2415 B12R1.270 COc1ccc(c(c1)NCF)Cl 34a_100000745576_100015361967 [0,1,1,0,0,0|1,0,1]=4 2416 B12R1.270 COc1ccc(c(c1)NCF)F 34a_100000764331_100015361967 [0,1,1,0,0,0|1,0,1]=4 2417 B12R1.270 COc1ccc(c(c1)NCF)I 34a_100000748021_100015361967 [0,1,1,0,0,0|1,0,1]=4 2418 B12R1.270 COc1ccc(c(c1)NCF)O 34a_100000188146_100015361967 [0,1,1,0,0,0|1,0,1]=4 2419 B12R1.278 CC=Cc1cccc(c1)COC 271570a_100016259895_100011493687 [0,1,1,0,0,0|2,0,0]=4 2420 B12R1.278 CC=Cc1cccc(c1)OCC 271570a_100016259895_100000170002 [0,1,1,0,0,0|2,0,0]=4 2421 B12R1.278 CCNc1cccc(c1)COC 2230a_100000737370_100000210202 [0,1,1,0,0,0|1,0,1]=4 2422 B12R1.278 CCNc1cccc(c1)COC 34a_100000737370_100000210202 [0,1,1,0,0,0|1,0,1]=4 2423 B12R1.278 CCNc1cccc(c1)OCC 2230a_100000742568_100000210202 [0,1,1,0,0,0|1,0,1]=4 2424 B12R1.278 CCNc1cccc(c1)OCC 34a_100000717746_100000210202 [0,1,1,0,0,0|1,0,1]=4 2425 B12R1.278 CCNc1cccc(c1)OCC 34a_100000742568_100000210202 [0,1,1,0,0,0|1,0,1]=4 2426 B12R1.278 CCNc1cccc(c1)OCC 7a_100000717746_100000210202 [0,1,1,0,0,0|1,0,1]=4 2427 B12R1.278 CCNc1cccc(c1)OCF 34a_100000717746_100015361967 [0,1,1,0,0,0|1,0,1]=4 2428 B12R1.278 CCNc1cccc(c1)OCF 7a_100000717746_100015361967 [0,1,1,0,0,0|1,0,1]=4 2429 B12R1.278 CCOc1cccc(c1)NCF 34a_100000742568_100015361967 [0,1,1,0,0,0|1,0,1]=4 2430 B12R1.278 COCc1cccc(c1)NCF 34a_100000737370_100015361967 [0,1,1,0,0,0|1,0,1]=4 2431 B12R1.280 CC=Cc1cccc(c1C)OC 271570a_100016259895_100010002647 [0,1,1,0,0,0|2,0,0]=4 2432 B12R1.280 CC=Cc1cccc(c1Cl)OC 271570a_100016259895_100010147677 [0,1,1,0,0,0|2,0,0]=4 2433 B12R1.280 CC=Cc1cccc(c1F)OC 271570a_100016259895_100010185846 [0,1,1,0,0,0|2,0,0]=4 2434 B12R1.280 CC=Cc1cccc(c1N)OC 271570a_100016259895_100000708083 [0,1,1,0,0,0|2,0,0]=4 2435 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [0,1,1,0,0,0|2,0,0]=4 2436 B12R1.280 CCNc1cccc(c1Br)OC 34a_100000703447_100000210202 [0,1,1,0,0,0|1,0,1]=4 2437 B12R1.280 CCNc1cccc(c1C)OC 34a_100011244893_100000210202 [0,1,1,0,0,0|1,0,1]=4 2438 B12R1.280 CCNc1cccc(c1C)OC 7a_100011244893_100000210202 [0,1,1,0,0,0|1,0,1]=4 2439 B12R1.280 CCNc1cccc(c1Cl)OC 34a_100000089720_100000210202 [0,1,1,0,0,0|1,0,1]=4 2440 B12R1.280 CCNc1cccc(c1F)OC 34a_100000100910_100000210202 [0,1,1,0,0,0|1,0,1]=4 2441 B12R1.280 CCNc1cccc(c1I)OC 34a_100010245509_100000210202 [0,1,1,0,0,0|1,0,1]=4 2442 B12R1.280 CCNc1cccc(c1O)OC 34a_100000123586_100000210202 [0,1,1,0,0,0|1,0,1]=4 2443 B12R1.280 COc1cccc(c1Br)NCF 34a_100000703447_100015361967 [0,1,1,0,0,0|1,0,1]=4 2444 B12R1.280 COc1cccc(c1C)NCF 34a_100011244893_100015361967 [0,1,1,0,0,0|1,0,1]=4 2445 B12R1.280 COc1cccc(c1C)NCF 7a_100011244893_100015361967 [0,1,1,0,0,0|1,0,1]=4 2446 B12R1.280 COc1cccc(c1Cl)NCF 34a_100000089720_100015361967 [0,1,1,0,0,0|1,0,1]=4 2447 B12R1.280 COc1cccc(c1F)NCF 34a_100000100910_100015361967 [0,1,1,0,0,0|1,0,1]=4 2448 B12R1.280 COc1cccc(c1I)NCF 34a_100010245509_100015361967 [0,1,1,0,0,0|1,0,1]=4 2449 B12R1.280 COc1cccc(c1O)NCF 34a_100000123586_100015361967 [0,1,1,0,0,0|1,0,1]=4 2450 B12R1.286 CC=Cc1ccc(c(c1)OC)Br 271570a_100016259895_100012353699 [0,1,1,0,0,0|2,0,0]=4 2451 B12R1.286 CC=Cc1ccc(c(c1)OC)C 271570a_100016259895_100011830276 [0,1,1,0,0,0|2,0,0]=4 2452 B12R1.286 CC=Cc1ccc(c(c1)OC)Cl 271570a_100016259895_100011356853 [0,1,1,0,0,0|2,0,0]=4 2453 B12R1.286 CC=Cc1ccc(c(c1)OC)F 271570a_100016259895_100011934186 [0,1,1,0,0,0|2,0,0]=4 2454 B12R1.286 CC=Cc1ccc(c(c1)OC)N 271570a_100016259895_100011279103 [0,1,1,0,0,0|2,0,0]=4 2455 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [0,1,1,0,0,0|2,0,0]=4 2456 B12R1.286 CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210202 [0,1,1,0,0,0|1,0,1]=4 2457 B12R1.286 CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210202 [0,1,1,0,0,0|1,0,1]=4 2458 B12R1.286 CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210202 [0,1,1,0,0,0|1,0,1]=4 2459 B12R1.286 CCNc1ccc(c(c1)OC)C 34a_100011279678_100000210202 [0,1,1,0,0,0|1,0,1]=4 2460 B12R1.286 CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210202 [0,1,1,0,0,0|1,0,1]=4 2461 B12R1.286 CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210202 [0,1,1,0,0,0|1,0,1]=4 2462 B12R1.286 CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210202 [0,1,1,0,0,0|1,0,1]=4 2463 B12R1.286 CCNc1ccc(c(c1)OC)F 34a_100000701188_100000210202 [0,1,1,0,0,0|1,0,1]=4 2464 B12R1.286 CCNc1ccc(c(c1)OC)I 34a_100000746945_100000210202 [0,1,1,0,0,0|1,0,1]=4 2465 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [0,1,1,0,0,0|1,0,1]=4 2466 B12R1.286 COc1cc(ccc1Br)NCF 34a_100000765947_100015361967 [0,1,1,0,0,0|1,0,1]=4 2467 B12R1.286 COc1cc(ccc1C)NCF 34a_100011279678_100015361967 [0,1,1,0,0,0|1,0,1]=4 2468 B12R1.286 COc1cc(ccc1Cl)NCF 34a_100000742311_100015361967 [0,1,1,0,0,0|1,0,1]=4 2469 B12R1.286 COc1cc(ccc1F)NCF 34a_100000701188_100015361967 [0,1,1,0,0,0|1,0,1]=4 2470 B12R1.286 COc1cc(ccc1I)NCF 34a_100000746945_100015361967 [0,1,1,0,0,0|1,0,1]=4 2471 B12R1.286 COc1cc(ccc1O)NCF 34a_100000726020_100015361967 [0,1,1,0,0,0|1,0,1]=4 2472 B12R1.382 C#CCNc1cccc(c1)OC 34a_100000210024_100000184674 [0,1,1,0,0,0|1,0,1]=4 2473 B12R1.382 C=CCNc1cccc(c1)CC 2230a_100000211250_100000210623 [0,1,1,0,0,0|2,0,0]=4 2474 B12R1.382 C=CCNc1cccc(c1)CC 34a_100000211250_100015514636 [0,1,1,0,0,0|2,0,0]=4 2475 B12R1.382 C=CCNc1cccc(c1)CC 7a_100000211250_100015514636 [0,1,1,0,0,0|2,0,0]=4 2476 B12R1.382 C=CCNc1cccc(c1)OC 34a_100000210024_100015514636 [0,1,1,0,0,0|1,0,0]=3 2477 B12R1.382 C=CCNc1cccc(c1)SC 2230a_100000210049_100000210623 [0,1,1,0,0,0|1,1,0]=4 2478 B12R1.382 C=CCNc1cccc(c1)SC 34a_100000210049_100015514636 [0,1,1,0,0,0|1,1,0]=4 2479 B12R1.382 C=CCOc1cccc(c1)OC 34a_100000211255_100015514636 [0,1,1,0,0,0|2,0,0]=4 2480 B12R1.382 C=CCOc1cccc(c1)OC 7a_100000211255_100015514636 [0,1,1,0,0,0|2,0,0]=4 2481 B12R1.382 C=CCSc1cccc(c1)OC 62a_100000210623_100000170001 [0,1,1,0,0,0|2,0,0]=4 2482 B12R1.382 CC=NNc1cccc(c1)OC 4a_100000722927_200000210099 [0,1,1,0,0,0|1,0,0]=3 2483 B12R1.382 CC=NNc1cccc(n1)OC 4a_100000698482_200000210099 [0,1,1,0,0,0|2,0,0]=4 2484 B12R1.382 CCCNc1cccc(c1)OC 34a_100000210024_100000210303 [0,1,1,0,0,0|1,0,1]=4 2485 B12R1.382 CCNCc1cccc(c1)OC 207a_100015525214_100000170238 [0,1,1,0,0,0|1,0,1]=4 2486 B12R1.382 CCNCc1cccc(c1)OC 2230a_100000174954_100000210202 [0,1,1,0,0,0|1,0,1]=4 2487 B12R1.382 CCNCc1cccc(c1)OC 2230a_100015525214_100000211672 [0,1,1,0,0,0|1,0,1]=4 2488 B12R1.382 CCNCc1cccc(c1)OC 270004a_100015525214_100000170238 [0,1,1,0,0,0|1,0,1]=4 2489 B12R1.382 CCNCc1cccc(c1)OC 34a_100000174954_100000210202 [0,1,1,0,0,0|1,0,1]=4 2490 B12R1.382 CCNCc1cccc(c1)OC 34a_100000201218_200000210301 [0,1,1,0,0,0|1,0,1]=4 2491 B12R1.382 CCNCc1cccc(c1)O[13CH3] 34a_100000201218_200025704644 [0,1,1,0,0,0|1,0,1]=4 2492 B12R1.382 CCc1cccc(c1)NCC=O 2230a_100000211250_200015260668 [0,1,1,0,0,0|2,0,0]=4 2493 B12R1.382 CCc1cccc(c1)NCC=O 34a_100000211250_200009817547 [0,1,1,0,0,0|2,0,0]=4 2494 B12R1.382 CCc1cccc(c1)NCC=O 7a_100000211250_200015260668 [0,1,1,0,0,0|2,0,0]=4 2495 B12R1.382 COc1cccc(c1)CNCF 34a_100000174954_100015361967 [0,1,1,0,0,0|1,0,1]=4 2496 B12R1.382 COc1cccc(c1)NCC=O 34a_100000210024_200009817547 [0,1,1,0,0,0|1,0,0]=3 2497 B12R1.382 COc1cccc(c1)NCCF 34a_100000210024_100011217306 [0,1,1,0,0,0|1,0,1]=4 2498 B12R1.382 COc1cccc(c1)NCCO 34a_100000210024_100000211926 [0,1,1,0,0,0|1,0,1]=4 2499 B12R1.382 COc1cccc(c1)NCSC 34a_100000210024_100011218213 [0,1,1,0,0,0|1,0,1]=4 2500 B12R1.382 COc1cccc(c1)OCC=O 34a_100000211255_200009817547 [0,1,1,0,0,0|2,0,0]=4 2501 B12R1.382 COc1cccc(c1)OCC=O 7a_100000211255_200015260668 [0,1,1,0,0,0|2,0,0]=4 2502 B12R1.382 COc1cccc(c1)SCC=O 62a_200015260668_100000170001 [0,1,1,0,0,0|2,0,0]=4 2503 B12R1.382 CSc1cccc(c1)NCC=O 2230a_100000210049_200015260668 [0,1,1,0,0,0|1,1,0]=4 2504 B12R1.382 CSc1cccc(c1)NCC=O 34a_100000210049_200009817547 [0,1,1,0,0,0|1,1,0]=4 2505 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219725_100000210202 [0,1,1,0,0,0|1,0,1]=4 2506 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219733_200000210301 [0,1,1,0,0,0|1,0,1]=4 2507 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219725_100000204670 [0,1,1,0,0,0|1,0,1]=4 2508 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219733_200000210301 [0,1,1,0,0,0|1,0,1]=4 2509 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219725_100000210202 [0,1,1,0,0,0|1,0,1]=4 2510 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219733_200000210301 [0,1,1,0,0,0|1,0,1]=4 2511 B12R1.435 CCN([13CH3])c1cccc(c1)OC 2230a_100000219733_200025704644 [0,1,1,0,0,0|1,0,1]=4 2512 B12R1.435 CCN([13CH3])c1cccc(c1)OC 269982a_100000219733_200025704644 [0,1,1,0,0,0|1,0,1]=4 2513 B12R1.435 CCN([13CH3])c1cccc(c1)OC 34a_100000219733_200025704644 [0,1,1,0,0,0|1,0,1]=4 2514 B12R1.435 COc1cccc(c1)N(C)CF 269982a_100000219725_100015361967 [0,1,1,0,0,0|1,0,1]=4 2515 B12R1.435 COc1cccc(c1)N(C)CF 34a_100000219725_100015361967 [0,1,1,0,0,0|1,0,1]=4 2516 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [0,1,1,0,0,0|2,0,0]=4 2517 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [0,1,1,0,0,0|1,0,0]=3 2518 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [0,1,1,0,0,0|1,0,0]=3 2519 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [0,1,1,0,0,0|1,1,0]=4 2520 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [0,1,1,0,0,0|2,0,0]=4 2521 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [0,1,1,0,0,0|2,0,0]=4 2522 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [0,1,1,0,0,0|2,0,0]=4 2523 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [0,1,1,0,0,0|2,0,0]=4 2524 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [0,1,1,0,0,0|2,0,0]=4 2525 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [0,1,1,0,0,0|2,0,0]=4 2526 B12R1.438 CNc1cccc(c1)NC(=O)N 34a_100000736001_200000210301 [0,1,1,0,0,0|1,0,1]=4 2527 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [0,1,1,0,0,0|2,0,0]=4 2528 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [0,1,1,0,0,0|2,0,0]=4 2529 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [0,1,1,0,0,0|2,0,0]=4 2530 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [0,1,1,0,0,0|1,0,1]=4 2531 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [0,1,1,0,0,0|1,0,1]=4 2532 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [0,1,1,0,0,0|2,0,0]=4 2533 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [0,1,1,0,0,0|1,0,0]=3 2534 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [0,1,1,0,0,0|1,0,0]=3 2535 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [0,1,1,0,0,0|1,0,0]=3 2536 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [0,1,1,0,0,0|1,0,0]=3 2537 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [0,1,1,0,0,0|1,0,0]=3 2538 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [0,1,1,0,0,0|1,0,0]=3 2539 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [0,1,1,0,0,0|0,0,1]=3 2540 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [0,1,1,0,0,0|0,0,1]=3 2541 B12R1.438 COc1cccc(c1)NC(=S)N 7a_100000023991_200000210301 [0,1,1,0,0,0|0,0,1]=3 2542 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [0,1,1,0,0,0|1,0,1]=4 2543 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [0,1,1,0,0,0|2,0,0]=4 2544 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [0,1,1,0,0,0|1,1,0]=4 2545 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [0,1,1,0,0,0|1,1,0]=4 2546 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [0,1,1,0,0,0|1,1,0]=4 2547 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [0,1,1,0,0,0|1,1,0]=4 2548 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [0,1,1,0,0,0|1,1,0]=4 2549 B12R1.438 CSc1cccc(c1)NC(=O)N 62a_200000210301_100000238923 [0,1,1,0,0,0|0,1,1]=4 2550 B12R1.438 [13CH3]Nc1cccc(c1)NC(=O)N 34a_100000736001_200025704644 [0,1,1,0,0,0|1,0,1]=4 2551 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [0,1,1,0,0,0|1,0,1]=4 2552 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [0,1,1,0,0,0|1,0,1]=4 2553 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [0,1,1,0,0,0|0,0,1]=3 2554 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [0,1,1,0,0,0|0,0,1]=3 2555 B12R1.438 [13CH3]Oc1cccc(c1)NC(=S)N 7a_100000023991_200025704644 [0,1,1,0,0,0|0,0,1]=3 2556 B12R1.438 [13CH3]Sc1cccc(c1)NC(=O)N 62a_200025704644_100000238923 [0,1,1,0,0,0|0,1,1]=4 2557 B12R1.48 C=Cc1ccc(cc1N)C(=O)C 271570a_100011290941_100009816534 [0,1,1,0,0,0|2,0,0]=4 2558 B12R1.78 C=Cc1ccc(cc1C#N)OC 271570a_100011290941_100000748272 [0,1,1,0,0,0|1,0,1]=4 2559 B12R1.78 C=Cc1ccc(cc1C=O)OC 271570a_100011290941_100000691568 [0,1,1,0,0,0|2,0,0]=4 2560 B12R1.78 C=Cc1ccc(cc1CC)OC 271570a_100011290941_100000720562 [0,1,1,0,0,0|2,0,0]=4 2561 B12R1.78 C=Cc1ccc(cc1CN)OC 271570a_100011290941_100000741592 [0,1,1,0,0,0|1,0,0]=3 2562 B12R1.78 C=Cc1ccc(cc1CO)OC 271570a_100011290941_200011273942 [0,1,1,0,0,0|2,0,0]=4 2563 B12R1.78 C=Cc1ccc(cc1OC)OC 271570a_100011290941_100000750026 [0,1,1,0,0,0|2,0,0]=4 2564 B12R1.78 CNc1cc(ccc1C#N)OC 2230a_100000687564_200000210301 [0,1,1,0,0,0|2,0,0]=4 2565 B12R1.78 CNc1cc(ccc1C#N)OC 34a_100000687564_200000210301 [0,1,1,0,0,0|2,0,0]=4 2566 B12R1.78 CNc1cc(ccc1C#N)OC 7a_100000687564_200000210301 [0,1,1,0,0,0|2,0,0]=4 2567 B12R1.78 CNc1cc(ccc1CO)OC 34a_100011998734_200000210301 [0,1,1,0,0,0|2,0,0]=4 2568 B12R1.78 CNc1cc(ccc1OC)OC 2230a_100000184736_200000210301 [0,1,1,0,0,0|1,0,1]=4 2569 B12R1.78 CNc1cc(ccc1OC)OC 34a_100000184736_200000210301 [0,1,1,0,0,0|1,0,1]=4 2570 B12R1.78 COc1ccc(c(c1)CN)SC 62a_100000741592_200000210301 [0,1,1,0,0,0|1,0,1]=4 2571 B12R1.78 COc1ccc(c(c1)CN)SC 62a_200000210301_100000741592 [0,1,1,0,0,0|1,0,1]=4 2572 B12R1.78 COc1ccc(c(c1)CN)S[13CH3] 62a_100000741592_200025704644 [0,1,1,0,0,0|1,0,1]=4 2573 B12R1.78 COc1ccc(c(c1)CN)S[13CH3] 62a_200025704644_100000741592 [0,1,1,0,0,0|1,0,1]=4 2574 B12R1.78 COc1ccc(c(c1)N[13CH3])C#N 2230a_100000687564_200025704644 [0,1,1,0,0,0|2,0,0]=4 2575 B12R1.78 COc1ccc(c(c1)N[13CH3])C#N 34a_100000687564_200025704644 [0,1,1,0,0,0|2,0,0]=4 2576 B12R1.78 COc1ccc(c(c1)N[13CH3])C#N 7a_100000687564_200025704644 [0,1,1,0,0,0|2,0,0]=4 2577 B12R1.78 COc1ccc(c(c1)N[13CH3])CO 34a_100011998734_200025704644 [0,1,1,0,0,0|2,0,0]=4 2578 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 2230a_100000184736_200025704644 [0,1,1,0,0,0|1,0,1]=4 2579 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 34a_100000184736_200025704644 [0,1,1,0,0,0|1,0,1]=4 2580 B12R1.78 COc1ccc(c(c1)OC)N=O 34a_200010658452_200000210301 [0,1,1,0,0,0|2,0,0]=4 2581 B12R1.78 COc1ccc(c(c1)OC)N=O 7a_200010658452_200000210301 [0,1,1,0,0,0|2,0,0]=4 2582 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 34a_200010658452_200025704644 [0,1,1,0,0,0|2,0,0]=4 2583 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 7a_200010658452_200025704644 [0,1,1,0,0,0|2,0,0]=4 2584 B12R1.301 C=Cc1c(cc(cc1C)OC)C 271570a_100011290941_100012160682 [0,1,1,0,0,0|2,0,0]=4 2585 B12R1.301 C=Cc1c(cc(cc1F)OC)F 271570a_100011290941_100011218311 [0,1,1,0,0,0|2,0,0]=4 2586 B12R1.301 COc1cc(c(c(c1)Br)OC)N 34a_200010008348_200000210301 [0,1,1,0,0,0|1,0,1]=4 2587 B12R1.301 COc1cc(c(c(c1)Br)O[13CH3])N 34a_200010008348_200025704644 [0,1,1,0,0,0|1,0,1]=4 2588 B12R1.301 COc1cc(c(c(c1)O)OC)N 271570a_203496583355_100010294495 [0,1,1,0,0,0|1,0,1]=4 2589 B12R1.450 C=Cc1cc(c(cc1C)OC)C 271570a_100011290941_100000698960 [0,1,1,0,0,0|2,0,0]=4 2590 B12R1.450 C=Cc1cc(c(cc1C)OC)F 271570a_100011290941_100010074640 [0,1,1,0,0,0|2,0,0]=4 2591 B12R1.450 C=Cc1cc(c(cc1Cl)OC)N 271570a_100011290941_100011011177 [0,1,1,0,0,0|2,0,0]=4 2592 B12R1.450 C=Cc1cc(c(cc1F)OC)F 271570a_100011290941_100009813720 [0,1,1,0,0,0|2,0,0]=4 2593 B12R1.450 C=Cc1cc(c(cc1F)OC)N 271570a_100011290941_100012361397 [0,1,1,0,0,0|2,0,0]=4 2594 B12R1.450 C=Cc1cc(c(cc1N)OC)C 271570a_100011290941_100010244135 [0,1,1,0,0,0|1,0,0]=3 2595 B12R1.450 C=Cc1cc(c(cc1N)OC)F 271570a_100011290941_100010208193 [0,1,1,0,0,0|1,0,0]=3 2596 B12R1.450 COc1cc(c(cc1C)SC)N 62a_100010244135_200000210301 [0,1,1,0,0,0|1,0,1]=4 2597 B12R1.450 COc1cc(c(cc1C)SC)N 62a_200000210301_100010244135 [0,1,1,0,0,0|1,0,1]=4 2598 B12R1.450 COc1cc(c(cc1C)S[13CH3])N 62a_100010244135_200025704644 [0,1,1,0,0,0|1,0,1]=4 2599 B12R1.450 COc1cc(c(cc1C)S[13CH3])N 62a_200025704644_100010244135 [0,1,1,0,0,0|1,0,1]=4 2600 B12R1.450 COc1cc(c(cc1F)SC)N 62a_100010208193_200000210301 [0,1,1,0,0,0|1,0,1]=4 2601 B12R1.450 COc1cc(c(cc1F)SC)N 62a_200000210301_100010208193 [0,1,1,0,0,0|1,0,1]=4 2602 B12R1.450 COc1cc(c(cc1F)S[13CH3])N 62a_100010208193_200025704644 [0,1,1,0,0,0|1,0,1]=4 2603 B12R1.450 COc1cc(c(cc1F)S[13CH3])N 62a_200025704644_100010208193 [0,1,1,0,0,0|1,0,1]=4 2604 B12R1.452 C=C(C)c1ccc(cc1Br)OC 271570a_100000694244_100012349170 [0,1,1,0,0,0|2,0,0]=4 2605 B12R1.452 C=C(C)c1ccc(cc1C)OC 271570a_100000694244_100000759875 [0,1,1,0,0,0|2,0,0]=4 2606 B12R1.452 C=C(C)c1ccc(cc1F)OC 271570a_100000694244_100000753793 [0,1,1,0,0,0|2,0,0]=4 2607 B12R1.452 C=C(C)c1ccc(cc1N)OC 271570a_100000694244_100000748021 [0,1,1,0,0,0|1,0,0]=3 2608 B12R1.452 C=C(C)c1ccc(cc1O)OC 271570a_100000694244_100000719091 [0,1,1,0,0,0|2,0,0]=4 2609 B12R1.452 C=C(C)c1ccc(nc1N)OC 271570a_100000694244_100010187629 [0,1,1,0,0,0|2,0,0]=4 2610 B12R1.452 C=C(C)c1cnc(cc1N)OC 271570a_100000694244_100010254562 [0,1,1,0,0,0|2,0,0]=4 2611 B12R1.452 C=C(C)c1ncc(cc1N)OC 271570a_100000694244_100010074831 [0,1,1,0,0,0|2,0,0]=4 2612 B12R1.452 COc1ccc(c(c1)N)C(=O)N 34a_100012186684_200000210301 [0,1,1,0,0,0|2,0,0]=4 2613 B12R1.452 COc1ccc(c(c1)N)C(=O)N 7a_100012186684_200000210301 [0,1,1,0,0,0|2,0,0]=4 2614 B12R1.452 COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200000210301 [0,1,1,0,0,0|1,0,1]=4 2615 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 34a_100012186684_200025704644 [0,1,1,0,0,0|2,0,0]=4 2616 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 7a_100012186684_200025704644 [0,1,1,0,0,0|2,0,0]=4 2617 B12R1.452 [13CH3]Oc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200025704644 [0,1,1,0,0,0|1,0,1]=4 2618 B12R1.653 C=Cc1ccc(c(c1C)C)OC 271570a_100011290941_100000049725 [0,1,1,0,0,0|2,0,0]=4 2619 B12R1.653 C=Cc1ccc(c(c1F)F)OC 271570a_100011290941_100009816879 [0,1,1,0,0,0|2,0,0]=4 2620 B12R1.300 C=Cc1cc(cc(c1N)C)OC 271570a_100011290941_200011010636 [0,1,1,0,0,0|1,0,1]=4 2621 B12R1.300 C=Cc1cc(cc(c1N)N)OC 271570a_100011290941_100010194281 [0,1,1,0,0,0|1,0,1]=4 2622 B12R1.300 C=Cc1cc(cc(c1O)N)OC 271570a_100011290941_200010008348 [0,1,1,0,0,0|2,0,0]=4 2623 B12R1.300 CNc1cc(cc(c1O)Br)OC 34a_200010008348_200000210301 [0,1,1,0,0,0|1,0,1]=4 2624 B12R1.300 COc1cc(c(c(c1)N[13CH3])O)Br 34a_200010008348_200025704644 [0,1,1,0,0,0|1,0,1]=4 2625 B12R1.449 C=Cc1cc(c(cc1Br)Br)OC 271570a_100011290941_200014006352 [0,1,1,0,0,0|2,0,0]=4 2626 B12R1.449 C=Cc1cc(c(cc1C)F)OC 271570a_100011290941_100011009880 [0,1,1,0,0,0|2,0,0]=4 2627 B12R1.449 C=Cc1cc(c(cc1C)N)OC 271570a_100011290941_100010141321 [0,1,1,0,0,0|2,0,0]=4 2628 B12R1.449 C=Cc1cc(c(cc1F)Cl)OC 271570a_100011290941_100010739614 [0,1,1,0,0,0|2,0,0]=4 2629 B12R1.449 C=Cc1cc(c(cc1F)F)OC 271570a_100011290941_200015541288 [0,1,1,0,0,0|2,0,0]=4 2630 B12R1.449 C=Cc1cc(c(cc1F)N)OC 271570a_100011290941_100012766639 [0,1,1,0,0,0|2,0,0]=4 2631 B12R1.449 C=Cc1cc(c(cc1F)O)OC 271570a_100011290941_100010189133 [0,1,1,0,0,0|2,0,0]=4 2632 B12R1.449 C=Cc1cc(c(cc1N)C)OC 271570a_100011290941_200010584344 [0,1,1,0,0,0|1,0,1]=4 2633 B12R1.449 C=Cc1cc(c(cc1N)F)OC 271570a_100011290941_100010365326 [0,1,1,0,0,0|1,0,1]=4 2634 B12R1.449 CNc1cc(c(cc1Br)Br)OC 34a_100000718616_200000210301 [0,1,1,0,0,0|1,0,1]=4 2635 B12R1.449 CNc1cc(c(cc1Br)Br)OC 7a_100000718616_200000210301 [0,1,1,0,0,0|1,0,1]=4 2636 B12R1.449 CNc1cc(c(cc1Br)C)OC 34a_100010244135_200000210301 [0,1,1,0,0,0|1,0,1]=4 2637 B12R1.449 CNc1cc(c(cc1Br)C)OC 7a_100010244135_200000210301 [0,1,1,0,0,0|1,0,1]=4 2638 B12R1.449 CNc1cc(c(cc1Br)Cl)OC 34a_100013022580_200000210301 [0,1,1,0,0,0|1,0,1]=4 2639 B12R1.449 CNc1cc(c(cc1Br)Cl)OC 7a_100013022580_200000210301 [0,1,1,0,0,0|1,0,1]=4 2640 B12R1.449 CNc1cc(c(cc1Br)F)OC 34a_100010208193_200000210301 [0,1,1,0,0,0|1,0,1]=4 2641 B12R1.449 CNc1cc(c(cc1Br)F)OC 7a_100010208193_200000210301 [0,1,1,0,0,0|1,0,1]=4 2642 B12R1.449 CNc1cc(c(cc1C)Br)OC 34a_100010232211_200000210301 [0,1,1,0,0,0|1,0,1]=4 2643 B12R1.449 CNc1cc(c(cc1C)Br)OC 7a_100010232211_200000210301 [0,1,1,0,0,0|1,0,1]=4 2644 B12R1.449 CNc1cc(c(cc1C)Cl)OC 2230a_100009858536_200000210301 [0,1,1,0,0,0|1,0,1]=4 2645 B12R1.449 CNc1cc(c(cc1C)Cl)OC 34a_100009858536_200000210301 [0,1,1,0,0,0|1,0,1]=4 2646 B12R1.449 CNc1cc(c(cc1C)Cl)OC 7a_100009858536_200000210301 [0,1,1,0,0,0|1,0,1]=4 2647 B12R1.449 CNc1cc(c(cc1Cl)Br)OC 34a_100012361290_200000210301 [0,1,1,0,0,0|1,0,1]=4 2648 B12R1.449 CNc1cc(c(cc1Cl)Br)OC 7a_100012361290_200000210301 [0,1,1,0,0,0|1,0,1]=4 2649 B12R1.449 CNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_200000210301 [0,1,1,0,0,0|1,0,1]=4 2650 B12R1.449 CNc1cc(c(cc1Cl)F)OC 34a_100009958774_200000210301 [0,1,1,0,0,0|1,0,1]=4 2651 B12R1.449 CNc1cc(c(cc1Cl)F)OC 7a_100009958774_200000210301 [0,1,1,0,0,0|1,0,1]=4 2652 B12R1.449 CNc1cc(c(cc1F)Cl)OC 34a_100009872666_200000210301 [0,1,1,0,0,0|1,0,1]=4 2653 B12R1.449 CNc1cc(c(cc1F)Cl)OC 7a_100009872666_200000210301 [0,1,1,0,0,0|1,0,1]=4 2654 B12R1.449 COc1cc(c(cc1Br)Br)N[13CH3] 34a_100000718616_200025704644 [0,1,1,0,0,0|1,0,1]=4 2655 B12R1.449 COc1cc(c(cc1Br)Br)N[13CH3] 7a_100000718616_200025704644 [0,1,1,0,0,0|1,0,1]=4 2656 B12R1.449 COc1cc(c(cc1Br)C)N[13CH3] 34a_100010232211_200025704644 [0,1,1,0,0,0|1,0,1]=4 2657 B12R1.449 COc1cc(c(cc1Br)C)N[13CH3] 7a_100010232211_200025704644 [0,1,1,0,0,0|1,0,1]=4 2658 B12R1.449 COc1cc(c(cc1Br)Cl)N[13CH3] 34a_100012361290_200025704644 [0,1,1,0,0,0|1,0,1]=4 2659 B12R1.449 COc1cc(c(cc1Br)Cl)N[13CH3] 7a_100012361290_200025704644 [0,1,1,0,0,0|1,0,1]=4 2660 B12R1.449 COc1cc(c(cc1C)Br)N[13CH3] 34a_100010244135_200025704644 [0,1,1,0,0,0|1,0,1]=4 2661 B12R1.449 COc1cc(c(cc1C)Br)N[13CH3] 7a_100010244135_200025704644 [0,1,1,0,0,0|1,0,1]=4 2662 B12R1.449 COc1cc(c(cc1Cl)Br)N[13CH3] 34a_100013022580_200025704644 [0,1,1,0,0,0|1,0,1]=4 2663 B12R1.449 COc1cc(c(cc1Cl)Br)N[13CH3] 7a_100013022580_200025704644 [0,1,1,0,0,0|1,0,1]=4 2664 B12R1.449 COc1cc(c(cc1Cl)C)N[13CH3] 2230a_100009858536_200025704644 [0,1,1,0,0,0|1,0,1]=4 2665 B12R1.449 COc1cc(c(cc1Cl)C)N[13CH3] 34a_100009858536_200025704644 [0,1,1,0,0,0|1,0,1]=4 2666 B12R1.449 COc1cc(c(cc1Cl)C)N[13CH3] 7a_100009858536_200025704644 [0,1,1,0,0,0|1,0,1]=4 2667 B12R1.449 COc1cc(c(cc1Cl)Cl)N[13CH3] 34a_100011830341_200025704644 [0,1,1,0,0,0|1,0,1]=4 2668 B12R1.449 COc1cc(c(cc1Cl)F)N[13CH3] 34a_100009872666_200025704644 [0,1,1,0,0,0|1,0,1]=4 2669 B12R1.449 COc1cc(c(cc1Cl)F)N[13CH3] 7a_100009872666_200025704644 [0,1,1,0,0,0|1,0,1]=4 2670 B12R1.449 COc1cc(c(cc1F)Br)N[13CH3] 34a_100010208193_200025704644 [0,1,1,0,0,0|1,0,1]=4 2671 B12R1.449 COc1cc(c(cc1F)Br)N[13CH3] 7a_100010208193_200025704644 [0,1,1,0,0,0|1,0,1]=4 2672 B12R1.449 COc1cc(c(cc1F)Cl)N[13CH3] 34a_100009958774_200025704644 [0,1,1,0,0,0|1,0,1]=4 2673 B12R1.449 COc1cc(c(cc1F)Cl)N[13CH3] 7a_100009958774_200025704644 [0,1,1,0,0,0|1,0,1]=4 2674 B12R1.453 C=C(C)c1cc(ccc1Br)OC 271570a_100000694244_100009992028 [0,1,1,0,0,0|2,0,0]=4 2675 B12R1.453 C=C(C)c1cc(ccc1C)OC 271570a_100000694244_100012349166 [0,1,1,0,0,0|2,0,0]=4 2676 B12R1.453 C=C(C)c1cc(ccc1Cl)OC 271570a_100000694244_100011356938 [0,1,1,0,0,0|2,0,0]=4 2677 B12R1.453 C=C(C)c1cc(ccc1F)OC 271570a_100000694244_100000699733 [0,1,1,0,0,0|2,0,0]=4 2678 B12R1.453 C=C(C)c1cc(ccc1N)OC 271570a_100000694244_100015195136 [0,1,1,0,0,0|1,0,1]=4 2679 B12R1.453 C=C(C)c1cc(ccc1O)OC 271570a_100000694244_100000685887 [0,1,1,0,0,0|2,0,0]=4 2680 B12R1.453 CN(C)c1cc(ccc1I)O[13CH3] 34a_200010083878_200025704644 [0,1,1,0,0,0|1,0,1]=4 2681 B12R1.453 COc1ccc(c(c1)N(C)C)C 34a_200000087912_200000210301 [0,1,1,0,0,0|1,0,1]=4 2682 B12R1.453 COc1ccc(c(c1)N(C)C)I 34a_200010083878_200000210301 [0,1,1,0,0,0|1,0,1]=4 2683 B12R1.453 Cc1ccc(cc1N(C)C)O[13CH3] 34a_200000087912_200025704644 [0,1,1,0,0,0|1,0,1]=4 2684 B12R1.654 C=Cc1c(ccc(c1C)OC)C 271570a_100011290941_100016151084 [0,1,1,0,0,0|2,0,0]=4 2685 B12R1.654 C=Cc1c(ccc(c1F)OC)F 271570a_100011290941_100010946477 [0,1,1,0,0,0|2,0,0]=4 2686 B12R1.654 CNc1c(ccc(c1C)OC)C 34a_100000089760_200000210301 [0,1,1,0,0,0|1,0,1]=4 2687 B12R1.654 CNc1c(ccc(c1C)OC)C 7a_100000089760_200000210301 [0,1,1,0,0,0|1,0,1]=4 2688 B12R1.654 CNc1c(ccc(c1Cl)OC)Cl 34a_100009956855_200000210301 [0,1,1,0,0,0|1,0,1]=4 2689 B12R1.654 CNc1c(ccc(c1Cl)OC)F 34a_100000061512_200000210301 [0,1,1,0,0,0|1,0,1]=4 2690 B12R1.654 CNc1c(ccc(c1F)OC)Cl 34a_100000061519_200000210301 [0,1,1,0,0,0|1,0,1]=4 2691 B12R1.654 CNc1c(ccc(c1F)OC)F 34a_200000062051_200000210301 [0,1,1,0,0,0|1,0,1]=4 2692 B12R1.654 COc1ccc(c(c1C)N[13CH3])C 34a_100000089760_200025704644 [0,1,1,0,0,0|1,0,1]=4 2693 B12R1.654 COc1ccc(c(c1C)N[13CH3])C 7a_100000089760_200025704644 [0,1,1,0,0,0|1,0,1]=4 2694 B12R1.654 COc1ccc(c(c1Cl)N[13CH3])Cl 34a_100009956855_200025704644 [0,1,1,0,0,0|1,0,1]=4 2695 B12R1.654 COc1ccc(c(c1Cl)N[13CH3])F 34a_100000061512_200025704644 [0,1,1,0,0,0|1,0,1]=4 2696 B12R1.654 COc1ccc(c(c1F)N[13CH3])Cl 34a_100000061519_200025704644 [0,1,1,0,0,0|1,0,1]=4 2697 B12R1.654 COc1ccc(c(c1F)N[13CH3])F 34a_200000062051_200025704644 [0,1,1,0,0,0|1,0,1]=4 2698 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [1,1,0,0,0,0|1,0,0]=3 2699 B12R2.82 Cc1c(ccc2c1cc[nH]2)O 271570a_203496583355_100010731972 [1,1,0,0,0,0|1,0,1]=4 2700 B12R2.82 Cc1c(ccc2c1nc[nH]2)O 271570a_203496583355_100010009745 [1,1,0,0,0,0|0,0,2]=4 2701 B12R2.82 Cc1c(ccc2n1ccn2)O 271570a_203496583355_100012569086 [1,1,0,0,0,0|2,0,0]=4 2702 B12R2.82 Cc1c(ccc2n1ncn2)O 271570a_203496583355_100010201169 [1,1,0,0,0,0|1,0,1]=4 2703 B12R2.82 Cc1c(cnc2c1[nH]cn2)O 271570a_203496583355_100010140963 [1,1,0,0,0,0|1,0,0]=3 2704 B12R2.82 Cc1c(ncc2c1[nH]cc2)O 271570a_203496583355_100010244392 [1,1,0,0,0,0|2,0,0]=4 2705 B12R2.82 Cc1ccc2[nH]ccc2c1O 271570a_203496583355_100010248896 [1,1,0,0,0,0|1,0,1]=4 2706 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [1,1,0,0,0,0|1,0,0]=3 2707 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [1,1,0,0,0,0|2,0,0]=4 2708 B12R2.82 Cc1ccc2nccn2c1O 271570a_203496583355_100010765079 [1,1,0,0,0,0|2,0,0]=4 2709 B12R2.82 Nc1c(ccc2c1scn2)O 271570a_203496583355_100010998030 [1,1,0,0,0,0|1,0,0]=3 2710 B12R2.82 Nc1ccc2ncsc2c1O 271570a_203496583355_100010007894 [1,1,0,0,0,0|2,0,0]=4 2711 B12R2.82 Oc1c(ccc2c1ocn2)F 271570a_203496583355_100010870391 [1,1,0,0,0,0|2,0,0]=4 2712 B12R2.82 Oc1ccc2[nH]ccc2c1F 271570a_203496583355_100000700836 [1,1,0,0,0,0|1,0,1]=4 2713 B12R2.82 Oc1ccc2cn[nH]c2c1F 271570a_203496583355_100102525427 [1,1,0,0,0,0|2,0,0]=4 2714 B12R2.100 Cc1cc2[nH]ccc2cc1O 271570a_203496583355_100010199648 [1,1,0,0,0,0|1,0,0]=3 2715 B12R2.100 Cc1cc2[nH]ncc2cc1O 271570a_203496583355_100009816927 [1,1,0,0,0,0|2,0,0]=4 2716 B12R2.100 Cc1cc2cc[nH]c2cc1O 271570a_203496583355_100010199660 [1,1,0,0,0,0|1,0,0]=3 2717 B12R2.100 Cc1cc2ccsc2cc1O 271570a_203496583355_100010762285 [1,1,0,0,0,0|2,0,0]=4 2718 B12R2.100 Cc1cc2cn[nH]c2cc1O 271570a_203496583355_100009816928 [1,1,0,0,0,0|2,0,0]=4 2719 B12R2.100 Cc1cc2nc[nH]c2cc1O 271570a_203496583355_200010107306 [1,1,0,0,0,0|0,0,0]=2 2720 B12R2.100 Cc1cc2nccn2cc1O 271570a_203496583355_100020606757 [1,1,0,0,0,0|2,0,0]=4 2721 B12R2.100 Cc1cc2ncnn2cc1O 271570a_203496583355_100010254783 [1,1,0,0,0,0|1,0,1]=4 2722 B12R2.100 Cc1cc2nn[nH]c2cc1O 271570a_203496583355_100010721108 [1,1,0,0,0,0|1,0,0]=3 2723 B12R2.100 Cc1nc2[nH]ccc2cc1O 271570a_203496583355_100010212563 [1,1,0,0,0,0|2,0,0]=4 2724 B12R2.100 Cc1nc2[nH]cnc2cc1O 271570a_203496583355_100000689652 [1,1,0,0,0,0|1,0,0]=3 2725 B12R2.100 Nc1cc2[nH]ccc2cc1O 271570a_203496583355_100010212544 [1,1,0,0,0,0|1,0,1]=4 2726 B12R2.100 Nc1cc2[nH]cnc2cc1O 271570a_203496583355_200010336578 [1,1,0,0,0,0|1,0,0]=3 2727 B12R2.100 Nc1cc2cn[nH]c2cc1O 271570a_203496583355_100011012411 [1,1,0,0,0,0|2,0,0]=4 2728 B12R2.100 Oc1cc2[nH]ccc2cc1Br 271570a_203496583355_100000703010 [1,1,0,0,0,0|1,0,0]=3 2729 B12R2.100 Oc1cc2[nH]ccc2cc1F 271570a_203496583355_100009817181 [1,1,0,0,0,0|1,0,0]=3 2730 B12R2.100 Oc1cc2[nH]ncc2cc1F 271570a_203496583355_100010131892 [1,1,0,0,0,0|2,0,0]=4 2731 B12R2.100 Oc1cc2[nH]nnc2cc1F 271570a_203496583355_100010075030 [1,1,0,0,0,0|1,0,0]=3 2732 B12R2.100 Oc1cc2cc[nH]c2cc1F 271570a_203496583355_100000731065 [1,1,0,0,0,0|1,0,1]=4 2733 B12R2.100 Oc1cc2cn[nH]c2cc1O 271570a_203496583355_100010079831 [1,1,0,0,0,0|2,0,0]=4 2734 B12R2.100 Oc1cc2cn[nH]c2cc1O 271570a_203496583355_100010080172 [1,1,0,0,0,0|2,0,0]=4 2735 B12R2.100 Oc1cc2nc[nH]c2cc1F 271570a_203496583355_100012361300 [1,1,0,0,0,0|1,0,0]=3 2736 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [1,1,0,0,0,0|1,0,1]=4 2737 B12R2.132 Cc1ccc2ncc(n2c1)O 271570a_203496583355_100012351729 [1,1,0,0,0,0|2,0,0]=4 2738 B12R2.132 Cc1cnc2n1cc(cc2)O 271570a_203496583355_100012353388 [1,1,0,0,0,0|2,0,0]=4 2739 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [1,1,0,0,0,0|2,0,0]=4 2740 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [1,1,0,0,0,0|2,0,0]=4 2741 B12R2.132 Cn1ccc2c1cc(cc2)O 271570a_203496583355_100011934912 [1,1,0,0,0,0|1,0,0]=3 2742 B12R2.132 Cn1ccc2c1cc(cn2)O 271570a_203496583355_100010761474 [1,1,0,0,0,0|2,0,0]=4 2743 B12R2.132 Cn1ccc2c1cc(nc2)O 271570a_203496583355_100020639908 [1,1,0,0,0,0|2,0,0]=4 2744 B12R2.132 Cn1cnc2c1cc(cc2)O 271570a_203496583355_100000702186 [1,1,0,0,0,0|0,0,0]=2 2745 B12R2.132 Cn1cnc2c1cc(nc2)O 271570a_203496583355_100009863791 [1,1,0,0,0,0|1,0,0]=3 2746 B12R2.132 Cn1cnc2c1nc(nc2)O 271570a_203496583355_100000085903 [1,1,0,0,0,0|2,0,0]=4 2747 B12R2.132 Cn1ncc2c1cc(cc2)O 271570a_203496583355_100009817177 [1,1,0,0,0,0|2,0,0]=4 2748 B12R2.132 Cn1nnc2c1cc(cc2)O 271570a_203496583355_100010241234 [1,1,0,0,0,0|1,0,0]=3 2749 B12R2.132 Oc1ccc2ncc(n2c1)Br 271570a_203496583355_100010184845 [1,1,0,0,0,0|2,0,0]=4 2750 B12R2.132 Oc1ccc2ncc(n2c1)F 271570a_203496583355_100025711191 [1,1,0,0,0,0|2,0,0]=4 2751 B12R2.246 Cc1cc(c2[nH]cnc2c1)O 271570a_203496583355_100010107307 [1,1,0,0,0,0|0,0,2]=4 2752 B12R2.246 Cc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010186026 [1,1,0,0,0,0|1,0,0]=3 2753 B12R2.246 Cc1cc(c2cc[nH]c2n1)O 271570a_203496583355_100000095047 [1,1,0,0,0,0|2,0,0]=4 2754 B12R2.246 Cc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100009816876 [1,1,0,0,0,0|2,0,0]=4 2755 B12R2.246 Cc1cc(c2nccn2c1)O 271570a_203496583355_100025775375 [1,1,0,0,0,0|2,0,0]=4 2756 B12R2.246 Cc1cc(c2ncnn2c1)O 271570a_203496583355_100009817174 [1,1,0,0,0,0|1,0,1]=4 2757 B12R2.246 Cc1cc(c2occc2c1)O 271570a_203496583355_100012361857 [1,1,0,0,0,0|2,0,0]=4 2758 B12R2.246 Cc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009817142 [1,1,0,0,0,0|1,0,1]=4 2759 B12R2.246 Cc1cc(cc2c1cn[nH]2)O 271570a_203496583355_100009816875 [1,1,0,0,0,0|2,0,0]=4 2760 B12R2.246 Cc1cc(cc2c1nc[nH]2)O 271570a_203496583355_100000239325 [1,1,0,0,0,0|0,0,0]=2 2761 B12R2.246 Cc1cc(cc2c1occ2)O 271570a_203496583355_100012361858 [1,1,0,0,0,0|2,0,0]=4 2762 B12R2.246 Cc1cc(cn2c1ncc2)O 271570a_203496583355_100000701042 [1,1,0,0,0,0|2,0,0]=4 2763 B12R2.246 Cc1cc(cn2c1ncn2)O 271570a_203496583355_100010201170 [1,1,0,0,0,0|1,0,1]=4 2764 B12R2.246 Nc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006569 [1,1,0,0,0,0|2,0,0]=4 2765 B12R2.246 Nc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009813507 [1,1,0,0,0,0|1,0,1]=4 2766 B12R2.246 Nc1cc(cc2c1cc[nH]2)O 271570a_203496583355_106744500199 [1,1,0,0,0,0|1,0,0]=3 2767 B12R2.246 Nc1cc(cc2c1cn[nH]2)O 271570a_203496583355_100010177796 [1,1,0,0,0,0|2,0,0]=4 2768 B12R2.246 Nc1cc(cn2c1ncc2)O 271570a_203496583355_100009816852 [1,1,0,0,0,0|2,0,0]=4 2769 B12R2.246 Oc1cc(c2[nH]ccc2c1)F 271570a_203496583355_100010138380 [1,1,0,0,0,0|1,0,1]=4 2770 B12R2.246 Oc1cc(c2cc[nH]c2c1)Br 271570a_203496583355_100009814775 [1,1,0,0,0,0|1,0,0]=3 2771 B12R2.246 Oc1cc(c2cc[nH]c2c1)F 271570a_203496583355_100010186028 [1,1,0,0,0,0|1,0,0]=3 2772 B12R2.246 Oc1cc(c2cn[nH]c2c1)Br 271570a_203496583355_100009814768 [1,1,0,0,0,0|2,0,0]=4 2773 B12R2.246 Oc1cc(c2cn[nH]c2c1)Cl 271570a_203496583355_100000050090 [1,1,0,0,0,0|2,0,0]=4 2774 B12R2.246 Oc1cc(c2cn[nH]c2c1)F 271570a_203496583355_100010185991 [1,1,0,0,0,0|2,0,0]=4 2775 B12R2.246 Oc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010185960 [1,1,0,0,0,0|2,0,0]=4 2776 B12R2.246 Oc1cc(c2nccn2c1)F 271570a_203496583355_100010174814 [1,1,0,0,0,0|2,0,0]=4 2777 B12R2.246 Oc1cc(c2nccn2c1)O 271570a_203496583355_100010074634 [1,1,0,0,0,0|2,0,0]=4 2778 B12R2.246 Oc1cc(c2ncnn2c1)F 271570a_203496583355_100015548010 [1,1,0,0,0,0|1,0,1]=4 2779 B12R2.246 Oc1cc(c2occc2c1)F 271570a_203496583355_100012355474 [1,1,0,0,0,0|2,0,0]=4 2780 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [1,1,0,0,0,0|2,0,0]=4 2781 B12R2.246 Oc1cc(cc2c1cc[nH]2)Br 271570a_203496583355_100009814761 [1,1,0,0,0,0|2,0,0]=4 2782 B12R2.246 Oc1cc(cc2c1cc[nH]2)F 271570a_203496583355_100010188273 [1,1,0,0,0,0|2,0,0]=4 2783 B12R2.246 Oc1cc(cc2c1nc[nH]2)F 271570a_203496583355_100010192642 [1,1,0,0,0,0|1,0,0]=3 2784 B12R2.246 Oc1cc(cc2c1nco2)F 271570a_203496583355_100016120941 [1,1,0,0,0,0|2,0,0]=4 2785 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [1,1,0,0,0,0|1,0,1]=4 2786 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [1,1,0,0,0,0|2,0,0]=4 2787 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [1,1,0,0,0,0|1,0,0]=3 2788 B12R2.606 Cc1cc2ncc(cc2[nH]1)O 271570a_203496583355_100010168555 [1,1,0,0,0,0|2,0,0]=4 2789 B12R2.606 Cc1ccc2nc(sc2c1)O 271570a_203496583355_100010186437 [1,1,0,0,0,0|1,0,0]=3 2790 B12R2.606 Cc1cn2cc(ccc2n1)O 271570a_203496583355_100000194050 [1,1,0,0,0,0|2,0,0]=4 2791 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [1,1,0,0,0,0|0,0,2]=4 2792 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [1,1,0,0,0,0|1,0,1]=4 2793 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [1,1,0,0,0,0|1,0,1]=4 2794 B12R2.606 Cc1nc2cc(ccn2n1)O 271570a_203496583355_100010063680 [1,1,0,0,0,0|1,0,1]=4 2795 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [1,1,0,0,0,0|1,0,0]=3 2796 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [1,1,0,0,0,0|1,0,0]=3 2797 B12R2.606 Cc1nc2ccc(cn2n1)O 271570a_203496583355_100009815719 [1,1,0,0,0,0|1,0,1]=4 2798 B12R2.606 Cc1nc2ccc(nc2[nH]1)O 271570a_203496583355_100000079090 [1,1,0,0,0,0|1,0,0]=3 2799 B12R2.606 Cc1nc2ncc(cc2[nH]1)O 271570a_203496583355_100000758206 [1,1,0,0,0,0|1,0,0]=3 2800 B12R2.606 Cc1nc2ncc(cc2o1)O 271570a_203496583355_100010235748 [1,1,0,0,0,0|2,0,0]=4 2801 B12R2.606 Cn1cc2cc(ccc2n1)O 271570a_203496583355_100009817163 [1,1,0,0,0,0|2,0,0]=4 2802 B12R2.606 Nc1ccc2nc(sc2c1)O 271570a_203496583355_100010253933 [1,1,0,0,0,0|2,0,0]=4 2803 B12R2.606 Nc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000764686 [1,1,0,0,0,0|0,0,2]=4 2804 B12R2.606 Nc1nc2cc(ccc2o1)O 271570a_203496583355_100000737949 [1,1,0,0,0,0|1,0,1]=4 2805 B12R2.606 Nc1nc2cc(ccc2s1)O 271570a_203496583355_100011934045 [1,1,0,0,0,0|1,0,1]=4 2806 B12R2.606 Nc1nc2cc(ccn2n1)O 271570a_203496583355_100000757011 [1,1,0,0,0,0|1,0,1]=4 2807 B12R2.606 Nc1nc2ccc(cc2o1)O 271570a_203496583355_100010000678 [1,1,0,0,0,0|1,0,0]=3 2808 B12R2.606 Nc1nc2ccc(cc2s1)O 271570a_203496583355_100102524914 [1,1,0,0,0,0|1,0,0]=3 2809 B12R2.606 Nc1nc2ccc(cn2n1)O 271570a_203496583355_100000766472 [1,1,0,0,0,0|1,0,1]=4 2810 B12R2.606 Nc1nc2ccc(nc2s1)O 271570a_203496583355_100000075896 [1,1,0,0,0,0|2,0,0]=4 2811 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [1,1,0,0,0,0|1,0,1]=4 2812 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [1,1,0,0,0,0|2,0,0]=4 2813 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [1,1,0,0,0,0|1,0,0]=3 2814 B12R2.606 O=C1Cc2ccc(nc2N1)O 271570a_203496583355_100000104062 [1,1,0,0,0,0|2,0,0]=4 2815 B12R2.606 O=C1Cc2cnc(cc2N1)O 271570a_203496583355_100000089690 [1,1,0,0,0,0|2,0,0]=4 2816 B12R2.606 O=C1Cc2ncc(cc2N1)O 271570a_203496583355_100010168558 [1,1,0,0,0,0|2,0,0]=4 2817 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [1,1,0,0,0,0|1,0,0]=3 2818 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [1,1,0,0,0,0|1,0,0]=3 2819 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [1,1,0,0,0,0|0,0,1]=3 2820 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [1,1,0,0,0,0|1,0,1]=4 2821 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [1,1,0,0,0,0|1,0,1]=4 2822 B12R2.606 O=c1[nH]c2ccc(nc2[nH]1)O 271570a_203496583355_100000084209 [1,1,0,0,0,0|1,0,1]=4 2823 B12R2.606 Oc1cc2[nH]c(nc2cn1)O 271570a_203496583355_100010516660 [1,1,0,0,0,0|1,0,0]=3 2824 B12R2.606 Oc1ccc2nc(sc2c1)Cl 271570a_203496583355_100010163703 [1,1,0,0,0,0|1,0,0]=3 2825 B12R2.606 Oc1ccc2nc(sc2c1)O 271570a_203496583355_100010063415 [1,1,0,0,0,0|1,0,0]=3 2826 B12R2.606 Oc1nc2ccc(cc2s1)F 271570a_203496583355_100000751617 [1,1,0,0,0,0|2,0,0]=4 2827 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [1,1,0,0,0,0|1,0,0]=3 2828 B12R2.612 Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049534 [1,1,0,0,0,0|2,0,0]=4 2829 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [1,1,0,0,0,0|2,0,0]=4 2830 B12R2.612 Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009816850 [1,1,0,0,0,0|2,0,0]=4 2831 B12R2.612 Cn1ccc2c1ccc(c2)O 271570a_203496583355_100011202928 [1,1,0,0,0,0|1,0,1]=4 2832 B12R2.612 Cn1cnc2c1ccc(c2)O 271570a_203496583355_100000718706 [1,1,0,0,0,0|0,0,2]=4 2833 B12R2.612 Nc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100011934401 [1,1,0,0,0,0|2,0,0]=4 2834 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [1,1,0,0,0,0|2,0,0]=4 2835 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [1,1,0,0,0,0|2,0,0]=4 2836 B12R2.143 COCc1ccc2c(c1)CC2 34a_100010733339_200000210301 [0,1,0,0,1,0|1,0,1]=4 2837 B12R2.143 COCc1ccc2c(c1)CC2 7a_100010733339_200000210301 [0,1,0,0,1,0|1,0,1]=4 2838 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 34a_100010733339_200025704644 [0,1,0,0,1,0|1,0,1]=4 2839 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 7a_100010733339_200025704644 [0,1,0,0,1,0|1,0,1]=4 2840 B14R2.92 CNc1ccc2cnccc2c1Cl 34a_100009851981_200000210301 [0,1,0,0,0,1|2,0,0]=4 2841 B14R2.92 CNc1ccc2ncccc2c1Br 34a_200009995563_200000210301 [0,1,0,0,0,1|2,0,0]=4 2842 B14R2.92 CNc1ccc2nccnc2c1C 27a_100102657272_100135414757 [0,1,0,0,0,1|1,0,1]=4 2843 B14R2.92 COc1ccc2ccccc2c1Br 34a_100000183829_200000210301 [0,1,0,0,0,1|2,0,0]=4 2844 B14R2.92 COc1ccc2ccccc2c1Br 7a_100000183829_200000210301 [0,1,0,0,0,1|2,0,0]=4 2845 B14R2.92 COc1ccc2ccccc2c1C 34a_100009830054_200000210301 [0,1,0,0,0,1|2,0,0]=4 2846 B14R2.92 COc1ccc2ccccc2c1C 7a_100009830054_200000210301 [0,1,0,0,0,1|2,0,0]=4 2847 B14R2.92 COc1ccc2ccccc2c1Cl 34a_100000029778_200000210301 [0,1,0,0,0,1|2,0,0]=4 2848 B14R2.92 COc1ccc2ccccc2c1Cl 7a_100000029778_200000210301 [0,1,0,0,0,1|2,0,0]=4 2849 B14R2.92 COc1ccc2ccccc2c1I 34a_100000041551_200000210301 [0,1,0,0,0,1|2,0,0]=4 2850 B14R2.92 COc1ccc2ccccc2c1I 7a_100000041551_200000210301 [0,1,0,0,0,1|2,0,0]=4 2851 B14R2.92 COc1ccc2ccccc2c1N 34a_100000007056_200000210301 [0,1,0,0,0,1|2,0,0]=4 2852 B14R2.92 COc1ccc2ccccc2c1N 7a_100000007056_200000210301 [0,1,0,0,0,1|2,0,0]=4 2853 B14R2.92 COc1ccc2ccccc2c1O 271570a_203496583355_100000173347 [0,1,0,0,0,1|2,0,0]=4 2854 B14R2.92 COc1ccc2cccnc2c1Br 34a_100010173343_200000210301 [0,1,0,0,0,1|1,0,1]=4 2855 B14R2.92 COc1ccc2cccnc2c1Br 7a_100010173343_200000210301 [0,1,0,0,0,1|1,0,1]=4 2856 B14R2.92 COc1ccc2cccnc2c1O 271570a_203496583355_100010071576 [0,1,0,0,0,1|1,0,1]=4 2857 B14R2.92 COc1ccc2ccncc2c1Br 34a_200010115057_200000210301 [0,1,0,0,0,1|1,0,1]=4 2858 B14R2.92 COc1ccc2ccncc2c1Br 7a_200010115057_200000210301 [0,1,0,0,0,1|1,0,1]=4 2859 B14R2.92 COc1ccc2cnccc2c1Cl 34a_100009824633_200000210301 [0,1,0,0,0,1|1,0,0]=3 2860 B14R2.92 COc1ccc2cnccc2c1Cl 7a_100009824633_200000210301 [0,1,0,0,0,1|1,0,0]=3 2861 B14R2.92 CSc1ccc2cnccc2c1N 62a_100010191621_200000210301 [0,1,0,0,0,1|1,1,0]=4 2862 B14R2.92 CSc1ccc2cnccc2c1N 62a_200000210301_100010191621 [0,1,0,0,0,1|1,1,0]=4 2863 B14R2.92 CSc1ccc2ncccc2c1C 62a_200000210301_200010137439 [0,1,0,0,0,1|1,1,0]=4 2864 B14R2.92 CSc1ccc2ncccc2c1C 62a_200010137439_200000210301 [0,1,0,0,0,1|1,1,0]=4 2865 B14R2.92 CSc1ccc2ncccc2c1N 62a_200010235790_200000210301 [0,1,0,0,0,1|1,1,0]=4 2866 B14R2.92 CSc1ccc2nccnc2c1C 62a_100135414757_200000210301 [0,1,0,0,0,1|0,1,1]=4 2867 B14R2.92 CSc1ccc2nccnc2c1C 62a_200000210301_100135414757 [0,1,0,0,0,1|0,1,1]=4 2868 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 34a_100009830054_200025704644 [0,1,0,0,0,1|2,0,0]=4 2869 B14R2.92 Cc1c(ccc2c1cccc2)O[13CH3] 7a_100009830054_200025704644 [0,1,0,0,0,1|2,0,0]=4 2870 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200010137439_200025704644 [0,1,0,0,0,1|1,1,0]=4 2871 B14R2.92 Cc1c(ccc2c1cccn2)S[13CH3] 62a_200025704644_200010137439 [0,1,0,0,0,1|1,1,0]=4 2872 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_100135414757_200025704644 [0,1,0,0,0,1|0,1,1]=4 2873 B14R2.92 Cc1c(ccc2c1nccn2)S[13CH3] 62a_200025704644_100135414757 [0,1,0,0,0,1|0,1,1]=4 2874 B14R2.92 [13CH3]Nc1ccc2cnccc2c1Cl 34a_100009851981_200025704644 [0,1,0,0,0,1|2,0,0]=4 2875 B14R2.92 [13CH3]Nc1ccc2ncccc2c1Br 34a_200009995563_200025704644 [0,1,0,0,0,1|2,0,0]=4 2876 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 34a_100000183829_200025704644 [0,1,0,0,0,1|2,0,0]=4 2877 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Br 7a_100000183829_200025704644 [0,1,0,0,0,1|2,0,0]=4 2878 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 34a_100000029778_200025704644 [0,1,0,0,0,1|2,0,0]=4 2879 B14R2.92 [13CH3]Oc1ccc2ccccc2c1Cl 7a_100000029778_200025704644 [0,1,0,0,0,1|2,0,0]=4 2880 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 34a_100000041551_200025704644 [0,1,0,0,0,1|2,0,0]=4 2881 B14R2.92 [13CH3]Oc1ccc2ccccc2c1I 7a_100000041551_200025704644 [0,1,0,0,0,1|2,0,0]=4 2882 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 34a_100000007056_200025704644 [0,1,0,0,0,1|2,0,0]=4 2883 B14R2.92 [13CH3]Oc1ccc2ccccc2c1N 7a_100000007056_200025704644 [0,1,0,0,0,1|2,0,0]=4 2884 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 34a_100010173343_200025704644 [0,1,0,0,0,1|1,0,1]=4 2885 B14R2.92 [13CH3]Oc1ccc2cccnc2c1Br 7a_100010173343_200025704644 [0,1,0,0,0,1|1,0,1]=4 2886 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 34a_200010115057_200025704644 [0,1,0,0,0,1|1,0,1]=4 2887 B14R2.92 [13CH3]Oc1ccc2ccncc2c1Br 7a_200010115057_200025704644 [0,1,0,0,0,1|1,0,1]=4 2888 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 34a_100009824633_200025704644 [0,1,0,0,0,1|1,0,0]=3 2889 B14R2.92 [13CH3]Oc1ccc2cnccc2c1Cl 7a_100009824633_200025704644 [0,1,0,0,0,1|1,0,0]=3 2890 B14R2.92 [13CH3]Sc1ccc2cnccc2c1N 62a_100010191621_200025704644 [0,1,0,0,0,1|1,1,0]=4 2891 B14R2.92 [13CH3]Sc1ccc2cnccc2c1N 62a_200025704644_100010191621 [0,1,0,0,0,1|1,1,0]=4 2892 B14R2.92 [13CH3]Sc1ccc2ncccc2c1N 62a_200010235790_200025704644 [0,1,0,0,0,1|1,1,0]=4 2893 B14R2.112 CC=Cc1ccc2cnccc2c1 271570a_100016259895_100009816743 [0,1,0,0,0,1|2,0,0]=4 2894 B14R2.112 CC=Cc1ccc2cncnc2c1 271570a_100016259895_100010185614 [0,1,0,0,0,1|1,0,1]=4 2895 B14R2.112 CC=Cc1ccc2ncccc2c1 271570a_100016259895_100000754243 [0,1,0,0,0,1|2,0,0]=4 2896 B14R2.112 CC=Cc1ccc2nccnc2c1 271570a_100016259895_100011219451 [0,1,0,0,0,1|1,0,1]=4 2897 B14R2.112 CC=Cc1ccc2ncncc2c1 271570a_100016259895_100009989443 [0,1,0,0,0,1|1,0,1]=4 2898 B14R2.112 CC=Cc1ccc2nnccc2c1 271570a_100016259895_100010209549 [0,1,0,0,0,1|2,0,0]=4 2899 B14R2.112 CCNc1ccc2cnccc2c1 34a_100000039641_100000210202 [0,1,0,0,0,1|2,0,0]=4 2900 B14R2.112 CCNc1ccc2cncnc2c1 27a_100015525214_100010185614 [0,1,0,0,0,1|1,0,1]=4 2901 B14R2.112 CCNc1ccc2ncccc2c1 34a_100011198106_100000210202 [0,1,0,0,0,1|2,0,0]=4 2902 B14R2.112 CCNc1ccc2nccnc2c1 27a_100015525214_100011219451 [0,1,0,0,0,1|1,0,1]=4 2903 B14R2.112 CCNc1ccc2nccnc2c1 34a_100011219565_100000210202 [0,1,0,0,0,1|1,0,1]=4 2904 B14R2.112 CCOc1ccc2c(c1)CNCC2 34a_100015185785_100000210202 [0,1,0,0,0,1|1,0,1]=4 2905 B14R2.112 CCOc1ccc2c(c1)NCCC2 34a_106638131596_100000210202 [0,1,0,0,0,1|1,0,1]=4 2906 B14R2.112 CCOc1ccc2c(c1)NCCO2 34a_100020636358_100000210202 [0,1,0,0,0,1|1,0,1]=4 2907 B14R2.112 CCOc1ccc2ccccc2c1 34a_100000185828_100000210202 [0,1,0,0,0,1|2,0,0]=4 2908 B14R2.112 CCOc1ccc2ccccc2c1 7a_100000185828_100000210202 [0,1,0,0,0,1|2,0,0]=4 2909 B14R2.112 CCOc1ccc2cccnc2c1 34a_100011216045_100000210202 [0,1,0,0,0,1|1,0,1]=4 2910 B14R2.112 CCOc1ccc2ccncc2c1 7a_100000752006_100000210202 [0,1,0,0,0,1|1,0,1]=4 2911 B14R2.112 CCOc1ccc2cnccc2c1 34a_100000046372_100000210202 [0,1,0,0,0,1|1,0,0]=3 2912 B14R2.112 CCOc1ccc2cnccc2c1 7a_100000046372_100000210202 [0,1,0,0,0,1|1,0,0]=3 2913 B14R2.112 CCOc1ccc2ncccc2c1 34a_100011215586_100000210202 [0,1,0,0,0,1|1,0,0]=3 2914 B14R2.112 CCOc1ccc2ncccc2c1 7a_100011215586_100000210202 [0,1,0,0,0,1|1,0,0]=3 2915 B14R2.112 CCOc1ccc2nccnc2c1 34a_100000694412_100000210202 [0,1,0,0,0,1|0,0,1]=3 2916 B14R2.112 CCSc1ccc2cnccc2c1 62a_100000210202_100009816743 [0,1,0,0,0,1|1,1,0]=4 2917 B14R2.112 CCSc1ccc2cnccc2c1 62a_100009816743_100000210202 [0,1,0,0,0,1|1,1,0]=4 2918 B14R2.112 CCSc1ccc2cncnc2c1 62a_100000210202_100010185614 [0,1,0,0,0,1|0,1,1]=4 2919 B14R2.112 CCSc1ccc2cncnc2c1 62a_100010185614_100000210202 [0,1,0,0,0,1|0,1,1]=4 2920 B14R2.112 CCSc1ccc2ncccc2c1 62a_100000210202_100011215947 [0,1,0,0,0,1|1,1,0]=4 2921 B14R2.112 CCSc1ccc2ncccc2c1 62a_100011215947_100000210202 [0,1,0,0,0,1|1,1,0]=4 2922 B14R2.112 CCSc1ccc2nccnc2c1 62a_100000210202_100011219451 [0,1,0,0,0,1|0,1,1]=4 2923 B14R2.112 CCSc1ccc2nccnc2c1 62a_100011219451_100000210202 [0,1,0,0,0,1|0,1,1]=4 2924 B14R2.112 CCSc1ccc2ncncc2c1 62a_100000210202_100009989443 [0,1,0,0,0,1|0,1,1]=4 2925 B14R2.112 CCSc1ccc2ncncc2c1 62a_100009989443_100000210202 [0,1,0,0,0,1|0,1,1]=4 2926 B14R2.112 CCSc1ccc2nnccc2c1 62a_100000210202_100010209549 [0,1,0,0,0,1|1,1,0]=4 2927 B14R2.112 CCSc1ccc2nnccc2c1 62a_100010209549_100000210202 [0,1,0,0,0,1|1,1,0]=4 2928 B14R2.112 CNCc1ccc2cnccc2c1 207a_100102657272_100000068276 [0,1,0,0,0,1|2,0,0]=4 2929 B14R2.112 CNCc1ccc2cnccc2c1 2230a_106832991635_100020605334 [0,1,0,0,0,1|2,0,0]=4 2930 B14R2.112 CNCc1ccc2cnccc2c1 270004a_106832991635_100000068276 [0,1,0,0,0,1|2,0,0]=4 2931 B14R2.112 CNCc1ccc2cnccc2c1 34a_100102657272_100020605334 [0,1,0,0,0,1|2,0,0]=4 2932 B14R2.112 CNCc1ccc2cnccc2c1 7a_106832991635_100020605334 [0,1,0,0,0,1|2,0,0]=4 2933 B14R2.112 CNCc1ccc2ncccc2c1 207a_100102657272_100000211315 [0,1,0,0,0,1|2,0,0]=4 2934 B14R2.112 CNCc1ccc2ncccc2c1 2230a_106832991635_100000703657 [0,1,0,0,0,1|2,0,0]=4 2935 B14R2.112 CNCc1ccc2ncccc2c1 270004a_106832991635_100000211315 [0,1,0,0,0,1|2,0,0]=4 2936 B14R2.112 CNCc1ccc2ncccc2c1 34a_100000238500_200000210301 [0,1,0,0,0,1|2,0,0]=4 2937 B14R2.112 CNCc1ccc2ncccc2c1 34a_100102657272_100000703657 [0,1,0,0,0,1|2,0,0]=4 2938 B14R2.112 CNCc1ccc2ncccc2c1 7a_106832991635_100000703657 [0,1,0,0,0,1|2,0,0]=4 2939 B14R2.112 CNCc1ccc2nccnc2c1 2230a_106832991635_200011762199 [0,1,0,0,0,1|1,0,1]=4 2940 B14R2.112 CNCc1ccc2nccnc2c1 270004a_106832991635_100000239887 [0,1,0,0,0,1|1,0,1]=4 2941 B14R2.112 CNCc1ccc2nccnc2c1 7a_106832991635_200011762199 [0,1,0,0,0,1|1,0,1]=4 2942 B14R2.112 COCc1ccc2c(c1)CNCC2 34a_100138411858_200000210301 [0,1,0,0,0,1|1,0,1]=4 2943 B14R2.112 COCc1ccc2ccccc2c1 34a_100011215330_200000210301 [0,1,0,0,0,1|2,0,0]=4 2944 B14R2.112 COCc1ccc2ccccc2c1 34a_100138415774_100011216711 [0,1,0,0,0,1|2,0,0]=4 2945 B14R2.112 COCc1ccc2ccccc2c1 7a_100011215330_200000210301 [0,1,0,0,0,1|2,0,0]=4 2946 B14R2.112 COCc1ccc2cnccc2c1 34a_100138415774_100020605334 [0,1,0,0,0,1|1,0,0]=3 2947 B14R2.112 COCc1ccc2ncccc2c1 34a_100011315636_200000210301 [0,1,0,0,0,1|1,0,0]=3 2948 B14R2.112 COCc1ccc2ncccc2c1 34a_100138415774_100000703657 [0,1,0,0,0,1|1,0,0]=3 2949 B14R2.112 CSCc1ccc2cnccc2c1 62a_100020605334_200000210301 [0,1,0,0,0,1|1,1,0]=4 2950 B14R2.112 CSCc1ccc2cnccc2c1 62a_200000210301_100020605334 [0,1,0,0,0,1|1,1,0]=4 2951 B14R2.112 CSCc1ccc2ncccc2c1 62a_100000703657_200000210301 [0,1,0,0,0,1|1,1,0]=4 2952 B14R2.112 CSCc1ccc2ncccc2c1 62a_200000210301_100000703657 [0,1,0,0,0,1|1,1,0]=4 2953 B14R2.112 CSCc1ccc2nccnc2c1 62a_200000210301_200011762199 [0,1,0,0,0,1|0,1,1]=4 2954 B14R2.112 CSCc1ccc2nccnc2c1 62a_200011762199_200000210301 [0,1,0,0,0,1|0,1,1]=4 2955 B14R2.112 FCNc1ccc2cnccc2c1 34a_100000039641_100015361967 [0,1,0,0,0,1|2,0,0]=4 2956 B14R2.112 FCNc1ccc2ncccc2c1 34a_100011198106_100015361967 [0,1,0,0,0,1|2,0,0]=4 2957 B14R2.112 FCNc1ccc2nccnc2c1 34a_100011219565_100015361967 [0,1,0,0,0,1|1,0,1]=4 2958 B14R2.112 FCOc1ccc2c(c1)CNCC2 34a_100015185785_100015361967 [0,1,0,0,0,1|1,0,1]=4 2959 B14R2.112 FCOc1ccc2c(c1)NCCC2 34a_106638131596_100015361967 [0,1,0,0,0,1|1,0,1]=4 2960 B14R2.112 FCOc1ccc2c(c1)NCCO2 34a_100020636358_100015361967 [0,1,0,0,0,1|1,0,1]=4 2961 B14R2.112 FCOc1ccc2ccccc2c1 34a_100000185828_100015361967 [0,1,0,0,0,1|2,0,0]=4 2962 B14R2.112 FCOc1ccc2ccccc2c1 7a_100000185828_100015361967 [0,1,0,0,0,1|2,0,0]=4 2963 B14R2.112 FCOc1ccc2cccnc2c1 34a_100011216045_100015361967 [0,1,0,0,0,1|1,0,1]=4 2964 B14R2.112 FCOc1ccc2ccncc2c1 7a_100000752006_100015361967 [0,1,0,0,0,1|1,0,1]=4 2965 B14R2.112 FCOc1ccc2cnccc2c1 34a_100000046372_100015361967 [0,1,0,0,0,1|1,0,0]=3 2966 B14R2.112 FCOc1ccc2cnccc2c1 7a_100000046372_100015361967 [0,1,0,0,0,1|1,0,0]=3 2967 B14R2.112 FCOc1ccc2ncccc2c1 34a_100011215586_100015361967 [0,1,0,0,0,1|1,0,0]=3 2968 B14R2.112 FCOc1ccc2ncccc2c1 7a_100011215586_100015361967 [0,1,0,0,0,1|1,0,0]=3 2969 B14R2.112 FCOc1ccc2nccnc2c1 34a_100000694412_100015361967 [0,1,0,0,0,1|0,0,1]=3 2970 B14R2.112 FCSc1ccc2cnccc2c1 62a_100009816743_100015361967 [0,1,0,0,0,1|1,1,0]=4 2971 B14R2.112 FCSc1ccc2cnccc2c1 62a_100015361967_100009816743 [0,1,0,0,0,1|1,1,0]=4 2972 B14R2.112 FCSc1ccc2cncnc2c1 62a_100010185614_100015361967 [0,1,0,0,0,1|0,1,1]=4 2973 B14R2.112 FCSc1ccc2cncnc2c1 62a_100015361967_100010185614 [0,1,0,0,0,1|0,1,1]=4 2974 B14R2.112 FCSc1ccc2ncccc2c1 62a_100011215947_100015361967 [0,1,0,0,0,1|1,1,0]=4 2975 B14R2.112 FCSc1ccc2ncccc2c1 62a_100015361967_100011215947 [0,1,0,0,0,1|1,1,0]=4 2976 B14R2.112 FCSc1ccc2nccnc2c1 62a_100011219451_100015361967 [0,1,0,0,0,1|0,1,1]=4 2977 B14R2.112 FCSc1ccc2nccnc2c1 62a_100015361967_100011219451 [0,1,0,0,0,1|0,1,1]=4 2978 B14R2.112 FCSc1ccc2ncncc2c1 62a_100009989443_100015361967 [0,1,0,0,0,1|0,1,1]=4 2979 B14R2.112 FCSc1ccc2ncncc2c1 62a_100015361967_100009989443 [0,1,0,0,0,1|0,1,1]=4 2980 B14R2.112 FCSc1ccc2nnccc2c1 62a_100010209549_100015361967 [0,1,0,0,0,1|1,1,0]=4 2981 B14R2.112 FCSc1ccc2nnccc2c1 62a_100015361967_100010209549 [0,1,0,0,0,1|1,1,0]=4 2982 B14R2.112 [13CH3]NCc1ccc2ncccc2c1 34a_100000238500_200025704644 [0,1,0,0,0,1|2,0,0]=4 2983 B14R2.112 [13CH3]OCc1ccc2c(c1)CNCC2 34a_100138411858_200025704644 [0,1,0,0,0,1|1,0,1]=4 2984 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 34a_100011215330_200025704644 [0,1,0,0,0,1|2,0,0]=4 2985 B14R2.112 [13CH3]OCc1ccc2ccccc2c1 7a_100011215330_200025704644 [0,1,0,0,0,1|2,0,0]=4 2986 B14R2.112 [13CH3]OCc1ccc2ncccc2c1 34a_100011315636_200025704644 [0,1,0,0,0,1|1,0,0]=3 2987 B14R2.112 [13CH3]SCc1ccc2cnccc2c1 62a_100020605334_200025704644 [0,1,0,0,0,1|1,1,0]=4 2988 B14R2.112 [13CH3]SCc1ccc2cnccc2c1 62a_200025704644_100020605334 [0,1,0,0,0,1|1,1,0]=4 2989 B14R2.112 [13CH3]SCc1ccc2ncccc2c1 62a_100000703657_200025704644 [0,1,0,0,0,1|1,1,0]=4 2990 B14R2.112 [13CH3]SCc1ccc2ncccc2c1 62a_200025704644_100000703657 [0,1,0,0,0,1|1,1,0]=4 2991 B14R2.112 [13CH3]SCc1ccc2nccnc2c1 62a_200011762199_200025704644 [0,1,0,0,0,1|0,1,1]=4 2992 B14R2.112 [13CH3]SCc1ccc2nccnc2c1 62a_200025704644_200011762199 [0,1,0,0,0,1|0,1,1]=4 2993 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200000210301 [0,1,0,0,0,1|2,0,0]=4 2994 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200000210301 [0,1,0,0,0,1|2,0,0]=4 2995 B14R2.134 CNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200000210301 [0,1,0,0,0,1|2,0,0]=4 2996 B14R2.134 CNc1ccc2cnc(nc2c1)C 27a_100102657272_100010233817 [0,1,0,0,0,1|1,0,1]=4 2997 B14R2.134 CNc1ccc2cnc(nc2c1)N 27a_100102657272_100010199760 [0,1,0,0,0,1|1,0,1]=4 2998 B14R2.134 CNc1ccc2ncc(cc2c1)Br 34a_100009888932_200000210301 [0,1,0,0,0,1|2,0,0]=4 2999 B14R2.134 COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_200000210301 [0,1,0,0,0,1|2,0,0]=4 3000 B14R2.134 COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_200000210301 [0,1,0,0,0,1|2,0,0]=4 3001 B14R2.134 COc1ccc2c(c1)CN(CC2)C 2230a_100015207042_200000210301 [0,1,0,0,0,1|1,0,1]=4 3002 B14R2.134 COc1ccc2c(c1)CN(CC2)C 269982a_100015207042_200000210301 [0,1,0,0,0,1|1,0,1]=4 3003 B14R2.134 COc1ccc2c(c1)CN(CC2)C 34a_100015207042_200000210301 [0,1,0,0,0,1|1,0,1]=4 3004 B14R2.134 COc1ccc2c(c1)CN(CC2)[13CH3] 2230a_100015207042_200025704644 [0,1,0,0,0,1|1,0,1]=4 3005 B14R2.134 COc1ccc2c(c1)CN(CC2)[13CH3] 269982a_100015207042_200025704644 [0,1,0,0,0,1|1,0,1]=4 3006 B14R2.134 COc1ccc2c(c1)CN(CC2)[13CH3] 34a_100015207042_200025704644 [0,1,0,0,0,1|1,0,1]=4 3007 B14R2.134 COc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200000210301 [0,1,0,0,0,1|1,0,0]=3 3008 B14R2.134 COc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200000210301 [0,1,0,0,0,1|1,0,0]=3 3009 B14R2.134 COc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200000210301 [0,1,0,0,0,1|2,0,0]=4 3010 B14R2.134 COc1ccc2ccc(=O)oc2c1 34a_100000185914_200000210301 [0,1,0,0,0,1|2,0,0]=4 3011 B14R2.134 COc1ccc2ccc(=O)oc2c1 7a_100000185914_200000210301 [0,1,0,0,0,1|2,0,0]=4 3012 B14R2.134 COc1ccc2ccc(cc2c1)Br 34a_100009816537_200000210301 [0,1,0,0,0,1|2,0,0]=4 3013 B14R2.134 COc1ccc2ccc(cc2c1)Br 7a_100009816537_200000210301 [0,1,0,0,0,1|2,0,0]=4 3014 B14R2.134 COc1ccc2ccc(cc2c1)C 34a_100000091598_200000210301 [0,1,0,0,0,1|2,0,0]=4 3015 B14R2.134 COc1ccc2ccc(cc2c1)C 7a_100000091598_200000210301 [0,1,0,0,0,1|2,0,0]=4 3016 B14R2.134 COc1ccc2ccc(cc2c1)N 34a_100015378740_200000210301 [0,1,0,0,0,1|2,0,0]=4 3017 B14R2.134 COc1ccc2ccc(cc2c1)N 7a_100015378740_200000210301 [0,1,0,0,0,1|2,0,0]=4 3018 B14R2.134 COc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090027 [0,1,0,0,0,1|2,0,0]=4 3019 B14R2.134 COc1ccc2ccc(nc2c1)C 34a_100009867695_200000210301 [0,1,0,0,0,1|1,0,1]=4 3020 B14R2.134 COc1ccc2ccc(nc2c1)C 7a_100009867695_200000210301 [0,1,0,0,0,1|1,0,1]=4 3021 B14R2.134 COc1ccc2ccc(nc2c1)Cl 34a_100000079174_200000210301 [0,1,0,0,0,1|1,0,1]=4 3022 B14R2.134 COc1ccc2ccc(nc2c1)Cl 7a_100000079174_200000210301 [0,1,0,0,0,1|1,0,1]=4 3023 B14R2.134 COc1ccc2ccc(nc2c1)O 271570a_203496583355_100009877240 [0,1,0,0,0,1|1,0,1]=4 3024 B14R2.134 COc1ccc2cnc(nc2c1)O 271570a_203496583355_100000059825 [0,1,0,0,0,1|0,0,1]=3 3025 B14R2.134 COc1ccc2ncc(cc2c1)Br 34a_100010137430_200000210301 [0,1,0,0,0,1|1,0,0]=3 3026 B14R2.134 COc1ccc2ncc(cc2c1)Br 7a_100010137430_200000210301 [0,1,0,0,0,1|1,0,0]=3 3027 B14R2.134 COc1ccc2ncc(cc2c1)Cl 34a_100009869629_200000210301 [0,1,0,0,0,1|1,0,0]=3 3028 B14R2.134 COc1ccc2ncc(cc2c1)Cl 7a_100009869629_200000210301 [0,1,0,0,0,1|1,0,0]=3 3029 B14R2.134 COc1ccc2ncc(cc2c1)F 34a_100009845357_200000210301 [0,1,0,0,0,1|1,0,0]=3 3030 B14R2.134 COc1ccc2ncc(cc2c1)F 7a_100009845357_200000210301 [0,1,0,0,0,1|1,0,0]=3 3031 B14R2.134 COc1ccc2ncc(cc2c1)O 271570a_203496583355_100000700671 [0,1,0,0,0,1|1,0,0]=3 3032 B14R2.134 COc1ccc2ncc(nc2c1)Cl 34a_200020640061_200000210301 [0,1,0,0,0,1|0,0,1]=3 3033 B14R2.134 COc1ccc2ncc(nc2c1)O 271570a_203496583355_100009882714 [0,1,0,0,0,1|0,0,1]=3 3034 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200000210301 [0,1,0,0,0,1|1,1,0]=4 3035 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_200000210301_100000763451 [0,1,0,0,0,1|1,1,0]=4 3036 B14R2.134 CSc1ccc2c(c1)NC(=O)NC2 62a_100010161048_200000210301 [0,1,0,0,0,1|0,1,1]=4 3037 B14R2.134 CSc1ccc2c(c1)NC(=O)NC2 62a_200000210301_100010161048 [0,1,0,0,0,1|0,1,1]=4 3038 B14R2.134 CSc1ccc2cnc(cc2c1)F 62a_100010291885_200000210301 [0,1,0,0,0,1|1,1,0]=4 3039 B14R2.134 CSc1ccc2cnc(cc2c1)F 62a_200000210301_100010291885 [0,1,0,0,0,1|1,1,0]=4 3040 B14R2.134 CSc1ccc2cnc(cc2c1)N 62a_100009817123_200000210301 [0,1,0,0,0,1|1,1,0]=4 3041 B14R2.134 CSc1ccc2cnc(cc2c1)N 62a_200000210301_100009817123 [0,1,0,0,0,1|1,1,0]=4 3042 B14R2.134 CSc1ccc2cnc(cc2c1)O 62a_200000210301_100009817130 [0,1,0,0,0,1|1,1,0]=4 3043 B14R2.134 CSc1ccc2cnc(nc2c1)C 62a_100010233817_200000210301 [0,1,0,0,0,1|0,1,1]=4 3044 B14R2.134 CSc1ccc2cnc(nc2c1)C 62a_200000210301_100010233817 [0,1,0,0,0,1|0,1,1]=4 3045 B14R2.134 CSc1ccc2cnc(nc2c1)N 62a_100010199760_200000210301 [0,1,0,0,0,1|0,1,1]=4 3046 B14R2.134 CSc1ccc2cnc(nc2c1)N 62a_200000210301_100010199760 [0,1,0,0,0,1|0,1,1]=4 3047 B14R2.134 CSc1ccc2ncc(cc2c1)Br 62a_200000210301_200010254249 [0,1,0,0,0,1|1,1,0]=4 3048 B14R2.134 CSc1ccc2ncc(cc2c1)Br 62a_200010254249_200000210301 [0,1,0,0,0,1|1,1,0]=4 3049 B14R2.134 CSc1ccc2ncc(cc2c1)C 62a_200000210301_100009817055 [0,1,0,0,0,1|1,1,0]=4 3050 B14R2.134 CSc1ccc2ncc(cc2c1)O 62a_200000210301_100000703654 [0,1,0,0,0,1|1,1,0]=4 3051 B14R2.134 CSc1ccc2ncc(nc2c1)N 62a_100010090528_200000210301 [0,1,0,0,0,1|0,1,1]=4 3052 B14R2.134 CSc1ccc2ncc(nc2c1)N 62a_200000210301_100010090528 [0,1,0,0,0,1|0,1,1]=4 3053 B14R2.134 CSc1ccc2ncc(nc2c1)O 62a_200000210301_100010000190 [0,1,0,0,0,1|0,1,1]=4 3054 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 34a_100000091598_200025704644 [0,1,0,0,0,1|2,0,0]=4 3055 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 7a_100000091598_200025704644 [0,1,0,0,0,1|2,0,0]=4 3056 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 34a_100009867695_200025704644 [0,1,0,0,0,1|1,0,1]=4 3057 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 7a_100009867695_200025704644 [0,1,0,0,0,1|1,0,1]=4 3058 B14R2.134 Cc1cnc2ccc(cc2c1)S[13CH3] 62a_200025704644_100009817055 [0,1,0,0,0,1|1,1,0]=4 3059 B14R2.134 Cc1ncc2ccc(cc2n1)S[13CH3] 62a_100010233817_200025704644 [0,1,0,0,0,1|0,1,1]=4 3060 B14R2.134 Cc1ncc2ccc(cc2n1)S[13CH3] 62a_200025704644_100010233817 [0,1,0,0,0,1|0,1,1]=4 3061 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200025704644 [0,1,0,0,0,1|2,0,0]=4 3062 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200025704644 [0,1,0,0,0,1|2,0,0]=4 3063 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200025704644 [0,1,0,0,0,1|2,0,0]=4 3064 B14R2.134 [13CH3]Nc1ccc2ncc(cc2c1)Br 34a_100009888932_200025704644 [0,1,0,0,0,1|2,0,0]=4 3065 B14R2.134 [13CH3]Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_200025704644 [0,1,0,0,0,1|2,0,0]=4 3066 B14R2.134 [13CH3]Oc1ccc2c(c1)CC(=O)CC2 7a_200000081095_200025704644 [0,1,0,0,0,1|2,0,0]=4 3067 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200025704644 [0,1,0,0,0,1|1,0,0]=3 3068 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200025704644 [0,1,0,0,0,1|1,0,0]=3 3069 B14R2.134 [13CH3]Oc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200025704644 [0,1,0,0,0,1|2,0,0]=4 3070 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 34a_100000185914_200025704644 [0,1,0,0,0,1|2,0,0]=4 3071 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 7a_100000185914_200025704644 [0,1,0,0,0,1|2,0,0]=4 3072 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 34a_100009816537_200025704644 [0,1,0,0,0,1|2,0,0]=4 3073 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 7a_100009816537_200025704644 [0,1,0,0,0,1|2,0,0]=4 3074 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 34a_100015378740_200025704644 [0,1,0,0,0,1|2,0,0]=4 3075 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 7a_100015378740_200025704644 [0,1,0,0,0,1|2,0,0]=4 3076 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 34a_100000079174_200025704644 [0,1,0,0,0,1|1,0,1]=4 3077 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 7a_100000079174_200025704644 [0,1,0,0,0,1|1,0,1]=4 3078 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Br 34a_100010137430_200025704644 [0,1,0,0,0,1|1,0,0]=3 3079 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Br 7a_100010137430_200025704644 [0,1,0,0,0,1|1,0,0]=3 3080 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Cl 34a_100009869629_200025704644 [0,1,0,0,0,1|1,0,0]=3 3081 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)Cl 7a_100009869629_200025704644 [0,1,0,0,0,1|1,0,0]=3 3082 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)F 34a_100009845357_200025704644 [0,1,0,0,0,1|1,0,0]=3 3083 B14R2.134 [13CH3]Oc1ccc2ncc(cc2c1)F 7a_100009845357_200025704644 [0,1,0,0,0,1|1,0,0]=3 3084 B14R2.134 [13CH3]Oc1ccc2ncc(nc2c1)Cl 34a_200020640061_200025704644 [0,1,0,0,0,1|0,0,1]=3 3085 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200025704644 [0,1,0,0,0,1|1,1,0]=4 3086 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_200025704644_100000763451 [0,1,0,0,0,1|1,1,0]=4 3087 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)NC2 62a_100010161048_200025704644 [0,1,0,0,0,1|0,1,1]=4 3088 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)NC2 62a_200025704644_100010161048 [0,1,0,0,0,1|0,1,1]=4 3089 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)F 62a_100010291885_200025704644 [0,1,0,0,0,1|1,1,0]=4 3090 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)F 62a_200025704644_100010291885 [0,1,0,0,0,1|1,1,0]=4 3091 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)N 62a_100009817123_200025704644 [0,1,0,0,0,1|1,1,0]=4 3092 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)N 62a_200025704644_100009817123 [0,1,0,0,0,1|1,1,0]=4 3093 B14R2.134 [13CH3]Sc1ccc2cnc(cc2c1)O 62a_200025704644_100009817130 [0,1,0,0,0,1|1,1,0]=4 3094 B14R2.134 [13CH3]Sc1ccc2cnc(nc2c1)N 62a_100010199760_200025704644 [0,1,0,0,0,1|0,1,1]=4 3095 B14R2.134 [13CH3]Sc1ccc2cnc(nc2c1)N 62a_200025704644_100010199760 [0,1,0,0,0,1|0,1,1]=4 3096 B14R2.134 [13CH3]Sc1ccc2ncc(cc2c1)Br 62a_200010254249_200025704644 [0,1,0,0,0,1|1,1,0]=4 3097 B14R2.134 [13CH3]Sc1ccc2ncc(cc2c1)Br 62a_200025704644_200010254249 [0,1,0,0,0,1|1,1,0]=4 3098 B14R2.134 [13CH3]Sc1ccc2ncc(cc2c1)O 62a_200025704644_100000703654 [0,1,0,0,0,1|1,1,0]=4 3099 B14R2.134 [13CH3]Sc1ccc2ncc(nc2c1)N 62a_100010090528_200025704644 [0,1,0,0,0,1|0,1,1]=4 3100 B14R2.134 [13CH3]Sc1ccc2ncc(nc2c1)N 62a_200025704644_100010090528 [0,1,0,0,0,1|0,1,1]=4 3101 B14R2.134 [13CH3]Sc1ccc2ncc(nc2c1)O 62a_200025704644_100010000190 [0,1,0,0,0,1|0,1,1]=4 3102 B14R2.142 C=Cc1ccc2nc[nH]c(=O)c2c1 271570a_100011290941_100000755678 [0,1,0,0,0,1|1,0,1]=4 3103 B14R2.142 CN1CCCc2c1cc(cc2)O[13CH3] 34a_100009849403_200025704644 [0,1,0,0,0,1|1,0,1]=4 3104 B14R2.142 CN1CCCc2c1cc(cc2)O[13CH3] 7a_100009849403_200025704644 [0,1,0,0,0,1|1,0,1]=4 3105 B14R2.142 CNc1ccc2nc[nH]c(=O)c2n1 27a_100102657272_100000117605 [0,1,0,0,0,1|2,0,0]=4 3106 B14R2.142 CNc1ccc2nccc(c2c1)Br 34a_100010074812_200000210301 [0,1,0,0,0,1|2,0,0]=4 3107 B14R2.142 CNc1ccc2nccc(c2c1)Cl 34a_100009879071_200000210301 [0,1,0,0,0,1|2,0,0]=4 3108 B14R2.142 CNc1ccc2ncnc(c2c1)C 27a_100102657272_100000700471 [0,1,0,0,0,1|1,0,1]=4 3109 B14R2.142 CNc1cnc2nc[nH]c(=O)c2c1 27a_100102657272_100010182796 [0,1,0,0,0,1|2,0,0]=4 3110 B14R2.142 COc1ccc2c(c1)C(=O)NCC2 34a_100000081307_200000210301 [0,1,0,0,0,1|1,0,1]=4 3111 B14R2.142 COc1ccc2c(c1)C(=O)NCC2 7a_100000081307_200000210301 [0,1,0,0,0,1|1,0,1]=4 3112 B14R2.142 COc1ccc2c(c1)N(CCC2)C 34a_100009849403_200000210301 [0,1,0,0,0,1|1,0,1]=4 3113 B14R2.142 COc1ccc2c(c1)N(CCC2)C 7a_100009849403_200000210301 [0,1,0,0,0,1|1,0,1]=4 3114 B14R2.142 COc1ccc2cccc(c2c1)Br 34a_100010169565_200000210301 [0,1,0,0,0,1|2,0,0]=4 3115 B14R2.142 COc1ccc2cccc(c2c1)Br 7a_100010169565_200000210301 [0,1,0,0,0,1|2,0,0]=4 3116 B14R2.142 COc1ccc2cccc(c2c1)C 34a_200000091600_200000210301 [0,1,0,0,0,1|2,0,0]=4 3117 B14R2.142 COc1ccc2cccc(c2c1)C 7a_200000091600_200000210301 [0,1,0,0,0,1|2,0,0]=4 3118 B14R2.142 COc1ccc2cccc(c2c1)F 34a_100000091619_200000210301 [0,1,0,0,0,1|2,0,0]=4 3119 B14R2.142 COc1ccc2cccc(c2c1)F 7a_100000091619_200000210301 [0,1,0,0,0,1|2,0,0]=4 3120 B14R2.142 COc1ccc2cccc(c2c1)N 34a_100000034012_200000210301 [0,1,0,0,0,1|2,0,0]=4 3121 B14R2.142 COc1ccc2cccc(c2c1)N 7a_100000034012_200000210301 [0,1,0,0,0,1|2,0,0]=4 3122 B14R2.142 COc1ccc2cccc(c2c1)O 271570a_203496583355_100010178974 [0,1,0,0,0,1|2,0,0]=4 3123 B14R2.142 COc1ccc2ccnc(c2c1)Cl 34a_200009844553_200000210301 [0,1,0,0,0,1|1,0,1]=4 3124 B14R2.142 COc1ccc2ccnc(c2c1)Cl 7a_200009844553_200000210301 [0,1,0,0,0,1|1,0,1]=4 3125 B14R2.142 COc1ccc2ccnc(c2c1)O 271570a_203496583355_100012348807 [0,1,0,0,0,1|1,0,1]=4 3126 B14R2.142 COc1ccc2nc[nH]c(=O)c2c1 7a_100011934087_200000210301 [0,1,0,0,0,1|0,0,0]=2 3127 B14R2.142 COc1ccc2nccc(c2c1)Br 34a_100010204251_200000210301 [0,1,0,0,0,1|1,0,0]=3 3128 B14R2.142 COc1ccc2nccc(c2c1)Br 7a_100010204251_200000210301 [0,1,0,0,0,1|1,0,0]=3 3129 B14R2.142 COc1ccc2nccc(c2c1)Cl 34a_100000075933_200000210301 [0,1,0,0,0,1|1,0,0]=3 3130 B14R2.142 COc1ccc2nccc(c2c1)Cl 7a_100000075933_200000210301 [0,1,0,0,0,1|1,0,0]=3 3131 B14R2.142 COc1ccc2nccc(c2c1)O 271570a_203496583355_100011310462 [0,1,0,0,0,1|1,0,0]=3 3132 B14R2.142 COc1ccc2nccc(c2n1)O 271570a_203496583355_100000090520 [0,1,0,0,0,1|2,0,0]=4 3133 B14R2.142 COc1ccc2ncnc(c2c1)O 271570a_203496583355_100011804145 [0,1,0,0,0,1|0,0,1]=3 3134 B14R2.142 CSc1cc2c(=O)[nH]cnc2cn1 62a_200000210301_100000101234 [0,1,0,0,0,1|1,1,0]=4 3135 B14R2.142 CSc1ccc2cncc(c2c1)O 62a_200000210301_100010136424 [0,1,0,0,0,1|1,1,0]=4 3136 B14R2.142 CSc1ccc2nc[nH]c(=O)c2c1 62a_200000210301_100000755678 [0,1,0,0,0,1|0,1,0]=3 3137 B14R2.142 CSc1ccc2nc[nH]c(=O)c2n1 62a_200000210301_100000117605 [0,1,0,0,0,1|1,1,0]=4 3138 B14R2.142 CSc1ccc2nccc(c2c1)C 62a_100009817033_200000210301 [0,1,0,0,0,1|1,1,0]=4 3139 B14R2.142 CSc1ccc2nccc(c2c1)C 62a_200000210301_100009817033 [0,1,0,0,0,1|1,1,0]=4 3140 B14R2.142 CSc1ccc2nccc(c2c1)Cl 62a_100011310491_200000210301 [0,1,0,0,0,1|1,1,0]=4 3141 B14R2.142 CSc1ccc2nccc(c2c1)Cl 62a_200000210301_100011310491 [0,1,0,0,0,1|1,1,0]=4 3142 B14R2.142 CSc1ccc2nccc(c2c1)N 62a_100011620571_200000210301 [0,1,0,0,0,1|1,1,0]=4 3143 B14R2.142 CSc1ccc2nccc(c2c1)N 62a_200000210301_100011620571 [0,1,0,0,0,1|1,1,0]=4 3144 B14R2.142 CSc1ccc2ncnc(c2c1)C 62a_100000700471_200000210301 [0,1,0,0,0,1|0,1,1]=4 3145 B14R2.142 CSc1ccc2ncnc(c2c1)C 62a_200000210301_100000700471 [0,1,0,0,0,1|0,1,1]=4 3146 B14R2.142 CSc1ccc2ncnc(c2c1)Cl 62a_200000210301_100000757566 [0,1,0,0,0,1|0,1,1]=4 3147 B14R2.142 CSc1ccc2ncnc(c2c1)N 62a_100011390335_200000210301 [0,1,0,0,0,1|0,1,1]=4 3148 B14R2.142 CSc1ccc2ncnc(c2c1)N 62a_200000210301_100011390335 [0,1,0,0,0,1|0,1,1]=4 3149 B14R2.142 CSc1ccc2nncc(c2c1)O 62a_200000210301_100010074700 [0,1,0,0,0,1|1,1,0]=4 3150 B14R2.142 CSc1cnc2nc[nH]c(=O)c2c1 62a_100010182796_200000210301 [0,1,0,0,0,1|1,1,0]=4 3151 B14R2.142 CSc1cnc2nc[nH]c(=O)c2c1 62a_200000210301_100010182796 [0,1,0,0,0,1|1,1,0]=4 3152 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 34a_200000091600_200025704644 [0,1,0,0,0,1|2,0,0]=4 3153 B14R2.142 Cc1cccc2c1cc(cc2)O[13CH3] 7a_200000091600_200025704644 [0,1,0,0,0,1|2,0,0]=4 3154 B14R2.142 Cc1ccnc2c1cc(cc2)S[13CH3] 62a_100009817033_200025704644 [0,1,0,0,0,1|1,1,0]=4 3155 B14R2.142 Cc1ccnc2c1cc(cc2)S[13CH3] 62a_200025704644_100009817033 [0,1,0,0,0,1|1,1,0]=4 3156 B14R2.142 Cc1ncnc2c1cc(cc2)S[13CH3] 62a_100000700471_200025704644 [0,1,0,0,0,1|0,1,1]=4 3157 B14R2.142 Cc1ncnc2c1cc(cc2)S[13CH3] 62a_200025704644_100000700471 [0,1,0,0,0,1|0,1,1]=4 3158 B14R2.142 [13CH3]Nc1ccc2nccc(c2c1)Br 34a_100010074812_200025704644 [0,1,0,0,0,1|2,0,0]=4 3159 B14R2.142 [13CH3]Nc1ccc2nccc(c2c1)Cl 34a_100009879071_200025704644 [0,1,0,0,0,1|2,0,0]=4 3160 B14R2.142 [13CH3]Oc1ccc2c(c1)C(=O)NCC2 34a_100000081307_200025704644 [0,1,0,0,0,1|1,0,1]=4 3161 B14R2.142 [13CH3]Oc1ccc2c(c1)C(=O)NCC2 7a_100000081307_200025704644 [0,1,0,0,0,1|1,0,1]=4 3162 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 34a_100010169565_200025704644 [0,1,0,0,0,1|2,0,0]=4 3163 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)Br 7a_100010169565_200025704644 [0,1,0,0,0,1|2,0,0]=4 3164 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 34a_100000091619_200025704644 [0,1,0,0,0,1|2,0,0]=4 3165 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)F 7a_100000091619_200025704644 [0,1,0,0,0,1|2,0,0]=4 3166 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 34a_100000034012_200025704644 [0,1,0,0,0,1|2,0,0]=4 3167 B14R2.142 [13CH3]Oc1ccc2cccc(c2c1)N 7a_100000034012_200025704644 [0,1,0,0,0,1|2,0,0]=4 3168 B14R2.142 [13CH3]Oc1ccc2ccnc(c2c1)Cl 34a_200009844553_200025704644 [0,1,0,0,0,1|1,0,1]=4 3169 B14R2.142 [13CH3]Oc1ccc2ccnc(c2c1)Cl 7a_200009844553_200025704644 [0,1,0,0,0,1|1,0,1]=4 3170 B14R2.142 [13CH3]Oc1ccc2nc[nH]c(=O)c2c1 7a_100011934087_200025704644 [0,1,0,0,0,1|0,0,0]=2 3171 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Br 34a_100010204251_200025704644 [0,1,0,0,0,1|1,0,0]=3 3172 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Br 7a_100010204251_200025704644 [0,1,0,0,0,1|1,0,0]=3 3173 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Cl 34a_100000075933_200025704644 [0,1,0,0,0,1|1,0,0]=3 3174 B14R2.142 [13CH3]Oc1ccc2nccc(c2c1)Cl 7a_100000075933_200025704644 [0,1,0,0,0,1|1,0,0]=3 3175 B14R2.142 [13CH3]Sc1cc2c(=O)[nH]cnc2cn1 62a_200025704644_100000101234 [0,1,0,0,0,1|1,1,0]=4 3176 B14R2.142 [13CH3]Sc1ccc2cncc(c2c1)O 62a_200025704644_100010136424 [0,1,0,0,0,1|1,1,0]=4 3177 B14R2.142 [13CH3]Sc1ccc2nc[nH]c(=O)c2c1 62a_200025704644_100000755678 [0,1,0,0,0,1|0,1,0]=3 3178 B14R2.142 [13CH3]Sc1ccc2nc[nH]c(=O)c2n1 62a_200025704644_100000117605 [0,1,0,0,0,1|1,1,0]=4 3179 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)Cl 62a_100011310491_200025704644 [0,1,0,0,0,1|1,1,0]=4 3180 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)Cl 62a_200025704644_100011310491 [0,1,0,0,0,1|1,1,0]=4 3181 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)N 62a_100011620571_200025704644 [0,1,0,0,0,1|1,1,0]=4 3182 B14R2.142 [13CH3]Sc1ccc2nccc(c2c1)N 62a_200025704644_100011620571 [0,1,0,0,0,1|1,1,0]=4 3183 B14R2.142 [13CH3]Sc1ccc2ncnc(c2c1)Cl 62a_200025704644_100000757566 [0,1,0,0,0,1|0,1,1]=4 3184 B14R2.142 [13CH3]Sc1ccc2ncnc(c2c1)N 62a_100011390335_200025704644 [0,1,0,0,0,1|0,1,1]=4 3185 B14R2.142 [13CH3]Sc1ccc2ncnc(c2c1)N 62a_200025704644_100011390335 [0,1,0,0,0,1|0,1,1]=4 3186 B14R2.142 [13CH3]Sc1ccc2nncc(c2c1)O 62a_200025704644_100010074700 [0,1,0,0,0,1|1,1,0]=4 3187 B14R2.142 [13CH3]Sc1cnc2nc[nH]c(=O)c2c1 62a_100010182796_200025704644 [0,1,0,0,0,1|1,1,0]=4 3188 B14R2.142 [13CH3]Sc1cnc2nc[nH]c(=O)c2c1 62a_200025704644_100010182796 [0,1,0,0,0,1|1,1,0]=4 3189 B14R2.781 C=C(C)c1ccc2cnccc2c1 271570a_100000694244_100009816743 [0,1,0,0,0,1|2,0,0]=4 3190 B14R2.781 C=C(C)c1ccc2cncnc2c1 271570a_100000694244_100010185614 [0,1,0,0,0,1|1,0,1]=4 3191 B14R2.781 C=C(C)c1ccc2ncccc2c1 271570a_100000694244_100000754243 [0,1,0,0,0,1|2,0,0]=4 3192 B14R2.781 C=C(C)c1ccc2nccnc2c1 271570a_100000694244_100011219451 [0,1,0,0,0,1|1,0,1]=4 3193 B14R2.781 C=C(C)c1ccc2ncncc2c1 271570a_100000694244_100009989443 [0,1,0,0,0,1|1,0,1]=4 3194 B14R2.781 C=C(C)c1ccc2nnccc2c1 271570a_100000694244_100010209549 [0,1,0,0,0,1|2,0,0]=4 3195 B14R2.781 CC(=O)c1ccc2cnccc2c1 1458a_100011935275_200000210301 [0,1,0,0,0,1|2,0,0]=4 3196 B14R2.781 CC(=O)c1ccc2ncccc2c1 1458a_100011216044_200000210301 [0,1,0,0,0,1|2,0,0]=4 3197 B14R2.781 CC(=O)c1ccc2nccnc2c1 1458a_100000184533_200000210301 [0,1,0,0,0,1|1,0,1]=4 3198 B14R2.781 CN(C)c1ccc2cncnc2c1 27a_100102631434_100010185614 [0,1,0,0,0,1|1,0,1]=4 3199 B14R2.781 CN(C)c1ccc2nccnc2c1 27a_100102631434_100011219451 [0,1,0,0,0,1|1,0,1]=4 3200 B14R2.781 [13CH3]C(=O)c1ccc2cnccc2c1 1458a_100011935275_200025704644 [0,1,0,0,0,1|2,0,0]=4 3201 B14R2.781 [13CH3]C(=O)c1ccc2ncccc2c1 1458a_100011216044_200025704644 [0,1,0,0,0,1|2,0,0]=4 3202 B14R2.781 [13CH3]C(=O)c1ccc2nccnc2c1 1458a_100000184533_200025704644 [0,1,0,0,0,1|1,0,1]=4 3203 B14R2.1019 CNc1cc(c2cnccc2c1)F 27a_100102657272_100011068762 [0,1,0,0,0,1|2,0,0]=4 3204 B14R2.1019 CNc1cc(c2ncccc2c1)Cl 34a_200009830422_200000210301 [0,1,0,0,0,1|2,0,0]=4 3205 B14R2.1019 CNc1cc(c2nccnc2c1)C 27a_100102657272_100010080486 [0,1,0,0,0,1|1,0,1]=4 3206 B14R2.1019 CNc1cc(c2nccnc2c1)F 27a_100102657272_100010079260 [0,1,0,0,0,1|1,0,1]=4 3207 B14R2.1019 COc1cc(c2ccccc2c1)Br 34a_100010001680_200000210301 [0,1,0,0,0,1|2,0,0]=4 3208 B14R2.1019 COc1cc(c2ccccc2c1)Br 7a_100010001680_200000210301 [0,1,0,0,0,1|2,0,0]=4 3209 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [0,1,0,0,0,1|2,0,0]=4 3210 B14R2.1019 COc1cc(c2cccnc2c1)O 271570a_203496583355_100010248855 [0,1,0,0,0,1|1,0,1]=4 3211 B14R2.1019 COc1cc(c2cnccc2c1)Br 34a_100011009069_200000210301 [0,1,0,0,0,1|1,0,0]=3 3212 B14R2.1019 COc1cc(c2cnccc2c1)Br 7a_100011009069_200000210301 [0,1,0,0,0,1|1,0,0]=3 3213 B14R2.1019 COc1cc(c2ncccc2c1)Cl 34a_100000097192_200000210301 [0,1,0,0,0,1|1,0,0]=3 3214 B14R2.1019 COc1cc(c2ncccc2c1)Cl 7a_100000097192_200000210301 [0,1,0,0,0,1|1,0,0]=3 3215 B14R2.1019 COc1cc(c2ncccc2c1)F 34a_100009888031_200000210301 [0,1,0,0,0,1|1,0,0]=3 3216 B14R2.1019 COc1cc(c2ncccc2c1)F 7a_100009888031_200000210301 [0,1,0,0,0,1|1,0,0]=3 3217 B14R2.1019 COc1cc(c2ncccc2c1)N 34a_100000083691_200000210301 [0,1,0,0,0,1|1,0,0]=3 3218 B14R2.1019 COc1cc(c2ncccc2c1)O 271570a_203496583355_200010235761 [0,1,0,0,0,1|1,0,0]=3 3219 B14R2.1019 CSc1cc(c2cnccc2c1)F 62a_100011068762_200000210301 [0,1,0,0,0,1|1,1,0]=4 3220 B14R2.1019 CSc1cc(c2cnccc2c1)F 62a_200000210301_100011068762 [0,1,0,0,0,1|1,1,0]=4 3221 B14R2.1019 CSc1cc(c2ncccc2c1)C 62a_200000210301_100010130319 [0,1,0,0,0,1|1,1,0]=4 3222 B14R2.1019 CSc1cc(c2ncccc2c1)Cl 62a_200000210301_200010369337 [0,1,0,0,0,1|1,1,0]=4 3223 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_100010234705_200000210301 [0,1,0,0,0,1|1,1,0]=4 3224 B14R2.1019 CSc1cc(c2ncccc2c1)F 62a_200000210301_100010234705 [0,1,0,0,0,1|1,1,0]=4 3225 B14R2.1019 CSc1cc(c2ncccc2c1)N 62a_200000210301_100009814519 [0,1,0,0,0,1|1,1,0]=4 3226 B14R2.1019 CSc1cc(c2ncccc2c1)O 62a_200000210301_100010248853 [0,1,0,0,0,1|1,1,0]=4 3227 B14R2.1019 CSc1cc(c2nccnc2c1)C 62a_200000210301_100010080486 [0,1,0,0,0,1|0,1,1]=4 3228 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_100010079260_200000210301 [0,1,0,0,0,1|0,1,1]=4 3229 B14R2.1019 CSc1cc(c2nccnc2c1)F 62a_200000210301_100010079260 [0,1,0,0,0,1|0,1,1]=4 3230 B14R2.1019 Cc1cc(cc2c1nccc2)S[13CH3] 62a_200025704644_100010130319 [0,1,0,0,0,1|1,1,0]=4 3231 B14R2.1019 Cc1cc(cc2c1nccn2)S[13CH3] 62a_200025704644_100010080486 [0,1,0,0,0,1|0,1,1]=4 3232 B14R2.1019 [13CH3]Nc1cc(c2ncccc2c1)Cl 34a_200009830422_200025704644 [0,1,0,0,0,1|2,0,0]=4 3233 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 34a_100010001680_200025704644 [0,1,0,0,0,1|2,0,0]=4 3234 B14R2.1019 [13CH3]Oc1cc(c2ccccc2c1)Br 7a_100010001680_200025704644 [0,1,0,0,0,1|2,0,0]=4 3235 B14R2.1019 [13CH3]Oc1cc(c2cnccc2c1)Br 34a_100011009069_200025704644 [0,1,0,0,0,1|1,0,0]=3 3236 B14R2.1019 [13CH3]Oc1cc(c2cnccc2c1)Br 7a_100011009069_200025704644 [0,1,0,0,0,1|1,0,0]=3 3237 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 34a_100000097192_200025704644 [0,1,0,0,0,1|1,0,0]=3 3238 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)Cl 7a_100000097192_200025704644 [0,1,0,0,0,1|1,0,0]=3 3239 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 34a_100009888031_200025704644 [0,1,0,0,0,1|1,0,0]=3 3240 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)F 7a_100009888031_200025704644 [0,1,0,0,0,1|1,0,0]=3 3241 B14R2.1019 [13CH3]Oc1cc(c2ncccc2c1)N 34a_100000083691_200025704644 [0,1,0,0,0,1|1,0,0]=3 3242 B14R2.1019 [13CH3]Sc1cc(c2cnccc2c1)F 62a_100011068762_200025704644 [0,1,0,0,0,1|1,1,0]=4 3243 B14R2.1019 [13CH3]Sc1cc(c2cnccc2c1)F 62a_200025704644_100011068762 [0,1,0,0,0,1|1,1,0]=4 3244 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)Cl 62a_200025704644_200010369337 [0,1,0,0,0,1|1,1,0]=4 3245 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_100010234705_200025704644 [0,1,0,0,0,1|1,1,0]=4 3246 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)F 62a_200025704644_100010234705 [0,1,0,0,0,1|1,1,0]=4 3247 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)N 62a_200025704644_100009814519 [0,1,0,0,0,1|1,1,0]=4 3248 B14R2.1019 [13CH3]Sc1cc(c2ncccc2c1)O 62a_200025704644_100010248853 [0,1,0,0,0,1|1,1,0]=4 3249 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_100010079260_200025704644 [0,1,0,0,0,1|0,1,1]=4 3250 B14R2.1019 [13CH3]Sc1cc(c2nccnc2c1)F 62a_200025704644_100010079260 [0,1,0,0,0,1|0,1,1]=4 3251 B14R2.1128 CNc1cc2nccnc2cc1C 27a_100102657272_100010080479 [0,1,0,0,0,1|1,0,1]=4 3252 B14R2.1128 CNc1cc2nccnc2cc1F 27a_100102657272_100010080477 [0,1,0,0,0,1|1,0,1]=4 3253 B14R2.1128 COc1cc2ccccc2cc1Br 34a_100009817189_200000210301 [0,1,0,0,0,1|2,0,0]=4 3254 B14R2.1128 COc1cc2ccccc2cc1Br 7a_100009817189_200000210301 [0,1,0,0,0,1|2,0,0]=4 3255 B14R2.1128 COc1cc2ccccc2cc1C 34a_100000091601_200000210301 [0,1,0,0,0,1|2,0,0]=4 3256 B14R2.1128 COc1cc2ccccc2cc1C 7a_100000091601_200000210301 [0,1,0,0,0,1|2,0,0]=4 3257 B14R2.1128 COc1cc2ccccc2cc1N 34a_106744474703_200000210301 [0,1,0,0,0,1|2,0,0]=4 3258 B14R2.1128 COc1cc2ccccc2cc1N 7a_106744474703_200000210301 [0,1,0,0,0,1|2,0,0]=4 3259 B14R2.1128 COc1cc2ccccc2cc1O 271570a_203496583355_100009817100 [0,1,0,0,0,1|2,0,0]=4 3260 B14R2.1128 COc1cc2cccnc2cc1Br 34a_200010153759_200000210301 [0,1,0,0,0,1|1,0,0]=3 3261 B14R2.1128 COc1cc2cccnc2cc1Br 7a_200010153759_200000210301 [0,1,0,0,0,1|1,0,0]=3 3262 B14R2.1128 COc1cc2cccnc2cc1O 271570a_203496583355_100011093944 [0,1,0,0,0,1|1,0,0]=3 3263 B14R2.1128 COc1cc2ccncc2cc1O 271570a_203496583355_100010990640 [0,1,0,0,0,1|1,0,0]=3 3264 B14R2.1128 COc1cc2ncccc2cc1O 271570a_203496583355_100020706834 [0,1,0,0,0,1|1,0,1]=4 3265 B14R2.1128 CSc1cc2cccnc2cc1C 62a_100010137429_200000210301 [0,1,0,0,0,1|1,1,0]=4 3266 B14R2.1128 CSc1cc2cccnc2cc1C 62a_200000210301_100010137429 [0,1,0,0,0,1|1,1,0]=4 3267 B14R2.1128 CSc1cc2cccnc2cc1F 62a_100009854028_200000210301 [0,1,0,0,0,1|1,1,0]=4 3268 B14R2.1128 CSc1cc2cccnc2cc1F 62a_200000210301_100009854028 [0,1,0,0,0,1|1,1,0]=4 3269 B14R2.1128 CSc1cc2ccncc2cc1F 62a_100011105921_200000210301 [0,1,0,0,0,1|1,1,0]=4 3270 B14R2.1128 CSc1cc2ccncc2cc1F 62a_200000210301_100011105921 [0,1,0,0,0,1|1,1,0]=4 3271 B14R2.1128 CSc1cc2nccnc2cc1C 62a_100010080479_200000210301 [0,1,0,0,0,1|0,1,1]=4 3272 B14R2.1128 CSc1cc2nccnc2cc1C 62a_200000210301_100010080479 [0,1,0,0,0,1|0,1,1]=4 3273 B14R2.1128 CSc1cc2nccnc2cc1F 62a_100010080477_200000210301 [0,1,0,0,0,1|0,1,1]=4 3274 B14R2.1128 CSc1cc2nccnc2cc1F 62a_200000210301_100010080477 [0,1,0,0,0,1|0,1,1]=4 3275 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 34a_100000091601_200025704644 [0,1,0,0,0,1|2,0,0]=4 3276 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 7a_100000091601_200025704644 [0,1,0,0,0,1|2,0,0]=4 3277 B14R2.1128 Cc1cc2ncccc2cc1S[13CH3] 62a_100010137429_200025704644 [0,1,0,0,0,1|1,1,0]=4 3278 B14R2.1128 Cc1cc2ncccc2cc1S[13CH3] 62a_200025704644_100010137429 [0,1,0,0,0,1|1,1,0]=4 3279 B14R2.1128 Cc1cc2nccnc2cc1S[13CH3] 62a_100010080479_200025704644 [0,1,0,0,0,1|0,1,1]=4 3280 B14R2.1128 Cc1cc2nccnc2cc1S[13CH3] 62a_200025704644_100010080479 [0,1,0,0,0,1|0,1,1]=4 3281 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 34a_100009817189_200025704644 [0,1,0,0,0,1|2,0,0]=4 3282 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 7a_100009817189_200025704644 [0,1,0,0,0,1|2,0,0]=4 3283 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 34a_106744474703_200025704644 [0,1,0,0,0,1|2,0,0]=4 3284 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 7a_106744474703_200025704644 [0,1,0,0,0,1|2,0,0]=4 3285 B14R2.1128 [13CH3]Oc1cc2cccnc2cc1Br 34a_200010153759_200025704644 [0,1,0,0,0,1|1,0,0]=3 3286 B14R2.1128 [13CH3]Oc1cc2cccnc2cc1Br 7a_200010153759_200025704644 [0,1,0,0,0,1|1,0,0]=3 3287 B14R2.1128 [13CH3]Sc1cc2cccnc2cc1F 62a_100009854028_200025704644 [0,1,0,0,0,1|1,1,0]=4 3288 B14R2.1128 [13CH3]Sc1cc2cccnc2cc1F 62a_200025704644_100009854028 [0,1,0,0,0,1|1,1,0]=4 3289 B14R2.1128 [13CH3]Sc1cc2ccncc2cc1F 62a_100011105921_200025704644 [0,1,0,0,0,1|1,1,0]=4 3290 B14R2.1128 [13CH3]Sc1cc2ccncc2cc1F 62a_200025704644_100011105921 [0,1,0,0,0,1|1,1,0]=4 3291 B14R2.1128 [13CH3]Sc1cc2nccnc2cc1F 62a_100010080477_200025704644 [0,1,0,0,0,1|0,1,1]=4 3292 B14R2.1128 [13CH3]Sc1cc2nccnc2cc1F 62a_200025704644_100010080477 [0,1,0,0,0,1|0,1,1]=4 3293 B14R2.1801 CNc1ccc2c(ncnc2c1)N 27a_100102657272_100010199758 [0,1,0,0,0,1|1,0,1]=4 3294 B14R2.1801 COc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200000210301 [0,1,0,0,0,1|1,0,1]=4 3295 B14R2.1801 COc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200000210301 [0,1,0,0,0,1|1,0,1]=4 3296 B14R2.1801 COc1ccc2c(=O)ccoc2c1 34a_200000065989_200000210301 [0,1,0,0,0,1|2,0,0]=4 3297 B14R2.1801 COc1ccc2c(=O)ccoc2c1 7a_200000065989_200000210301 [0,1,0,0,0,1|2,0,0]=4 3298 B14R2.1801 COc1ccc2c(cccc2c1)N 34a_100000034668_200000210301 [0,1,0,0,0,1|2,0,0]=4 3299 B14R2.1801 COc1ccc2c(cccc2c1)N 7a_100000034668_200000210301 [0,1,0,0,0,1|2,0,0]=4 3300 B14R2.1801 COc1ccc2c(cccc2c1)O 271570a_203496583355_100010151670 [0,1,0,0,0,1|2,0,0]=4 3301 B14R2.1801 COc1ccc2c(ccnc2c1)Br 34a_100010204257_200000210301 [0,1,0,0,0,1|1,0,1]=4 3302 B14R2.1801 COc1ccc2c(ccnc2c1)Br 7a_100010204257_200000210301 [0,1,0,0,0,1|1,0,1]=4 3303 B14R2.1801 COc1ccc2c(ccnc2c1)C 34a_200009854145_200000210301 [0,1,0,0,0,1|1,0,1]=4 3304 B14R2.1801 COc1ccc2c(ccnc2c1)C 7a_200009854145_200000210301 [0,1,0,0,0,1|1,0,1]=4 3305 B14R2.1801 COc1ccc2c(ccnc2c1)Cl 34a_100000045489_200000210301 [0,1,0,0,0,1|1,0,1]=4 3306 B14R2.1801 COc1ccc2c(ccnc2c1)Cl 7a_100000045489_200000210301 [0,1,0,0,0,1|1,0,1]=4 3307 B14R2.1801 COc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045488 [0,1,0,0,0,1|1,0,1]=4 3308 B14R2.1801 COc1ccc2c(nccc2c1)Cl 34a_100009867704_200000210301 [0,1,0,0,0,1|1,0,0]=3 3309 B14R2.1801 COc1ccc2c(nccc2c1)Cl 7a_100009867704_200000210301 [0,1,0,0,0,1|1,0,0]=3 3310 B14R2.1801 COc1ccc2c(nccc2c1)O 271570a_203496583355_100000084302 [0,1,0,0,0,1|1,0,0]=3 3311 B14R2.1801 COc1ccc2c(ncnc2c1)O 271570a_203496583355_100011248138 [0,1,0,0,0,1|0,0,1]=3 3312 B14R2.1801 CSc1ccc2c(nccc2c1)N 62a_100000732483_200000210301 [0,1,0,0,0,1|1,1,0]=4 3313 B14R2.1801 CSc1ccc2c(nccc2c1)N 62a_200000210301_100000732483 [0,1,0,0,0,1|1,1,0]=4 3314 B14R2.1801 CSc1ccc2c(nccc2c1)O 62a_200000210301_100000760485 [0,1,0,0,0,1|1,1,0]=4 3315 B14R2.1801 CSc1ccc2c(ncnc2c1)N 62a_100010199758_200000210301 [0,1,0,0,0,1|0,1,1]=4 3316 B14R2.1801 CSc1ccc2c(ncnc2c1)N 62a_200000210301_100010199758 [0,1,0,0,0,1|0,1,1]=4 3317 B14R2.1801 Cc1ccnc2c1ccc(c2)O[13CH3] 34a_200009854145_200025704644 [0,1,0,0,0,1|1,0,1]=4 3318 B14R2.1801 Cc1ccnc2c1ccc(c2)O[13CH3] 7a_200009854145_200025704644 [0,1,0,0,0,1|1,0,1]=4 3319 B14R2.1801 [13CH3]Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200025704644 [0,1,0,0,0,1|1,0,1]=4 3320 B14R2.1801 [13CH3]Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200025704644 [0,1,0,0,0,1|1,0,1]=4 3321 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 34a_200000065989_200025704644 [0,1,0,0,0,1|2,0,0]=4 3322 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 7a_200000065989_200025704644 [0,1,0,0,0,1|2,0,0]=4 3323 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 34a_100000034668_200025704644 [0,1,0,0,0,1|2,0,0]=4 3324 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 7a_100000034668_200025704644 [0,1,0,0,0,1|2,0,0]=4 3325 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Br 34a_100010204257_200025704644 [0,1,0,0,0,1|1,0,1]=4 3326 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Br 7a_100010204257_200025704644 [0,1,0,0,0,1|1,0,1]=4 3327 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Cl 34a_100000045489_200025704644 [0,1,0,0,0,1|1,0,1]=4 3328 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Cl 7a_100000045489_200025704644 [0,1,0,0,0,1|1,0,1]=4 3329 B14R2.1801 [13CH3]Oc1ccc2c(nccc2c1)Cl 34a_100009867704_200025704644 [0,1,0,0,0,1|1,0,0]=3 3330 B14R2.1801 [13CH3]Oc1ccc2c(nccc2c1)Cl 7a_100009867704_200025704644 [0,1,0,0,0,1|1,0,0]=3 3331 B14R2.1801 [13CH3]Sc1ccc2c(nccc2c1)N 62a_100000732483_200025704644 [0,1,0,0,0,1|1,1,0]=4 3332 B14R2.1801 [13CH3]Sc1ccc2c(nccc2c1)N 62a_200025704644_100000732483 [0,1,0,0,0,1|1,1,0]=4 3333 B14R2.1801 [13CH3]Sc1ccc2c(nccc2c1)O 62a_200025704644_100000760485 [0,1,0,0,0,1|1,1,0]=4 3334 B14R2.1801 [13CH3]Sc1ccc2c(ncnc2c1)N 62a_100010199758_200025704644 [0,1,0,0,0,1|0,1,1]=4 3335 B14R2.1801 [13CH3]Sc1ccc2c(ncnc2c1)N 62a_200025704644_100010199758 [0,1,0,0,0,1|0,1,1]=4 3336 B14R2.2332 CNc1ccc2nc(ccc2c1)C 34a_100011216442_200000210301 [0,1,0,0,0,1|2,0,0]=4 3337 B14R2.2332 CNc1ccc2nc(cnc2c1)Cl 34a_100009885871_200000210301 [0,1,0,0,0,1|1,0,1]=4 3338 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200000210301 [0,1,0,0,0,1|2,0,0]=4 3339 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200000210301 [0,1,0,0,0,1|2,0,0]=4 3340 B14R2.2332 COc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200000210301 [0,1,0,0,0,1|1,0,1]=4 3341 B14R2.2332 COc1ccc2cc(ccc2c1)Br 34a_100000185455_200000210301 [0,1,0,0,0,1|2,0,0]=4 3342 B14R2.2332 COc1ccc2cc(ccc2c1)Br 7a_100000185455_200000210301 [0,1,0,0,0,1|2,0,0]=4 3343 B14R2.2332 COc1ccc2cc(ccc2c1)C 34a_100000074090_200000210301 [0,1,0,0,0,1|2,0,0]=4 3344 B14R2.2332 COc1ccc2cc(ccc2c1)C 7a_100000074090_200000210301 [0,1,0,0,0,1|2,0,0]=4 3345 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 34a_100000074905_200000210301 [0,1,0,0,0,1|2,0,0]=4 3346 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 7a_100000074905_200000210301 [0,1,0,0,0,1|2,0,0]=4 3347 B14R2.2332 COc1ccc2cc(ccc2c1)F 34a_100009847029_200000210301 [0,1,0,0,0,1|2,0,0]=4 3348 B14R2.2332 COc1ccc2cc(ccc2c1)F 7a_100009847029_200000210301 [0,1,0,0,0,1|2,0,0]=4 3349 B14R2.2332 COc1ccc2cc(ccc2c1)O 271570a_203496583355_100000170439 [0,1,0,0,0,1|2,0,0]=4 3350 B14R2.2332 COc1ccc2cc(cnc2c1)Br 34a_200010153753_200000210301 [0,1,0,0,0,1|1,0,1]=4 3351 B14R2.2332 COc1ccc2cc(cnc2c1)Br 7a_200010153753_200000210301 [0,1,0,0,0,1|1,0,1]=4 3352 B14R2.2332 COc1ccc2nc(ccc2c1)C 34a_100000037634_200000210301 [0,1,0,0,0,1|1,0,0]=3 3353 B14R2.2332 COc1ccc2nc(ccc2c1)C 7a_100000037634_200000210301 [0,1,0,0,0,1|1,0,0]=3 3354 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 34a_100009849208_200000210301 [0,1,0,0,0,1|1,0,0]=3 3355 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 7a_100009849208_200000210301 [0,1,0,0,0,1|1,0,0]=3 3356 B14R2.2332 COc1ccc2nc(ccc2c1)O 271570a_203496583355_100000743015 [0,1,0,0,0,1|1,0,0]=3 3357 B14R2.2332 COc1ccc2nc(cnc2c1)Cl 34a_200010664160_200000210301 [0,1,0,0,0,1|0,0,1]=3 3358 B14R2.2332 COc1ccc2nc(cnc2c1)O 271570a_203496583355_100009843035 [0,1,0,0,0,1|0,0,1]=3 3359 B14R2.2332 COc1ccc2oc(=O)ccc2c1 34a_100000066265_200000210301 [0,1,0,0,0,1|2,0,0]=4 3360 B14R2.2332 COc1ccc2oc(=O)ccc2c1 7a_100000066265_200000210301 [0,1,0,0,0,1|2,0,0]=4 3361 B14R2.2332 CSc1ccc2c(c1)CNC(=O)C2 62a_100010174877_200000210301 [0,1,0,0,0,1|1,1,0]=4 3362 B14R2.2332 CSc1ccc2c(c1)CNC(=O)N2 62a_200000210301_100010171468 [0,1,0,0,0,1|0,1,1]=4 3363 B14R2.2332 CSc1ccc2c(c1)NCC(=O)N2 62a_200000210301_100000693460 [0,1,0,0,0,1|0,1,1]=4 3364 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_100000686635_200000210301 [0,1,0,0,0,1|1,1,0]=4 3365 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_200000210301_100000686635 [0,1,0,0,0,1|1,1,0]=4 3366 B14R2.2332 CSc1ccc2nc(ccc2c1)Cl 62a_200000210301_200012034268 [0,1,0,0,0,1|1,1,0]=4 3367 B14R2.2332 CSc1ccc2nc(ccc2c1)N 62a_100011934619_200000210301 [0,1,0,0,0,1|1,1,0]=4 3368 B14R2.2332 CSc1ccc2nc(ncc2c1)N 62a_100010138702_200000210301 [0,1,0,0,0,1|0,1,1]=4 3369 B14R2.2332 CSc1ccc2nc(ncc2c1)N 62a_200000210301_100010138702 [0,1,0,0,0,1|0,1,1]=4 3370 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 34a_100000074090_200025704644 [0,1,0,0,0,1|2,0,0]=4 3371 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 7a_100000074090_200025704644 [0,1,0,0,0,1|2,0,0]=4 3372 B14R2.2332 Cc1ccc2cc(ccc2n1)N[13CH3] 34a_100011216442_200025704644 [0,1,0,0,0,1|2,0,0]=4 3373 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 34a_100000037634_200025704644 [0,1,0,0,0,1|1,0,0]=3 3374 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 7a_100000037634_200025704644 [0,1,0,0,0,1|1,0,0]=3 3375 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_100000686635_200025704644 [0,1,0,0,0,1|1,1,0]=4 3376 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_200025704644_100000686635 [0,1,0,0,0,1|1,1,0]=4 3377 B14R2.2332 [13CH3]Nc1ccc2nc(cnc2c1)Cl 34a_100009885871_200025704644 [0,1,0,0,0,1|1,0,1]=4 3378 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200025704644 [0,1,0,0,0,1|2,0,0]=4 3379 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200025704644 [0,1,0,0,0,1|2,0,0]=4 3380 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200025704644 [0,1,0,0,0,1|1,0,1]=4 3381 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 34a_100000185455_200025704644 [0,1,0,0,0,1|2,0,0]=4 3382 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 7a_100000185455_200025704644 [0,1,0,0,0,1|2,0,0]=4 3383 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 34a_100000074905_200025704644 [0,1,0,0,0,1|2,0,0]=4 3384 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 7a_100000074905_200025704644 [0,1,0,0,0,1|2,0,0]=4 3385 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 34a_100009847029_200025704644 [0,1,0,0,0,1|2,0,0]=4 3386 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 7a_100009847029_200025704644 [0,1,0,0,0,1|2,0,0]=4 3387 B14R2.2332 [13CH3]Oc1ccc2cc(cnc2c1)Br 34a_200010153753_200025704644 [0,1,0,0,0,1|1,0,1]=4 3388 B14R2.2332 [13CH3]Oc1ccc2cc(cnc2c1)Br 7a_200010153753_200025704644 [0,1,0,0,0,1|1,0,1]=4 3389 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 34a_100009849208_200025704644 [0,1,0,0,0,1|1,0,0]=3 3390 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 7a_100009849208_200025704644 [0,1,0,0,0,1|1,0,0]=3 3391 B14R2.2332 [13CH3]Oc1ccc2nc(cnc2c1)Cl 34a_200010664160_200025704644 [0,1,0,0,0,1|0,0,1]=3 3392 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 34a_100000066265_200025704644 [0,1,0,0,0,1|2,0,0]=4 3393 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 7a_100000066265_200025704644 [0,1,0,0,0,1|2,0,0]=4 3394 B14R2.2332 [13CH3]Sc1ccc2c(c1)CNC(=O)C2 62a_100010174877_200025704644 [0,1,0,0,0,1|1,1,0]=4 3395 B14R2.2332 [13CH3]Sc1ccc2c(c1)CNC(=O)N2 62a_200025704644_100010171468 [0,1,0,0,0,1|0,1,1]=4 3396 B14R2.2332 [13CH3]Sc1ccc2c(c1)NCC(=O)N2 62a_200025704644_100000693460 [0,1,0,0,0,1|0,1,1]=4 3397 B14R2.2332 [13CH3]Sc1ccc2nc(ccc2c1)Cl 62a_200025704644_200012034268 [0,1,0,0,0,1|1,1,0]=4 3398 B14R2.2332 [13CH3]Sc1ccc2nc(ccc2c1)N 62a_100011934619_200025704644 [0,1,0,0,0,1|1,1,0]=4 3399 B14R2.2332 [13CH3]Sc1ccc2nc(ncc2c1)N 62a_100010138702_200025704644 [0,1,0,0,0,1|0,1,1]=4 3400 B14R2.2332 [13CH3]Sc1ccc2nc(ncc2c1)N 62a_200025704644_100010138702 [0,1,0,0,0,1|0,1,1]=4 3401 B14R2.808 CC=Cc1ccc2cc[nH]c2c1C 271570a_100016259895_100009816929 [0,2,0,0,0,0|2,0,0]=4 3402 B14R2.808 CC=Cc1ccc2ncsc2c1N 271570a_100016259895_100010998030 [0,2,0,0,0,0|2,0,0]=4 3403 B14R2.808 CC=Cc1cnc2nc[nH]c2c1C 271570a_100016259895_100010140963 [0,2,0,0,0,0|2,0,0]=4 3404 B14R2.808 CCSc1ccc2cc[nH]c2c1C 62a_100000210202_100009816929 [0,2,0,0,0,0|1,1,0]=4 3405 B14R2.808 CCSc1ccc2ncsc2c1N 62a_100010998030_100000210202 [0,2,0,0,0,0|1,1,0]=4 3406 B14R2.808 CCSc1cnc2nc[nH]c2c1C 62a_100000210202_100010140963 [0,2,0,0,0,0|1,1,0]=4 3407 B14R2.808 Cc1c(ccc2c1[nH]cc2)SCF 62a_100015361967_100009816929 [0,2,0,0,0,0|1,1,0]=4 3408 B14R2.808 Cc1c(cnc2c1[nH]cn2)SCF 62a_100015361967_100010140963 [0,2,0,0,0,0|1,1,0]=4 3409 B14R2.808 Nc1c(ccc2c1scn2)SCF 62a_100010998030_100015361967 [0,2,0,0,0,0|1,1,0]=4 3410 B14R2.1238 C=Cc1c(ccc2c1cc[nH]2)OC 271570a_100011290941_100010169049 [0,2,0,0,0,0|1,0,1]=4 3411 B14R2.1238 C=Cc1c(ncc2c1[nH]cc2)OC 271570a_100011290941_100010168355 [0,2,0,0,0,0|2,0,0]=4 3412 B14R2.1238 COc1ccc2[nH]ccc2c1SC 62a_200000210301_100010169049 [0,2,0,0,0,0|1,0,1]=4 3413 B14R2.1238 COc1ccc2[nH]ccc2c1S[13CH3] 62a_200025704644_100010169049 [0,2,0,0,0,0|1,0,1]=4 3414 B14R2.1238 COc1ncc2cc[nH]c2c1SC 62a_200000210301_100010168355 [0,2,0,0,0,0|2,0,0]=4 3415 B14R2.1238 COc1ncc2cc[nH]c2c1S[13CH3] 62a_200025704644_100010168355 [0,2,0,0,0,0|2,0,0]=4 3416 B14R2.2296 COc1cc(c2cn[nH]c2c1O)C 271570a_203496583355_100010289777 [0,2,0,0,0,0|2,0,0]=4 3417 B14R2.3302 COc1ccc2[nH]c(cc2c1F)C 34a_100000085321_200000210301 [0,2,0,0,0,0|1,0,1]=4 3418 B14R2.3302 COc1ccc2[nH]c(cc2c1F)C 7a_100000085321_200000210301 [0,2,0,0,0,0|1,0,1]=4 3419 B14R2.3302 Cc1cc2c(c(ccc2[nH]1)O[13CH3])F 34a_100000085321_200025704644 [0,2,0,0,0,0|1,0,1]=4 3420 B14R2.3302 Cc1cc2c(c(ccc2[nH]1)O[13CH3])F 7a_100000085321_200025704644 [0,2,0,0,0,0|1,0,1]=4 3421 B14R2.5998 C=C(C)c1ccc2cc[nH]c2c1C 271570a_100000694244_100009816929 [0,2,0,0,0,0|2,0,0]=4 3422 B14R2.5998 C=C(C)c1ccc2ncsc2c1N 271570a_100000694244_100010998030 [0,2,0,0,0,0|2,0,0]=4 3423 B14R2.5998 C=C(C)c1cnc2nc[nH]c2c1C 271570a_100000694244_100010140963 [0,2,0,0,0,0|2,0,0]=4 3424 B14R2.5998 CC(=O)c1ccc2cc[nH]c2c1Br 1458a_100010717018_200000210301 [0,2,0,0,0,0|2,0,0]=4 3425 B14R2.5998 [13CH3]C(=O)c1ccc2cc[nH]c2c1Br 1458a_100010717018_200025704644 [0,2,0,0,0,0|2,0,0]=4 3426 B14R2.601 C=C(C)c1cc2[nH]c(nc2cn1)O 271570a_100000694244_100010516660 [0,2,0,0,0,0|2,0,0]=4 3427 B14R2.601 C=C(C)c1ccc2[nH]c(=O)[nH]c2c1 271570a_100000694244_100011221360 [0,2,0,0,0,0|1,0,1]=4 3428 B14R2.601 C=C(C)c1ccc2c(c1)NC(=O)C2 271570a_100000694244_100000760487 [0,2,0,0,0,0|2,0,0]=4 3429 B14R2.601 C=C(C)c1ccc2cc([nH]c2c1)C 271570a_100000694244_100010196937 [0,2,0,0,0,0|2,0,0]=4 3430 B14R2.601 C=C(C)c1ccc2nc([nH]c2n1)C 271570a_100000694244_100000079090 [0,2,0,0,0,0|2,0,0]=4 3431 B14R2.601 C=C(C)c1ccc2nc(oc2c1)C 271570a_100000694244_100010171164 [0,2,0,0,0,0|2,0,0]=4 3432 B14R2.601 C=C(C)c1ccc2nc(oc2c1)N 271570a_100000694244_100010000678 [0,2,0,0,0,0|2,0,0]=4 3433 B14R2.601 C=C(C)c1ccc2nc(sc2c1)C 271570a_100000694244_100009813144 [0,2,0,0,0,0|2,0,0]=4 3434 B14R2.601 C=C(C)c1ccc2nc(sc2c1)Cl 271570a_100000694244_100010163703 [0,2,0,0,0,0|2,0,0]=4 3435 B14R2.601 C=C(C)c1ccc2nc(sc2c1)N 271570a_100000694244_100102524914 [0,2,0,0,0,0|2,0,0]=4 3436 B14R2.601 C=C(C)c1ccc2oc(=O)[nH]c2c1 271570a_100000694244_100000764829 [0,2,0,0,0,0|2,0,0]=4 3437 B14R2.601 C=C(C)c1ccc2sc(=O)[nH]c2c1 271570a_100000694244_100000239354 [0,2,0,0,0,0|2,0,0]=4 3438 B14R2.601 C=C(C)c1cnc2nc([nH]c2c1)C 271570a_100000694244_100000758206 [0,2,0,0,0,0|2,0,0]=4 3439 B14R2.601 CC(=O)c1ccc2cc([nH]c2c1)C 1458a_100009852829_200000210301 [0,2,0,0,0,0|2,0,0]=4 3440 B14R2.601 CC(=O)c1ccc2nc(oc2c1)C 1458a_100000688415_200000210301 [0,2,0,0,0,0|2,0,0]=4 3441 B14R2.601 CC(=O)c1ccc2nc(sc2c1)Br 1458a_100009815783_200000210301 [0,2,0,0,0,0|2,0,0]=4 3442 B14R2.601 CC(=O)c1ccc2nc(sc2c1)C 1458a_100000695894_200000210301 [0,2,0,0,0,0|2,0,0]=4 3443 B14R2.601 CC(=O)c1ccc2nc(sc2c1)Cl 1458a_100000068991_200000210301 [0,2,0,0,0,0|2,0,0]=4 3444 B14R2.601 CC(=O)c1ccc2oc(=O)[nH]c2c1 1458a_100000724434_200000210301 [0,2,0,0,0,0|2,0,0]=4 3445 B14R2.601 CN(C)c1ccc2nc(sc2c1)Cl 27a_100102631434_100010163703 [0,2,0,0,0,0|2,0,0]=4 3446 B14R2.601 Cc1cc2ccc(cc2[nH]1)C(=O)[13CH3] 1458a_100009852829_200025704644 [0,2,0,0,0,0|2,0,0]=4 3447 B14R2.601 Cc1nc2ccc(cc2o1)C(=O)[13CH3] 1458a_100000688415_200025704644 [0,2,0,0,0,0|2,0,0]=4 3448 B14R2.601 Cc1nc2ccc(cc2s1)C(=O)[13CH3] 1458a_100000695894_200025704644 [0,2,0,0,0,0|2,0,0]=4 3449 B14R2.601 [13CH3]C(=O)c1ccc2nc(sc2c1)Br 1458a_100009815783_200025704644 [0,2,0,0,0,0|2,0,0]=4 3450 B14R2.601 [13CH3]C(=O)c1ccc2nc(sc2c1)Cl 1458a_100000068991_200025704644 [0,2,0,0,0,0|2,0,0]=4 3451 B14R2.601 [13CH3]C(=O)c1ccc2oc(=O)[nH]c2c1 1458a_100000724434_200025704644 [0,2,0,0,0,0|2,0,0]=4 3452 B14R2.624 C=C(C)c1cc2[nH]ccc2cc1Br 271570a_100000694244_100000703010 [0,2,0,0,0,0|2,0,0]=4 3453 B14R2.624 C=C(C)c1cc2[nH]ccc2cc1C 271570a_100000694244_100010199660 [0,2,0,0,0,0|2,0,0]=4 3454 B14R2.624 C=C(C)c1cc2[nH]ccc2cc1F 271570a_100000694244_100009817181 [0,2,0,0,0,0|2,0,0]=4 3455 B14R2.624 C=C(C)c1cc2[nH]cnc2cc1C 271570a_100000694244_200010107306 [0,2,0,0,0,0|1,0,0]=3 3456 B14R2.624 C=C(C)c1cc2[nH]nnc2cc1C 271570a_100000694244_100010721108 [0,2,0,0,0,0|2,0,0]=4 3457 B14R2.624 C=C(C)c1cc2[nH]nnc2cc1F 271570a_100000694244_100010075030 [0,2,0,0,0,0|2,0,0]=4 3458 B14R2.624 CC(=O)c1cc2[nH]ccc2cc1Cl 1458a_100009858578_200000210301 [0,2,0,0,0,0|2,0,0]=4 3459 B14R2.624 CC(=O)c1cc2[nH]cnc2cc1F 1458a_200000729458_200000210301 [0,2,0,0,0,0|1,0,0]=3 3460 B14R2.624 [13CH3]C(=O)c1cc2[nH]ccc2cc1Cl 1458a_100009858578_200025704644 [0,2,0,0,0,0|2,0,0]=4 3461 B14R2.624 [13CH3]C(=O)c1cc2[nH]cnc2cc1F 1458a_200000729458_200025704644 [0,2,0,0,0,0|1,0,0]=3 3462 B14R2.966 CCC(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_100000210202 [0,2,0,0,0,0|2,0,0]=4 3463 B14R2.966 CCC(=O)c1ccc2ncoc2c1 1458a_100000750374_100000210202 [0,2,0,0,0,0|2,0,0]=4 3464 B14R2.966 CCC(=O)c1ccc2ncsc2c1 1458a_100000183663_100000210202 [0,2,0,0,0,0|2,0,0]=4 3465 B14R2.966 CNC(=O)c1ccc2cc[nH]c2c1 11a_106832991635_100000739399 [0,2,0,0,0,0|2,0,0]=4 3466 B14R2.966 CNC(=O)c1ccc2cc[nH]c2c1 527a_100102657272_100000739399 [0,2,0,0,0,0|2,0,0]=4 3467 B14R2.966 CNC(=O)c1ccc2ncoc2c1 1626a_100102657272_100000750374 [0,2,0,0,0,0|2,0,0]=4 3468 B14R2.966 CNC(=O)c1ccc2ncsc2c1 11a_106832991635_100000183663 [0,2,0,0,0,0|2,0,0]=4 3469 B14R2.966 CNC(=O)c1ccc2ncsc2c1 1626a_100102657272_100000183663 [0,2,0,0,0,0|2,0,0]=4 3470 B14R2.966 CNC(=O)c1ccc2ncsc2c1 240690a_100102657272_100000183663 [0,2,0,0,0,0|2,0,0]=4 3471 B14R2.966 CNC(=O)c1ccc2ncsc2c1 527a_100102657272_100000183663 [0,2,0,0,0,0|2,0,0]=4 3472 B14R2.966 CNC(C)c1ccc2cc[nH]c2c1 269862a_106832991636_200000045062 [0,2,0,0,0,0|2,0,0]=4 3473 B14R2.966 O=C(CF)c1ccc2cc[nH]c2c1 1458a_100000739399_100015361967 [0,2,0,0,0,0|2,0,0]=4 3474 B14R2.966 O=C(CF)c1ccc2ncoc2c1 1458a_100000750374_100015361967 [0,2,0,0,0,0|2,0,0]=4 3475 B14R2.966 O=C(CF)c1ccc2ncsc2c1 1458a_100000183663_100015361967 [0,2,0,0,0,0|2,0,0]=4 3476 B14R2.5719 C=C(C)c1ccc2c(c[nH]c2c1)C 271570a_100000694244_100010209589 [0,2,0,0,0,0|2,0,0]=4 3477 B14R2.5719 CC(=O)c1ccc2c(c[nH]c2c1)Br 1458a_100010235667_200000210301 [0,2,0,0,0,0|2,0,0]=4 3478 B14R2.5719 [13CH3]C(=O)c1ccc2c(c[nH]c2c1)Br 1458a_100010235667_200025704644 [0,2,0,0,0,0|2,0,0]=4 3479 B14R2.8824 C=C(C)c1cc(c2cc[nH]c2c1)Br 271570a_100000694244_100009814775 [0,2,0,0,0,0|2,0,0]=4 3480 B14R2.8824 C=C(C)c1cc(c2cc[nH]c2c1)F 271570a_100000694244_100010186028 [0,2,0,0,0,0|2,0,0]=4 3481 B14R2.8824 C=C(C)c1cc(c2cc[nH]c2c1)N 271570a_100000694244_106744500199 [0,2,0,0,0,0|2,0,0]=4 3482 B14R2.8824 C=C(C)c1cc(c2nc[nH]c2c1)C 271570a_100000694244_100000239325 [0,2,0,0,0,0|1,0,0]=3 3483 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)Br 1458a_100102525212_200000210301 [0,2,0,0,0,0|2,0,0]=4 3484 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)C 1458a_200015282437_200000210301 [0,2,0,0,0,0|2,0,0]=4 3485 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)Cl 1458a_100000086644_200000210301 [0,2,0,0,0,0|2,0,0]=4 3486 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)F 1458a_100000086646_200000210301 [0,2,0,0,0,0|2,0,0]=4 3487 B14R2.8824 Cc1cc(cc2c1cc[nH]2)C(=O)[13CH3] 1458a_200015282437_200025704644 [0,2,0,0,0,0|2,0,0]=4 3488 B14R2.8824 [13CH3]C(=O)c1cc(c2cc[nH]c2c1)Br 1458a_100102525212_200025704644 [0,2,0,0,0,0|2,0,0]=4 3489 B14R2.8824 [13CH3]C(=O)c1cc(c2cc[nH]c2c1)Cl 1458a_100000086644_200025704644 [0,2,0,0,0,0|2,0,0]=4 3490 B14R2.8824 [13CH3]C(=O)c1cc(c2cc[nH]c2c1)F 1458a_100000086646_200025704644 [0,2,0,0,0,0|2,0,0]=4 3491 B14R2.24358 C=C(C)c1cc2c(cn1)ncn2C 271570a_100000694244_100009863791 [0,2,0,0,0,0|2,0,0]=4 3492 B14R2.24358 C=C(C)c1ccc2ccn(c2c1)C 271570a_100000694244_100011934912 [0,2,0,0,0,0|2,0,0]=4 3493 B14R2.24358 C=C(C)c1ccc2ncn(c2c1)C 271570a_100000694244_100000702186 [0,2,0,0,0,0|1,0,0]=3 3494 B14R2.24358 C=C(C)c1ccc2nnn(c2c1)C 271570a_100000694244_100010241234 [0,2,0,0,0,0|2,0,0]=4 3495 B14R2.24358 CC(=O)c1ccc2ccn(c2c1)C 1458a_100011912540_200000210301 [0,2,0,0,0,0|2,0,0]=4 3496 B14R2.24358 CC(=O)c1ccc2ncn(c2c1)C 1458a_100012001983_200000210301 [0,2,0,0,0,0|1,0,0]=3 3497 B14R2.24358 Cn1ccc2c1cc(cc2)C(=O)[13CH3] 1458a_100011912540_200025704644 [0,2,0,0,0,0|2,0,0]=4 3498 B14R2.24358 Cn1cnc2c1cc(cc2)C(=O)[13CH3] 1458a_100012001983_200025704644 [0,2,0,0,0,0|1,0,0]=3 3499 B14R2.475 C=C=Cc1ccc2ncn(c2c1)C 271570a_100015277604_100000702186 [0,2,0,0,0,0|1,0,1]=4 3500 B14R2.475 CC=Cc1cc2c(cn1)ncn2C 271570a_100016259895_100009863791 [0,2,0,0,0,0|2,0,0]=4 3501 B14R2.475 CC=Cc1ccc2ccn(c2c1)C 271570a_100016259895_100011934912 [0,2,0,0,0,0|2,0,0]=4 3502 B14R2.475 CC=Cc1ccc2ncn(c2c1)C 271570a_100016259895_100000702186 [0,2,0,0,0,0|1,0,0]=3 3503 B14R2.475 CC=Cc1ccc2nnn(c2c1)C 271570a_100016259895_100010241234 [0,2,0,0,0,0|2,0,0]=4 3504 B14R2.475 CCNc1ccc2ccn(c2c1)C 34a_100000712629_100000210202 [0,2,0,0,0,0|2,0,0]=4 3505 B14R2.475 CCNc1ccc2ncn(c2c1)C 34a_100015183096_100000210202 [0,2,0,0,0,0|1,0,0]=3 3506 B14R2.475 CCOc1ccc2[nH]cc(c2c1)C 34a_100000131216_100000210202 [0,2,0,0,0,0|1,0,1]=4 3507 B14R2.475 CCOc1ccc2cnn(c2c1)C 34a_100009862793_100000210202 [0,2,0,0,0,0|2,0,0]=4 3508 B14R2.475 CCSc1cc2c(cn1)ncn2C 62a_100000210202_100009863791 [0,2,0,0,0,0|1,1,0]=4 3509 B14R2.475 CCSc1ccc2ccn(c2c1)C 62a_100000210202_100011934912 [0,2,0,0,0,0|1,1,0]=4 3510 B14R2.475 CCSc1ccc2ncn(c2c1)C 62a_100000210202_100000702186 [0,2,0,0,0,0|0,1,0]=3 3511 B14R2.475 CCSc1ccc2nnn(c2c1)C 62a_100000210202_100010241234 [0,2,0,0,0,0|1,1,0]=4 3512 B14R2.475 CCSc1ccc2nnn(c2c1)C 62a_100010241234_100000210202 [0,2,0,0,0,0|1,1,0]=4 3513 B14R2.475 CNCc1ccc2ccn(c2c1)C 207a_100102657272_100011934850 [0,2,0,0,0,0|2,0,0]=4 3514 B14R2.475 CNCc1ccc2ccn(c2c1)C 2230a_100011934852_200000210301 [0,2,0,0,0,0|2,0,0]=4 3515 B14R2.475 CNCc1ccc2ccn(c2c1)C 270004a_106832991635_100011934850 [0,2,0,0,0,0|2,0,0]=4 3516 B14R2.475 CNCc1ccc2ccn(c2c1)C 34a_100011934852_200000210301 [0,2,0,0,0,0|2,0,0]=4 3517 B14R2.475 COCc1ccc2ccn(c2c1)C 34a_100011934851_200000210301 [0,2,0,0,0,0|1,0,0]=3 3518 B14R2.475 COCc1ccc2cnn(c2c1)C 34a_100000101604_200000210301 [0,2,0,0,0,0|2,0,0]=4 3519 B14R2.475 Cc1c[nH]c2c1cc(cc2)OCF 34a_100000131216_100015361967 [0,2,0,0,0,0|1,0,1]=4 3520 B14R2.475 Cn1ccc2c1cc(cc2)CN[13CH3] 2230a_100011934852_200025704644 [0,2,0,0,0,0|2,0,0]=4 3521 B14R2.475 Cn1ccc2c1cc(cc2)CN[13CH3] 34a_100011934852_200025704644 [0,2,0,0,0,0|2,0,0]=4 3522 B14R2.475 Cn1ccc2c1cc(cc2)CO[13CH3] 34a_100011934851_200025704644 [0,2,0,0,0,0|1,0,0]=3 3523 B14R2.475 Cn1ccc2c1cc(cc2)NCF 34a_100000712629_100015361967 [0,2,0,0,0,0|2,0,0]=4 3524 B14R2.475 Cn1ccc2c1cc(cc2)SCF 62a_100015361967_100011934912 [0,2,0,0,0,0|1,1,0]=4 3525 B14R2.475 Cn1cnc2c1cc(cc2)NCF 34a_100015183096_100015361967 [0,2,0,0,0,0|1,0,0]=3 3526 B14R2.475 Cn1cnc2c1cc(cc2)SCF 62a_100015361967_100000702186 [0,2,0,0,0,0|0,1,0]=3 3527 B14R2.475 Cn1cnc2c1cc(nc2)SCF 62a_100015361967_100009863791 [0,2,0,0,0,0|1,1,0]=4 3528 B14R2.475 Cn1ncc2c1cc(cc2)CO[13CH3] 34a_100000101604_200025704644 [0,2,0,0,0,0|2,0,0]=4 3529 B14R2.475 Cn1ncc2c1cc(cc2)OCF 34a_100009862793_100015361967 [0,2,0,0,0,0|2,0,0]=4 3530 B14R2.475 Cn1nnc2c1cc(cc2)SCF 62a_100010241234_100015361967 [0,2,0,0,0,0|1,1,0]=4 3531 B14R2.475 Cn1nnc2c1cc(cc2)SCF 62a_100015361967_100010241234 [0,2,0,0,0,0|1,1,0]=4 3532 B14R2.583 C=C=Cc1cc2[nH]cnc2cc1C 271570a_100015277604_200010107306 [0,2,0,0,0,0|1,0,1]=4 3533 B14R2.583 CC=Cc1cc2[nH]ccc2cc1Br 271570a_100016259895_100000703010 [0,2,0,0,0,0|2,0,0]=4 3534 B14R2.583 CC=Cc1cc2[nH]ccc2cc1C 271570a_100016259895_100010199660 [0,2,0,0,0,0|2,0,0]=4 3535 B14R2.583 CC=Cc1cc2[nH]ccc2cc1F 271570a_100016259895_100009817181 [0,2,0,0,0,0|2,0,0]=4 3536 B14R2.583 CC=Cc1cc2[nH]cnc2cc1C 271570a_100016259895_200010107306 [0,2,0,0,0,0|1,0,0]=3 3537 B14R2.583 CC=Cc1cc2[nH]nnc2cc1C 271570a_100016259895_100010721108 [0,2,0,0,0,0|2,0,0]=4 3538 B14R2.583 CC=Cc1cc2[nH]nnc2cc1F 271570a_100016259895_100010075030 [0,2,0,0,0,0|2,0,0]=4 3539 B14R2.583 CCSc1cc2[nH]ccc2cc1Br 62a_100000210202_100000703010 [0,2,0,0,0,0|1,1,0]=4 3540 B14R2.583 CCSc1cc2[nH]ccc2cc1Br 62a_100000703010_100000210202 [0,2,0,0,0,0|1,1,0]=4 3541 B14R2.583 CCSc1cc2[nH]ccc2cc1C 62a_100000210202_100010199660 [0,2,0,0,0,0|1,1,0]=4 3542 B14R2.583 CCSc1cc2[nH]ccc2cc1F 62a_100000210202_100009817181 [0,2,0,0,0,0|1,1,0]=4 3543 B14R2.583 CCSc1cc2[nH]ccc2cc1F 62a_100009817181_100000210202 [0,2,0,0,0,0|1,1,0]=4 3544 B14R2.583 CCSc1cc2[nH]cnc2cc1C 62a_100000210202_200010107306 [0,2,0,0,0,0|0,1,0]=3 3545 B14R2.583 CCSc1cc2[nH]nnc2cc1C 62a_100000210202_100010721108 [0,2,0,0,0,0|1,1,0]=4 3546 B14R2.583 CCSc1cc2[nH]nnc2cc1F 62a_100000210202_100010075030 [0,2,0,0,0,0|1,1,0]=4 3547 B14R2.583 CCSc1cc2[nH]nnc2cc1F 62a_100010075030_100000210202 [0,2,0,0,0,0|1,1,0]=4 3548 B14R2.583 Cc1cc2cc[nH]c2cc1SCF 62a_100015361967_100010199660 [0,2,0,0,0,0|1,1,0]=4 3549 B14R2.583 Cc1cc2nc[nH]c2cc1SCF 62a_100015361967_200010107306 [0,2,0,0,0,0|0,1,0]=3 3550 B14R2.583 Cc1cc2nn[nH]c2cc1SCF 62a_100015361967_100010721108 [0,2,0,0,0,0|1,1,0]=4 3551 B14R2.583 FCSc1cc2[nH]ccc2cc1Br 62a_100000703010_100015361967 [0,2,0,0,0,0|1,1,0]=4 3552 B14R2.583 FCSc1cc2[nH]ccc2cc1Br 62a_100015361967_100000703010 [0,2,0,0,0,0|1,1,0]=4 3553 B14R2.583 FCSc1cc2[nH]ccc2cc1F 62a_100009817181_100015361967 [0,2,0,0,0,0|1,1,0]=4 3554 B14R2.583 FCSc1cc2[nH]ccc2cc1F 62a_100015361967_100009817181 [0,2,0,0,0,0|1,1,0]=4 3555 B14R2.583 FCSc1cc2[nH]nnc2cc1F 62a_100010075030_100015361967 [0,2,0,0,0,0|1,1,0]=4 3556 B14R2.583 FCSc1cc2[nH]nnc2cc1F 62a_100015361967_100010075030 [0,2,0,0,0,0|1,1,0]=4 3557 B14R2.587 C=C=Cc1cc(c2nc[nH]c2c1)C 271570a_100015277604_100000239325 [0,2,0,0,0,0|1,0,1]=4 3558 B14R2.587 CC=Cc1cc(c2cc[nH]c2c1)Br 271570a_100016259895_100009814775 [0,2,0,0,0,0|2,0,0]=4 3559 B14R2.587 CC=Cc1cc(c2cc[nH]c2c1)F 271570a_100016259895_100010186028 [0,2,0,0,0,0|2,0,0]=4 3560 B14R2.587 CC=Cc1cc(c2cc[nH]c2c1)N 271570a_100016259895_106744500199 [0,2,0,0,0,0|2,0,0]=4 3561 B14R2.587 CC=Cc1cc(c2nc[nH]c2c1)C 271570a_100016259895_100000239325 [0,2,0,0,0,0|1,0,0]=3 3562 B14R2.587 CCNc1cc(c2cc[nH]c2c1)F 34a_100000085187_100000210202 [0,2,0,0,0,0|2,0,0]=4 3563 B14R2.587 CCOc1cc(c2ncsc2c1)C 34a_200009842467_100000210202 [0,2,0,0,0,0|1,0,0]=3 3564 B14R2.587 CCOc1cc(c2ncsc2c1)C 7a_200009842467_100000210202 [0,2,0,0,0,0|1,0,0]=3 3565 B14R2.587 CCOc1cc(c2occc2c1)Br 34a_200010248604_100000210202 [0,2,0,0,0,0|2,0,0]=4 3566 B14R2.587 CCOc1cc(c2occc2c1)Br 7a_200010248604_100000210202 [0,2,0,0,0,0|2,0,0]=4 3567 B14R2.587 CCSc1cc(c2cc[nH]c2c1)Br 62a_100000210202_100009814775 [0,2,0,0,0,0|1,1,0]=4 3568 B14R2.587 CCSc1cc(c2cc[nH]c2c1)Br 62a_100009814775_100000210202 [0,2,0,0,0,0|1,1,0]=4 3569 B14R2.587 CCSc1cc(c2cc[nH]c2c1)F 62a_100000210202_100010186028 [0,2,0,0,0,0|1,1,0]=4 3570 B14R2.587 CCSc1cc(c2cc[nH]c2c1)F 62a_100010186028_100000210202 [0,2,0,0,0,0|1,1,0]=4 3571 B14R2.587 CCSc1cc(c2cc[nH]c2c1)N 62a_100000210202_106744500199 [0,2,0,0,0,0|1,1,0]=4 3572 B14R2.587 CCSc1cc(c2nc[nH]c2c1)C 62a_100000210202_100000239325 [0,2,0,0,0,0|0,1,0]=3 3573 B14R2.587 Cc1cc(cc2c1nc[nH]2)SCF 62a_100015361967_100000239325 [0,2,0,0,0,0|0,1,0]=3 3574 B14R2.587 Cc1cc(cc2c1ncs2)OCF 34a_200009842467_100015361967 [0,2,0,0,0,0|1,0,0]=3 3575 B14R2.587 Cc1cc(cc2c1ncs2)OCF 7a_200009842467_100015361967 [0,2,0,0,0,0|1,0,0]=3 3576 B14R2.587 FCNc1cc(c2cc[nH]c2c1)F 34a_100000085187_100015361967 [0,2,0,0,0,0|2,0,0]=4 3577 B14R2.587 FCOc1cc(c2occc2c1)Br 34a_200010248604_100015361967 [0,2,0,0,0,0|2,0,0]=4 3578 B14R2.587 FCOc1cc(c2occc2c1)Br 7a_200010248604_100015361967 [0,2,0,0,0,0|2,0,0]=4 3579 B14R2.587 FCSc1cc(c2cc[nH]c2c1)Br 62a_100009814775_100015361967 [0,2,0,0,0,0|1,1,0]=4 3580 B14R2.587 FCSc1cc(c2cc[nH]c2c1)Br 62a_100015361967_100009814775 [0,2,0,0,0,0|1,1,0]=4 3581 B14R2.587 FCSc1cc(c2cc[nH]c2c1)F 62a_100010186028_100015361967 [0,2,0,0,0,0|1,1,0]=4 3582 B14R2.587 FCSc1cc(c2cc[nH]c2c1)F 62a_100015361967_100010186028 [0,2,0,0,0,0|1,1,0]=4 3583 B14R2.587 Nc1cc(cc2c1cc[nH]2)SCF 62a_100015361967_106744500199 [0,2,0,0,0,0|1,1,0]=4 3584 B14R2.991 C#CCNc1ccc2ncoc2c1 34a_100011248239_100000184674 [0,2,0,0,0,0|2,0,0]=4 3585 B14R2.991 C#CCNc1ccc2ncsc2c1 34a_100011215093_100000184674 [0,2,0,0,0,0|2,0,0]=4 3586 B14R2.991 C#CCOc1ccc2[nH]ccc2c1 34a_100000756620_100000184674 [0,2,0,0,0,0|1,0,1]=4 3587 B14R2.991 C#CCOc1ccc2c(c1)NCC2 34a_100020636427_100000184674 [0,2,0,0,0,0|1,0,1]=4 3588 B14R2.991 C#CCOc1ccc2cc[nH]c2c1 34a_100000036713_100000184674 [0,2,0,0,0,0|1,0,0]=3 3589 B14R2.991 C#CCOc1ccc2ccoc2c1 34a_100000089557_100000184674 [0,2,0,0,0,0|2,0,0]=4 3590 B14R2.991 C#CCOc1ccc2ccoc2c1 7a_100000089557_100000038162 [0,2,0,0,0,0|2,0,0]=4 3591 B14R2.991 C#CCOc1ccc2ncsc2c1 34a_100011995850_100000184674 [0,2,0,0,0,0|1,0,0]=3 3592 B14R2.991 C#CCOc1ccc2ncsc2c1 7a_100011995850_100000038162 [0,2,0,0,0,0|1,0,0]=3 3593 B14R2.991 C#CCOc1ccc2nonc2c1 34a_100000036933_100000184674 [0,2,0,0,0,0|1,0,1]=4 3594 B14R2.991 C#CCOc1ccc2occc2c1 34a_100000070125_100000184674 [0,2,0,0,0,0|2,0,0]=4 3595 B14R2.991 C#CCOc1ccc2occc2c1 7a_100000070125_100000038162 [0,2,0,0,0,0|2,0,0]=4 3596 B14R2.991 C#CCOc1ccc2sccc2c1 34a_100012180905_100000184674 [0,2,0,0,0,0|2,0,0]=4 3597 B14R2.991 C#CCOc1ccc2sccc2c1 7a_100012180905_100000038162 [0,2,0,0,0,0|2,0,0]=4 3598 B14R2.991 C#CCOc1ccc2scnc2c1 34a_200009850626_100000184674 [0,2,0,0,0,0|1,0,1]=4 3599 B14R2.991 C#CCOc1ccc2scnc2c1 7a_200009850626_100000038162 [0,2,0,0,0,0|1,0,1]=4 3600 B14R2.991 C#CCSc1ccc2cc[nH]c2c1 62a_100000038162_100000743809 [0,2,0,0,0,0|1,1,0]=4 3601 B14R2.991 C#CCSc1ccc2nc[nH]c2n1 62a_100000038162_100000077665 [0,2,0,0,0,0|1,1,0]=4 3602 B14R2.991 C#CCSc1ccc2ncoc2c1 62a_100000038162_100009817590 [0,2,0,0,0,0|1,1,0]=4 3603 B14R2.991 C#CCSc1ccc2ncsc2c1 62a_100000038162_100009816678 [0,2,0,0,0,0|1,1,0]=4 3604 B14R2.991 C#CCSc1ccc2nn[nH]c2c1 62a_100000038162_100009817464 [0,2,0,0,0,0|1,1,0]=4 3605 B14R2.991 C#CCSc1cnc2nc[nH]c2c1 62a_100000038162_100000760087 [0,2,0,0,0,0|1,1,0]=4 3606 B14R2.991 C=CCNc1ccc2ncoc2c1 34a_100011248239_100015514636 [0,2,0,0,0,0|2,0,0]=4 3607 B14R2.991 C=CCNc1ccc2ncsc2c1 34a_100011215093_100015514636 [0,2,0,0,0,0|2,0,0]=4 3608 B14R2.991 C=CCOc1ccc2[nH]ccc2c1 34a_100000756620_100015514636 [0,2,0,0,0,0|1,0,1]=4 3609 B14R2.991 C=CCOc1ccc2c(c1)NCC2 34a_100020636427_100015514636 [0,2,0,0,0,0|1,0,1]=4 3610 B14R2.991 C=CCOc1ccc2cc[nH]c2c1 34a_100000036713_100015514636 [0,2,0,0,0,0|1,0,0]=3 3611 B14R2.991 C=CCOc1ccc2ccoc2c1 34a_100000089557_100015514636 [0,2,0,0,0,0|2,0,0]=4 3612 B14R2.991 C=CCOc1ccc2ccoc2c1 7a_100000089557_100015514636 [0,2,0,0,0,0|2,0,0]=4 3613 B14R2.991 C=CCOc1ccc2ncsc2c1 34a_100011995850_100015514636 [0,2,0,0,0,0|1,0,0]=3 3614 B14R2.991 C=CCOc1ccc2ncsc2c1 7a_100011995850_100015514636 [0,2,0,0,0,0|1,0,0]=3 3615 B14R2.991 C=CCOc1ccc2nonc2c1 34a_100000036933_100015514636 [0,2,0,0,0,0|1,0,1]=4 3616 B14R2.991 C=CCOc1ccc2occc2c1 34a_100000070125_100015514636 [0,2,0,0,0,0|2,0,0]=4 3617 B14R2.991 C=CCOc1ccc2occc2c1 7a_100000070125_100015514636 [0,2,0,0,0,0|2,0,0]=4 3618 B14R2.991 C=CCOc1ccc2sccc2c1 34a_100012180905_100015514636 [0,2,0,0,0,0|2,0,0]=4 3619 B14R2.991 C=CCOc1ccc2sccc2c1 7a_100012180905_100015514636 [0,2,0,0,0,0|2,0,0]=4 3620 B14R2.991 C=CCOc1ccc2scnc2c1 34a_200009850626_100015514636 [0,2,0,0,0,0|1,0,1]=4 3621 B14R2.991 C=CCOc1ccc2scnc2c1 7a_200009850626_100015514636 [0,2,0,0,0,0|1,0,1]=4 3622 B14R2.991 C=CCSc1ccc2cc[nH]c2c1 62a_100000210623_100000743809 [0,2,0,0,0,0|1,1,0]=4 3623 B14R2.991 C=CCSc1ccc2nc[nH]c2n1 62a_100000210623_100000077665 [0,2,0,0,0,0|1,1,0]=4 3624 B14R2.991 C=CCSc1ccc2nc[nH]c2n1 62a_100009820032_100000210623 [0,2,0,0,0,0|1,1,0]=4 3625 B14R2.991 C=CCSc1ccc2ncoc2c1 62a_100000210623_100009817590 [0,2,0,0,0,0|1,1,0]=4 3626 B14R2.991 C=CCSc1ccc2ncsc2c1 62a_100000210623_100009816678 [0,2,0,0,0,0|1,1,0]=4 3627 B14R2.991 C=CCSc1ccc2ncsc2c1 62a_100009816678_100000210623 [0,2,0,0,0,0|1,1,0]=4 3628 B14R2.991 C=CCSc1ccc2nn[nH]c2c1 62a_100000210623_100009817464 [0,2,0,0,0,0|1,1,0]=4 3629 B14R2.991 C=CCSc1cnc2nc[nH]c2c1 62a_100000210623_100000760087 [0,2,0,0,0,0|1,1,0]=4 3630 B14R2.991 CCCCc1ccc2cc[nH]c2c1 271570a_100020621405_100000743809 [0,2,0,0,0,0|2,0,0]=4 3631 B14R2.991 CCCCc1ccc2nc[nH]c2n1 271570a_100020621405_100000077665 [0,2,0,0,0,0|2,0,0]=4 3632 B14R2.991 CCCCc1ccc2ncoc2c1 271570a_100020621405_100009817590 [0,2,0,0,0,0|2,0,0]=4 3633 B14R2.991 CCCCc1ccc2ncsc2c1 271570a_100020621405_100009816678 [0,2,0,0,0,0|2,0,0]=4 3634 B14R2.991 CCCCc1ccc2nn[nH]c2c1 271570a_100020621405_100009817464 [0,2,0,0,0,0|2,0,0]=4 3635 B14R2.991 CCCCc1cnc2nc[nH]c2c1 271570a_100020621405_100000760087 [0,2,0,0,0,0|2,0,0]=4 3636 B14R2.991 CCCNc1ccc2ncoc2c1 34a_100011248239_100000210303 [0,2,0,0,0,0|2,0,0]=4 3637 B14R2.991 CCCNc1ccc2ncsc2c1 34a_100011215093_100000210303 [0,2,0,0,0,0|2,0,0]=4 3638 B14R2.991 CCCOc1ccc2[nH]ccc2c1 34a_100000756620_100000210303 [0,2,0,0,0,0|1,0,1]=4 3639 B14R2.991 CCCOc1ccc2c(c1)NCC2 34a_100020636427_100000210303 [0,2,0,0,0,0|1,0,1]=4 3640 B14R2.991 CCCOc1ccc2cc[nH]c2c1 34a_100000036713_100000210303 [0,2,0,0,0,0|1,0,0]=3 3641 B14R2.991 CCCOc1ccc2ccoc2c1 34a_100000089557_100000210303 [0,2,0,0,0,0|2,0,0]=4 3642 B14R2.991 CCCOc1ccc2ccoc2c1 7a_100000089557_100000210303 [0,2,0,0,0,0|2,0,0]=4 3643 B14R2.991 CCCOc1ccc2ncsc2c1 34a_100011995850_100000210303 [0,2,0,0,0,0|1,0,0]=3 3644 B14R2.991 CCCOc1ccc2ncsc2c1 7a_100011995850_100000210303 [0,2,0,0,0,0|1,0,0]=3 3645 B14R2.991 CCCOc1ccc2nonc2c1 34a_100000036933_100000210303 [0,2,0,0,0,0|1,0,1]=4 3646 B14R2.991 CCCOc1ccc2occc2c1 34a_100000070125_100000210303 [0,2,0,0,0,0|2,0,0]=4 3647 B14R2.991 CCCOc1ccc2occc2c1 7a_100000070125_100000210303 [0,2,0,0,0,0|2,0,0]=4 3648 B14R2.991 CCCOc1ccc2sccc2c1 34a_100012180905_100000210303 [0,2,0,0,0,0|2,0,0]=4 3649 B14R2.991 CCCOc1ccc2sccc2c1 7a_100012180905_100000210303 [0,2,0,0,0,0|2,0,0]=4 3650 B14R2.991 CCCOc1ccc2scnc2c1 34a_200009850626_100000210303 [0,2,0,0,0,0|1,0,1]=4 3651 B14R2.991 CCCOc1ccc2scnc2c1 7a_200009850626_100000210303 [0,2,0,0,0,0|1,0,1]=4 3652 B14R2.991 CCCSc1ccc2cc[nH]c2c1 62a_100000210303_100000743809 [0,2,0,0,0,0|1,1,0]=4 3653 B14R2.991 CCCSc1ccc2nc[nH]c2n1 62a_100000210303_100000077665 [0,2,0,0,0,0|1,1,0]=4 3654 B14R2.991 CCCSc1ccc2nc[nH]c2n1 62a_100009820032_100000210303 [0,2,0,0,0,0|1,1,0]=4 3655 B14R2.991 CCCSc1ccc2ncoc2c1 62a_100000210303_100009817590 [0,2,0,0,0,0|1,1,0]=4 3656 B14R2.991 CCCSc1ccc2ncsc2c1 62a_100000210303_100009816678 [0,2,0,0,0,0|1,1,0]=4 3657 B14R2.991 CCCSc1ccc2ncsc2c1 62a_100009816678_100000210303 [0,2,0,0,0,0|1,1,0]=4 3658 B14R2.991 CCCSc1ccc2nn[nH]c2c1 62a_100000210303_100009817464 [0,2,0,0,0,0|1,1,0]=4 3659 B14R2.991 CCCSc1cnc2nc[nH]c2c1 62a_100000210303_100000760087 [0,2,0,0,0,0|1,1,0]=4 3660 B14R2.991 CCNCc1ccc2cc[nH]c2c1 207a_100015525214_100011218920 [0,2,0,0,0,0|2,0,0]=4 3661 B14R2.991 CCNCc1ccc2cc[nH]c2c1 270004a_100015525214_100011218920 [0,2,0,0,0,0|2,0,0]=4 3662 B14R2.991 CCNCc1ccc2nc[nH]c2c1 207a_100015525214_100000059205 [0,2,0,0,0,0|1,0,0]=3 3663 B14R2.991 CCNCc1ccc2nc[nH]c2c1 270004a_100015525214_100000059205 [0,2,0,0,0,0|1,0,0]=3 3664 B14R2.991 CCNCc1ccc2ncoc2c1 207a_100015525214_100000059852 [0,2,0,0,0,0|2,0,0]=4 3665 B14R2.991 CCNCc1ccc2ncoc2c1 2230a_100015525214_106359897996 [0,2,0,0,0,0|2,0,0]=4 3666 B14R2.991 CCNCc1ccc2ncoc2c1 270004a_100015525214_100000059852 [0,2,0,0,0,0|2,0,0]=4 3667 B14R2.991 CCNCc1ccc2ncsc2c1 207a_100015525214_100009861089 [0,2,0,0,0,0|2,0,0]=4 3668 B14R2.991 CCNCc1ccc2ncsc2c1 2230a_100015525214_100009847474 [0,2,0,0,0,0|2,0,0]=4 3669 B14R2.991 CCNCc1ccc2ncsc2c1 270004a_100015525214_100009861089 [0,2,0,0,0,0|2,0,0]=4 3670 B14R2.991 CCOCc1ccc2c(c1)NCC2 34a_100000694088_100000210202 [0,2,0,0,0,0|1,0,1]=4 3671 B14R2.991 CCOCc1ccc2ccoc2c1 34a_200009859634_100000210202 [0,2,0,0,0,0|2,0,0]=4 3672 B14R2.991 CCOCc1ccc2ccoc2c1 7a_200009859634_100000210202 [0,2,0,0,0,0|2,0,0]=4 3673 B14R2.991 CCOCc1ccc2ccsc2c1 34a_100010262773_100000210202 [0,2,0,0,0,0|2,0,0]=4 3674 B14R2.991 CCOCc1ccc2ccsc2c1 7a_100010262773_100000210202 [0,2,0,0,0,0|2,0,0]=4 3675 B14R2.991 CCOCc1ccc2cn[nH]c2c1 34a_100121572206_100020605281 [0,2,0,0,0,0|2,0,0]=4 3676 B14R2.991 CCOCc1ccc2ncoc2c1 34a_100121572206_106359897996 [0,2,0,0,0,0|1,0,0]=3 3677 B14R2.991 CCOCc1ccc2ncsc2c1 34a_100121572206_100009847474 [0,2,0,0,0,0|1,0,0]=3 3678 B14R2.991 CCOCc1ccc2nonc2c1 34a_100121572206_100000733437 [0,2,0,0,0,0|1,0,1]=4 3679 B14R2.991 CCOCc1ccc2nsnc2c1 34a_100121572206_100000187484 [0,2,0,0,0,0|1,0,1]=4 3680 B14R2.991 CCOCc1ccc2occc2c1 34a_100000067418_100000210202 [0,2,0,0,0,0|2,0,0]=4 3681 B14R2.991 CCOCc1ccc2occc2c1 7a_100000067418_100000210202 [0,2,0,0,0,0|2,0,0]=4 3682 B14R2.991 CCOCc1ccc2ocnc2c1 34a_100121572206_200010203175 [0,2,0,0,0,0|1,0,1]=4 3683 B14R2.991 CCOCc1ccc2sccc2c1 34a_100000068000_100000210202 [0,2,0,0,0,0|2,0,0]=4 3684 B14R2.991 CCOCc1ccc2sccc2c1 7a_100000068000_100000210202 [0,2,0,0,0,0|2,0,0]=4 3685 B14R2.991 CCOCc1ccc2scnc2c1 34a_100009883289_100000210202 [0,2,0,0,0,0|1,0,1]=4 3686 B14R2.991 CCSCc1ccc2ncoc2c1 62a_100000210202_106359897996 [0,2,0,0,0,0|1,1,0]=4 3687 B14R2.991 CCSCc1ccc2ncoc2c1 62a_106359897996_100000210202 [0,2,0,0,0,0|1,1,0]=4 3688 B14R2.991 CCSCc1ccc2ncsc2c1 62a_100000210202_100009847474 [0,2,0,0,0,0|1,1,0]=4 3689 B14R2.991 CCSCc1ccc2ncsc2c1 62a_100009847474_100000210202 [0,2,0,0,0,0|1,1,0]=4 3690 B14R2.991 COCCc1ccc2sccc2c1 34a_100000087132_200000210301 [0,2,0,0,0,0|2,0,0]=4 3691 B14R2.991 COCCc1ccc2sccc2c1 7a_100000087132_200000210301 [0,2,0,0,0,0|2,0,0]=4 3692 B14R2.991 COCSc1cc2[nH]ccc2cn1 62a_100000766300_100000089685 [0,2,0,0,0,0|2,0,0]=4 3693 B14R2.991 COCSc1ccc2[nH]ccc2c1 62a_100000766300_100000035808 [0,2,0,0,0,0|1,0,1]=4 3694 B14R2.991 COCSc1ccc2[nH]cnc2c1 62a_100000766300_100011265325 [0,2,0,0,0,0|0,0,2]=4 3695 B14R2.991 COCSc1ccc2c(c1)C=CC2 62a_100000766300_100009814306 [0,2,0,0,0,0|2,0,0]=4 3696 B14R2.991 COCSc1ccc2c(c1)C=CC2 62a_100009814306_100000766300 [0,2,0,0,0,0|2,0,0]=4 3697 B14R2.991 COCSc1ccc2c(c1)CC=C2 62a_100000766300_200009818231 [0,2,0,0,0,0|2,0,0]=4 3698 B14R2.991 COCSc1ccc2c(c1)CC=C2 62a_200009818231_100000766300 [0,2,0,0,0,0|2,0,0]=4 3699 B14R2.991 COCSc1ccc2c(c1)NCC2 62a_100000754641_100000766300 [0,2,0,0,0,0|1,0,1]=4 3700 B14R2.991 COCSc1ccc2c(c1)NCC2 62a_100000766300_100000754641 [0,2,0,0,0,0|1,0,1]=4 3701 B14R2.991 COCSc1ccc2cc[nH]c2c1 62a_100000766300_100000743809 [0,2,0,0,0,0|1,0,0]=3 3702 B14R2.991 COCSc1ccc2cc[nH]c2n1 62a_100000766300_100009814870 [0,2,0,0,0,0|2,0,0]=4 3703 B14R2.991 COCSc1ccc2ccoc2c1 62a_100000766300_100000759542 [0,2,0,0,0,0|2,0,0]=4 3704 B14R2.991 COCSc1ccc2ccsc2c1 62a_100000766300_100009888917 [0,2,0,0,0,0|2,0,0]=4 3705 B14R2.991 COCSc1ccc2cn[nH]c2c1 62a_100000766300_100000049514 [0,2,0,0,0,0|2,0,0]=4 3706 B14R2.991 COCSc1ccc2nc[nH]c2n1 62a_100000766300_100000077665 [0,2,0,0,0,0|1,0,0]=3 3707 B14R2.991 COCSc1ccc2nc[nH]c2n1 62a_100009820032_100000766300 [0,2,0,0,0,0|1,0,0]=3 3708 B14R2.991 COCSc1ccc2nccn2c1 62a_100000746083_100000766300 [0,2,0,0,0,0|2,0,0]=4 3709 B14R2.991 COCSc1ccc2nccn2c1 62a_100000766300_100000746083 [0,2,0,0,0,0|2,0,0]=4 3710 B14R2.991 COCSc1ccc2ncnn2c1 62a_100000766300_100009816971 [0,2,0,0,0,0|1,0,1]=4 3711 B14R2.991 COCSc1ccc2ncnn2c1 62a_100009816971_100000766300 [0,2,0,0,0,0|1,0,1]=4 3712 B14R2.991 COCSc1ccc2ncoc2c1 62a_100000766300_100009817590 [0,2,0,0,0,0|1,0,0]=3 3713 B14R2.991 COCSc1ccc2ncsc2c1 62a_100000766300_100009816678 [0,2,0,0,0,0|1,0,0]=3 3714 B14R2.991 COCSc1ccc2ncsc2c1 62a_100009816678_100000766300 [0,2,0,0,0,0|1,0,0]=3 3715 B14R2.991 COCSc1ccc2ncsc2n1 62a_100000766300_100010381354 [0,2,0,0,0,0|2,0,0]=4 3716 B14R2.991 COCSc1ccc2ncsc2n1 62a_100010090457_100000766300 [0,2,0,0,0,0|2,0,0]=4 3717 B14R2.991 COCSc1ccc2nn[nH]c2c1 62a_100000766300_100009817464 [0,2,0,0,0,0|1,0,0]=3 3718 B14R2.991 COCSc1ccc2nonc2c1 62a_100000766300_100009814275 [0,2,0,0,0,0|1,0,1]=4 3719 B14R2.991 COCSc1ccc2nonc2c1 62a_100009814275_100000766300 [0,2,0,0,0,0|1,0,1]=4 3720 B14R2.991 COCSc1ccc2nsnc2c1 62a_100000766300_100009814274 [0,2,0,0,0,0|1,0,1]=4 3721 B14R2.991 COCSc1ccc2nsnc2c1 62a_100009814274_100000766300 [0,2,0,0,0,0|1,0,1]=4 3722 B14R2.991 COCSc1ccc2occc2c1 62a_100000766300_100000691453 [0,2,0,0,0,0|2,0,0]=4 3723 B14R2.991 COCSc1ccc2ocnc2c1 62a_100000766300_100009816175 [0,2,0,0,0,0|1,0,1]=4 3724 B14R2.991 COCSc1ccc2sccc2c1 62a_100000766300_100009814439 [0,2,0,0,0,0|2,0,0]=4 3725 B14R2.991 COCSc1ccc2scnc2c1 62a_100000766300_100010005895 [0,2,0,0,0,0|1,0,1]=4 3726 B14R2.991 COCSc1ccn2nccc2c1 62a_100000766300_100000763084 [0,2,0,0,0,0|2,0,0]=4 3727 B14R2.991 COCSc1ccn2ncnc2c1 62a_100000766300_100009819723 [0,2,0,0,0,0|1,0,1]=4 3728 B14R2.991 COCSc1ccn2ncnc2c1 62a_100009819723_100000766300 [0,2,0,0,0,0|1,0,1]=4 3729 B14R2.991 COCSc1cnc2cc[nH]c2c1 62a_100000766300_100009818992 [0,2,0,0,0,0|2,0,0]=4 3730 B14R2.991 COCSc1cnc2nc[nH]c2c1 62a_100000766300_100000760087 [0,2,0,0,0,0|1,0,0]=3 3731 B14R2.991 COCSc1cnc2ncoc2c1 62a_100000721906_100000766300 [0,2,0,0,0,0|2,0,0]=4 3732 B14R2.991 COCSc1cnc2ncoc2c1 62a_100000766300_100000721906 [0,2,0,0,0,0|2,0,0]=4 3733 B14R2.991 COCSc1ncc2nc[nH]c2n1 62a_100000766300_100000009038 [0,2,0,0,0,0|2,0,0]=4 3734 B14R2.991 CSCNc1ccc2ncoc2c1 34a_100011248239_100011218213 [0,2,0,0,0,0|1,1,0]=4 3735 B14R2.991 CSCNc1ccc2ncsc2c1 34a_100011215093_100011218213 [0,2,0,0,0,0|1,1,0]=4 3736 B14R2.991 CSCOc1ccc2[nH]ccc2c1 34a_100000756620_100011218213 [0,2,0,0,0,0|1,0,1]=4 3737 B14R2.991 CSCOc1ccc2c(c1)NCC2 34a_100020636427_100011218213 [0,2,0,0,0,0|1,0,1]=4 3738 B14R2.991 CSCOc1ccc2cc[nH]c2c1 34a_100000036713_100011218213 [0,2,0,0,0,0|1,0,0]=3 3739 B14R2.991 CSCOc1ccc2ccoc2c1 34a_100000089557_100011218213 [0,2,0,0,0,0|2,0,0]=4 3740 B14R2.991 CSCOc1ccc2ncsc2c1 34a_100011995850_100011218213 [0,2,0,0,0,0|1,0,0]=3 3741 B14R2.991 CSCOc1ccc2nonc2c1 34a_100000036933_100011218213 [0,2,0,0,0,0|1,0,1]=4 3742 B14R2.991 CSCOc1ccc2occc2c1 34a_100000070125_100011218213 [0,2,0,0,0,0|2,0,0]=4 3743 B14R2.991 CSCOc1ccc2sccc2c1 34a_100012180905_100011218213 [0,2,0,0,0,0|2,0,0]=4 3744 B14R2.991 CSCOc1ccc2scnc2c1 34a_200009850626_100011218213 [0,2,0,0,0,0|1,0,1]=4 3745 B14R2.991 CSCSc1ccc2cc[nH]c2c1 62a_100011218213_100000743809 [0,2,0,0,0,0|1,1,0]=4 3746 B14R2.991 CSCSc1ccc2nc[nH]c2n1 62a_100009820032_100011218213 [0,2,0,0,0,0|1,1,0]=4 3747 B14R2.991 CSCSc1ccc2nc[nH]c2n1 62a_100011218213_100000077665 [0,2,0,0,0,0|1,1,0]=4 3748 B14R2.991 CSCSc1ccc2ncoc2c1 62a_100011218213_100009817590 [0,2,0,0,0,0|1,1,0]=4 3749 B14R2.991 CSCSc1ccc2ncsc2c1 62a_100009816678_100011218213 [0,2,0,0,0,0|1,1,0]=4 3750 B14R2.991 CSCSc1ccc2ncsc2c1 62a_100011218213_100009816678 [0,2,0,0,0,0|1,1,0]=4 3751 B14R2.991 CSCSc1ccc2nn[nH]c2c1 62a_100011218213_100009817464 [0,2,0,0,0,0|1,1,0]=4 3752 B14R2.991 CSCSc1cnc2nc[nH]c2c1 62a_100011218213_100000760087 [0,2,0,0,0,0|1,1,0]=4 3753 B14R2.991 FCCNc1ccc2ncoc2c1 34a_100011248239_100011217306 [0,2,0,0,0,0|2,0,0]=4 3754 B14R2.991 FCCNc1ccc2ncsc2c1 34a_100011215093_100011217306 [0,2,0,0,0,0|2,0,0]=4 3755 B14R2.991 FCCOc1ccc2[nH]ccc2c1 34a_100000756620_100011217306 [0,2,0,0,0,0|1,0,1]=4 3756 B14R2.991 FCCOc1ccc2c(c1)NCC2 34a_100020636427_100011217306 [0,2,0,0,0,0|1,0,1]=4 3757 B14R2.991 FCCOc1ccc2cc[nH]c2c1 34a_100000036713_100011217306 [0,2,0,0,0,0|1,0,0]=3 3758 B14R2.991 FCCOc1ccc2ccoc2c1 34a_100000089557_100011217306 [0,2,0,0,0,0|2,0,0]=4 3759 B14R2.991 FCCOc1ccc2ccoc2c1 7a_100000089557_100011217306 [0,2,0,0,0,0|2,0,0]=4 3760 B14R2.991 FCCOc1ccc2ncsc2c1 34a_100011995850_100011217306 [0,2,0,0,0,0|1,0,0]=3 3761 B14R2.991 FCCOc1ccc2ncsc2c1 7a_100011995850_100011217306 [0,2,0,0,0,0|1,0,0]=3 3762 B14R2.991 FCCOc1ccc2nonc2c1 34a_100000036933_100011217306 [0,2,0,0,0,0|1,0,1]=4 3763 B14R2.991 FCCOc1ccc2occc2c1 34a_100000070125_100011217306 [0,2,0,0,0,0|2,0,0]=4 3764 B14R2.991 FCCOc1ccc2occc2c1 7a_100000070125_100011217306 [0,2,0,0,0,0|2,0,0]=4 3765 B14R2.991 FCCOc1ccc2sccc2c1 34a_100012180905_100011217306 [0,2,0,0,0,0|2,0,0]=4 3766 B14R2.991 FCCOc1ccc2sccc2c1 7a_100012180905_100011217306 [0,2,0,0,0,0|2,0,0]=4 3767 B14R2.991 FCCOc1ccc2scnc2c1 34a_200009850626_100011217306 [0,2,0,0,0,0|1,0,1]=4 3768 B14R2.991 FCCOc1ccc2scnc2c1 7a_200009850626_100011217306 [0,2,0,0,0,0|1,0,1]=4 3769 B14R2.991 FCCSc1ccc2cc[nH]c2c1 62a_100011217306_100000743809 [0,2,0,0,0,0|1,1,0]=4 3770 B14R2.991 FCCSc1ccc2nc[nH]c2n1 62a_100009820032_100011217306 [0,2,0,0,0,0|1,1,0]=4 3771 B14R2.991 FCCSc1ccc2nc[nH]c2n1 62a_100011217306_100000077665 [0,2,0,0,0,0|1,1,0]=4 3772 B14R2.991 FCCSc1ccc2ncoc2c1 62a_100011217306_100009817590 [0,2,0,0,0,0|1,1,0]=4 3773 B14R2.991 FCCSc1ccc2ncsc2c1 62a_100009816678_100011217306 [0,2,0,0,0,0|1,1,0]=4 3774 B14R2.991 FCCSc1ccc2ncsc2c1 62a_100011217306_100009816678 [0,2,0,0,0,0|1,1,0]=4 3775 B14R2.991 FCCSc1ccc2nn[nH]c2c1 62a_100011217306_100009817464 [0,2,0,0,0,0|1,1,0]=4 3776 B14R2.991 FCCSc1cnc2nc[nH]c2c1 62a_100011217306_100000760087 [0,2,0,0,0,0|1,1,0]=4 3777 B14R2.991 FCOCc1ccc2c(c1)NCC2 34a_100000694088_100015361967 [0,2,0,0,0,0|1,0,1]=4 3778 B14R2.991 FCOCc1ccc2ccoc2c1 34a_200009859634_100015361967 [0,2,0,0,0,0|2,0,0]=4 3779 B14R2.991 FCOCc1ccc2ccoc2c1 7a_200009859634_100015361967 [0,2,0,0,0,0|2,0,0]=4 3780 B14R2.991 FCOCc1ccc2ccsc2c1 34a_100010262773_100015361967 [0,2,0,0,0,0|2,0,0]=4 3781 B14R2.991 FCOCc1ccc2ccsc2c1 7a_100010262773_100015361967 [0,2,0,0,0,0|2,0,0]=4 3782 B14R2.991 FCOCc1ccc2occc2c1 34a_100000067418_100015361967 [0,2,0,0,0,0|2,0,0]=4 3783 B14R2.991 FCOCc1ccc2occc2c1 7a_100000067418_100015361967 [0,2,0,0,0,0|2,0,0]=4 3784 B14R2.991 FCOCc1ccc2sccc2c1 34a_100000068000_100015361967 [0,2,0,0,0,0|2,0,0]=4 3785 B14R2.991 FCOCc1ccc2sccc2c1 7a_100000068000_100015361967 [0,2,0,0,0,0|2,0,0]=4 3786 B14R2.991 FCOCc1ccc2scnc2c1 34a_100009883289_100015361967 [0,2,0,0,0,0|1,0,1]=4 3787 B14R2.991 FCSCc1ccc2ncoc2c1 62a_100015361967_106359897996 [0,2,0,0,0,0|1,1,0]=4 3788 B14R2.991 FCSCc1ccc2ncoc2c1 62a_106359897996_100015361967 [0,2,0,0,0,0|1,1,0]=4 3789 B14R2.991 FCSCc1ccc2ncsc2c1 62a_100009847474_100015361967 [0,2,0,0,0,0|1,1,0]=4 3790 B14R2.991 FCSCc1ccc2ncsc2c1 62a_100015361967_100009847474 [0,2,0,0,0,0|1,1,0]=4 3791 B14R2.991 N#CCOc1ccc2ccoc2c1 7a_100000089557_100011215382 [0,2,0,0,0,0|2,0,0]=4 3792 B14R2.991 N#CCOc1ccc2ncsc2c1 7a_100011995850_100011215382 [0,2,0,0,0,0|1,0,0]=3 3793 B14R2.991 N#CCOc1ccc2occc2c1 7a_100000070125_100011215382 [0,2,0,0,0,0|2,0,0]=4 3794 B14R2.991 N#CCOc1ccc2sccc2c1 7a_100012180905_100011215382 [0,2,0,0,0,0|2,0,0]=4 3795 B14R2.991 N#CCOc1ccc2scnc2c1 7a_200009850626_100011215382 [0,2,0,0,0,0|1,0,1]=4 3796 B14R2.991 N#CCSc1ccc2cc[nH]c2c1 62a_100011215382_100000743809 [0,2,0,0,0,0|1,1,0]=4 3797 B14R2.991 N#CCSc1ccc2nc[nH]c2n1 62a_100009820032_100011215382 [0,2,0,0,0,0|1,1,0]=4 3798 B14R2.991 N#CCSc1ccc2nc[nH]c2n1 62a_100011215382_100000077665 [0,2,0,0,0,0|1,1,0]=4 3799 B14R2.991 N#CCSc1ccc2ncoc2c1 62a_100011215382_100009817590 [0,2,0,0,0,0|1,1,0]=4 3800 B14R2.991 N#CCSc1ccc2ncsc2c1 62a_100009816678_100011215382 [0,2,0,0,0,0|1,1,0]=4 3801 B14R2.991 N#CCSc1ccc2ncsc2c1 62a_100011215382_100009816678 [0,2,0,0,0,0|1,1,0]=4 3802 B14R2.991 N#CCSc1ccc2nn[nH]c2c1 62a_100011215382_100009817464 [0,2,0,0,0,0|1,1,0]=4 3803 B14R2.991 N#CCSc1cnc2nc[nH]c2c1 62a_100011215382_100000760087 [0,2,0,0,0,0|1,1,0]=4 3804 B14R2.991 O=CCNc1ccc2ncoc2c1 34a_100011248239_200009817547 [0,2,0,0,0,0|2,0,0]=4 3805 B14R2.991 O=CCNc1ccc2ncsc2c1 34a_100011215093_200009817547 [0,2,0,0,0,0|2,0,0]=4 3806 B14R2.991 O=CCOc1ccc2[nH]ccc2c1 34a_100000756620_200009817547 [0,2,0,0,0,0|1,0,1]=4 3807 B14R2.991 O=CCOc1ccc2c(c1)NCC2 34a_100020636427_200009817547 [0,2,0,0,0,0|1,0,1]=4 3808 B14R2.991 O=CCOc1ccc2cc[nH]c2c1 34a_100000036713_200009817547 [0,2,0,0,0,0|1,0,0]=3 3809 B14R2.991 O=CCOc1ccc2ccoc2c1 34a_100000089557_200009817547 [0,2,0,0,0,0|2,0,0]=4 3810 B14R2.991 O=CCOc1ccc2ccoc2c1 7a_100000089557_200015260668 [0,2,0,0,0,0|2,0,0]=4 3811 B14R2.991 O=CCOc1ccc2ncsc2c1 34a_100011995850_200009817547 [0,2,0,0,0,0|1,0,0]=3 3812 B14R2.991 O=CCOc1ccc2ncsc2c1 7a_100011995850_200015260668 [0,2,0,0,0,0|1,0,0]=3 3813 B14R2.991 O=CCOc1ccc2nonc2c1 34a_100000036933_200009817547 [0,2,0,0,0,0|1,0,1]=4 3814 B14R2.991 O=CCOc1ccc2occc2c1 34a_100000070125_200009817547 [0,2,0,0,0,0|2,0,0]=4 3815 B14R2.991 O=CCOc1ccc2occc2c1 7a_100000070125_200015260668 [0,2,0,0,0,0|2,0,0]=4 3816 B14R2.991 O=CCOc1ccc2sccc2c1 34a_100012180905_200009817547 [0,2,0,0,0,0|2,0,0]=4 3817 B14R2.991 O=CCOc1ccc2sccc2c1 7a_100012180905_200015260668 [0,2,0,0,0,0|2,0,0]=4 3818 B14R2.991 O=CCOc1ccc2scnc2c1 34a_200009850626_200009817547 [0,2,0,0,0,0|1,0,1]=4 3819 B14R2.991 O=CCOc1ccc2scnc2c1 7a_200009850626_200015260668 [0,2,0,0,0,0|1,0,1]=4 3820 B14R2.991 O=CCSc1ccc2cc[nH]c2c1 62a_200015260668_100000743809 [0,2,0,0,0,0|1,1,0]=4 3821 B14R2.991 O=CCSc1ccc2nc[nH]c2n1 62a_100009820032_200015260668 [0,2,0,0,0,0|1,1,0]=4 3822 B14R2.991 O=CCSc1ccc2nc[nH]c2n1 62a_200015260668_100000077665 [0,2,0,0,0,0|1,1,0]=4 3823 B14R2.991 O=CCSc1ccc2ncoc2c1 62a_200015260668_100009817590 [0,2,0,0,0,0|1,1,0]=4 3824 B14R2.991 O=CCSc1ccc2ncsc2c1 62a_100009816678_200015260668 [0,2,0,0,0,0|1,1,0]=4 3825 B14R2.991 O=CCSc1ccc2ncsc2c1 62a_200015260668_100009816678 [0,2,0,0,0,0|1,1,0]=4 3826 B14R2.991 O=CCSc1ccc2nn[nH]c2c1 62a_200015260668_100009817464 [0,2,0,0,0,0|1,1,0]=4 3827 B14R2.991 O=CCSc1cnc2nc[nH]c2c1 62a_200015260668_100000760087 [0,2,0,0,0,0|1,1,0]=4 3828 B14R2.991 OCCNc1ccc2ncoc2c1 34a_100011248239_100000211926 [0,2,0,0,0,0|2,0,0]=4 3829 B14R2.991 OCCNc1ccc2ncsc2c1 34a_100011215093_100000211926 [0,2,0,0,0,0|2,0,0]=4 3830 B14R2.991 OCCOc1ccc2[nH]ccc2c1 34a_100000756620_100000211926 [0,2,0,0,0,0|1,0,1]=4 3831 B14R2.991 OCCOc1ccc2c(c1)NCC2 34a_100020636427_100000211926 [0,2,0,0,0,0|1,0,1]=4 3832 B14R2.991 OCCOc1ccc2cc[nH]c2c1 34a_100000036713_100000211926 [0,2,0,0,0,0|1,0,0]=3 3833 B14R2.991 OCCOc1ccc2ccoc2c1 34a_100000089557_100000211926 [0,2,0,0,0,0|2,0,0]=4 3834 B14R2.991 OCCOc1ccc2ccoc2c1 7a_100000089557_100000211926 [0,2,0,0,0,0|2,0,0]=4 3835 B14R2.991 OCCOc1ccc2ncsc2c1 34a_100011995850_100000211926 [0,2,0,0,0,0|1,0,0]=3 3836 B14R2.991 OCCOc1ccc2ncsc2c1 7a_100011995850_100000211926 [0,2,0,0,0,0|1,0,0]=3 3837 B14R2.991 OCCOc1ccc2nonc2c1 34a_100000036933_100000211926 [0,2,0,0,0,0|1,0,1]=4 3838 B14R2.991 OCCOc1ccc2occc2c1 34a_100000070125_100000211926 [0,2,0,0,0,0|2,0,0]=4 3839 B14R2.991 OCCOc1ccc2occc2c1 7a_100000070125_100000211926 [0,2,0,0,0,0|2,0,0]=4 3840 B14R2.991 OCCOc1ccc2sccc2c1 34a_100012180905_100000211926 [0,2,0,0,0,0|2,0,0]=4 3841 B14R2.991 OCCOc1ccc2sccc2c1 7a_100012180905_100000211926 [0,2,0,0,0,0|2,0,0]=4 3842 B14R2.991 OCCOc1ccc2scnc2c1 34a_200009850626_100000211926 [0,2,0,0,0,0|1,0,1]=4 3843 B14R2.991 OCCOc1ccc2scnc2c1 7a_200009850626_100000211926 [0,2,0,0,0,0|1,0,1]=4 3844 B14R2.991 OCCSc1ccc2cc[nH]c2c1 62a_100000211926_100000743809 [0,2,0,0,0,0|1,1,0]=4 3845 B14R2.991 OCCSc1ccc2nc[nH]c2n1 62a_100000211926_100000077665 [0,2,0,0,0,0|1,1,0]=4 3846 B14R2.991 OCCSc1ccc2nc[nH]c2n1 62a_100009820032_100000211926 [0,2,0,0,0,0|1,1,0]=4 3847 B14R2.991 OCCSc1ccc2ncoc2c1 62a_100000211926_100009817590 [0,2,0,0,0,0|1,1,0]=4 3848 B14R2.991 OCCSc1ccc2ncsc2c1 62a_100000211926_100009816678 [0,2,0,0,0,0|1,1,0]=4 3849 B14R2.991 OCCSc1ccc2ncsc2c1 62a_100009816678_100000211926 [0,2,0,0,0,0|1,1,0]=4 3850 B14R2.991 OCCSc1ccc2nn[nH]c2c1 62a_100000211926_100009817464 [0,2,0,0,0,0|1,1,0]=4 3851 B14R2.991 OCCSc1cnc2nc[nH]c2c1 62a_100000211926_100000760087 [0,2,0,0,0,0|1,1,0]=4 3852 B14R2.991 [13CH3]OCCc1ccc2sccc2c1 34a_100000087132_200025704644 [0,2,0,0,0,0|2,0,0]=4 3853 B14R2.991 [13CH3]OCCc1ccc2sccc2c1 7a_100000087132_200025704644 [0,2,0,0,0,0|2,0,0]=4 3854 B14R2.1008 CC(=Cc1ccc2cc[nH]c2c1)C 271570a_100102525489_100000743809 [0,2,0,0,0,0|2,0,0]=4 3855 B14R2.1008 CC(=Cc1ccc2nc[nH]c2n1)C 271570a_100102525489_100000077665 [0,2,0,0,0,0|2,0,0]=4 3856 B14R2.1008 CC(=Cc1ccc2ncoc2c1)C 271570a_100102525489_100009817590 [0,2,0,0,0,0|2,0,0]=4 3857 B14R2.1008 CC(=Cc1ccc2ncsc2c1)C 271570a_100102525489_100009816678 [0,2,0,0,0,0|2,0,0]=4 3858 B14R2.1008 CC(=Cc1ccc2nn[nH]c2c1)C 271570a_100102525489_100009817464 [0,2,0,0,0,0|2,0,0]=4 3859 B14R2.1008 CC(=Cc1cnc2nc[nH]c2c1)C 271570a_100102525489_100000760087 [0,2,0,0,0,0|2,0,0]=4 3860 B14R2.1008 CC(=O)Cc1ccc2cc[nH]c2c1 1458a_100000094508_200000210301 [0,2,0,0,0,0|2,0,0]=4 3861 B14R2.1008 CC(=O)Cc1ccc2nc[nH]c2c1 1458a_100000055147_200000210301 [0,2,0,0,0,0|1,0,0]=3 3862 B14R2.1008 CC(=O)Cc1ccc2ncoc2c1 1458a_100000070787_106359897996 [0,2,0,0,0,0|2,0,0]=4 3863 B14R2.1008 CC(=O)Cc1ccc2ncsc2c1 1458a_100000070787_100009847474 [0,2,0,0,0,0|2,0,0]=4 3864 B14R2.1008 CC(=O)Nc1ccc2cc[nH]c2c1 11a_100000743810_100015343762 [0,2,0,0,0,0|2,0,0]=4 3865 B14R2.1008 CC(=O)Nc1ccc2cc[nH]c2c1 1626a_100000743810_100015343762 [0,2,0,0,0,0|2,0,0]=4 3866 B14R2.1008 CC(=O)Nc1ccc2cc[nH]c2c1 22a_100000743810_100000070787 [0,2,0,0,0,0|2,0,0]=4 3867 B14R2.1008 CC(=O)Nc1ccc2cc[nH]c2c1 527a_100000743810_100103153847 [0,2,0,0,0,0|2,0,0]=4 3868 B14R2.1008 CC(=O)Nc1ccc2ncoc2c1 11a_100011248239_100015343762 [0,2,0,0,0,0|2,0,0]=4 3869 B14R2.1008 CC(=O)Nc1ccc2ncoc2c1 1626a_100011248239_100015343762 [0,2,0,0,0,0|2,0,0]=4 3870 B14R2.1008 CC(=O)Nc1ccc2ncoc2c1 527a_100011248239_100103153847 [0,2,0,0,0,0|2,0,0]=4 3871 B14R2.1008 CC(=O)Nc1ccc2ncsc2c1 11a_100011215093_100015343762 [0,2,0,0,0,0|2,0,0]=4 3872 B14R2.1008 CC(=O)Nc1ccc2ncsc2c1 1626a_100011215093_100015343762 [0,2,0,0,0,0|2,0,0]=4 3873 B14R2.1008 CC(=O)Nc1ccc2ncsc2c1 22a_100011215093_100000070787 [0,2,0,0,0,0|2,0,0]=4 3874 B14R2.1008 CC(=O)Nc1ccc2ncsc2c1 527a_100011215093_100103153847 [0,2,0,0,0,0|2,0,0]=4 3875 B14R2.1008 CC(C)Nc1ccc2ncoc2c1 34a_100011248239_100000210206 [0,2,0,0,0,0|2,0,0]=4 3876 B14R2.1008 CC(C)Nc1ccc2ncsc2c1 34a_100011215093_100000210206 [0,2,0,0,0,0|2,0,0]=4 3877 B14R2.1008 CC(C)Oc1ccc2[nH]ccc2c1 34a_100000756620_100000210206 [0,2,0,0,0,0|1,0,1]=4 3878 B14R2.1008 CC(C)Oc1ccc2c(c1)NCC2 34a_100020636427_100000210206 [0,2,0,0,0,0|1,0,1]=4 3879 B14R2.1008 CC(C)Oc1ccc2cc[nH]c2c1 34a_100000036713_100000210206 [0,2,0,0,0,0|1,0,0]=3 3880 B14R2.1008 CC(C)Oc1ccc2ccoc2c1 34a_100000089557_100000210206 [0,2,0,0,0,0|2,0,0]=4 3881 B14R2.1008 CC(C)Oc1ccc2ccoc2c1 7a_100000089557_100000210206 [0,2,0,0,0,0|2,0,0]=4 3882 B14R2.1008 CC(C)Oc1ccc2ncsc2c1 34a_100011995850_100000210206 [0,2,0,0,0,0|1,0,0]=3 3883 B14R2.1008 CC(C)Oc1ccc2ncsc2c1 7a_100011995850_100000210206 [0,2,0,0,0,0|1,0,0]=3 3884 B14R2.1008 CC(C)Oc1ccc2nonc2c1 34a_100000036933_100000210206 [0,2,0,0,0,0|1,0,1]=4 3885 B14R2.1008 CC(C)Oc1ccc2occc2c1 34a_100000070125_100000210206 [0,2,0,0,0,0|2,0,0]=4 3886 B14R2.1008 CC(C)Oc1ccc2occc2c1 7a_100000070125_100000210206 [0,2,0,0,0,0|2,0,0]=4 3887 B14R2.1008 CC(C)Oc1ccc2sccc2c1 34a_100012180905_100000210206 [0,2,0,0,0,0|2,0,0]=4 3888 B14R2.1008 CC(C)Oc1ccc2sccc2c1 7a_100012180905_100000210206 [0,2,0,0,0,0|2,0,0]=4 3889 B14R2.1008 CC(C)Oc1ccc2scnc2c1 34a_200009850626_100000210206 [0,2,0,0,0,0|1,0,1]=4 3890 B14R2.1008 CC(C)Oc1ccc2scnc2c1 7a_200009850626_100000210206 [0,2,0,0,0,0|1,0,1]=4 3891 B14R2.1008 CC(C)Sc1ccc2cc[nH]c2c1 62a_100000210206_100000743809 [0,2,0,0,0,0|1,1,0]=4 3892 B14R2.1008 CC(C)Sc1ccc2nc[nH]c2n1 62a_100000210206_100000077665 [0,2,0,0,0,0|1,1,0]=4 3893 B14R2.1008 CC(C)Sc1ccc2nc[nH]c2n1 62a_100009820032_100000210206 [0,2,0,0,0,0|1,1,0]=4 3894 B14R2.1008 CC(C)Sc1ccc2ncoc2c1 62a_100000210206_100009817590 [0,2,0,0,0,0|1,1,0]=4 3895 B14R2.1008 CC(C)Sc1ccc2ncsc2c1 62a_100000210206_100009816678 [0,2,0,0,0,0|1,1,0]=4 3896 B14R2.1008 CC(C)Sc1ccc2ncsc2c1 62a_100009816678_100000210206 [0,2,0,0,0,0|1,1,0]=4 3897 B14R2.1008 CC(C)Sc1ccc2nn[nH]c2c1 62a_100000210206_100009817464 [0,2,0,0,0,0|1,1,0]=4 3898 B14R2.1008 CC(C)Sc1cnc2nc[nH]c2c1 62a_100000210206_100000760087 [0,2,0,0,0,0|1,1,0]=4 3899 B14R2.1008 CN(C)Cc1ccc2cc[nH]c2c1 270004a_100102631434_100011218920 [0,2,0,0,0,0|2,0,0]=4 3900 B14R2.1008 CN(C)Cc1ccc2nc[nH]c2c1 270004a_100102631434_100000059205 [0,2,0,0,0,0|1,0,0]=3 3901 B14R2.1008 CN(C)Cc1ccc2ncoc2c1 2230a_100102631434_106359897996 [0,2,0,0,0,0|2,0,0]=4 3902 B14R2.1008 CN(C)Cc1ccc2ncoc2c1 270004a_100102631434_100000059852 [0,2,0,0,0,0|2,0,0]=4 3903 B14R2.1008 CN(C)Cc1ccc2ncsc2c1 2230a_100102631434_100009847474 [0,2,0,0,0,0|2,0,0]=4 3904 B14R2.1008 CN(C)Cc1ccc2ncsc2c1 269982a_100102631434_100009847474 [0,2,0,0,0,0|2,0,0]=4 3905 B14R2.1008 CN(C)Cc1ccc2ncsc2c1 270004a_100102631434_100009861089 [0,2,0,0,0,0|2,0,0]=4 3906 B14R2.1008 [13CH3]C(=O)Cc1ccc2cc[nH]c2c1 1458a_100000094508_200025704644 [0,2,0,0,0,0|2,0,0]=4 3907 B14R2.1008 [13CH3]C(=O)Cc1ccc2nc[nH]c2c1 1458a_100000055147_200025704644 [0,2,0,0,0,0|1,0,0]=3 3908 B14R2.6400 CC=Cc1cc2[nH]c(nc2cn1)O 271570a_100016259895_100010516660 [0,2,0,0,0,0|2,0,0]=4 3909 B14R2.6400 CC=Cc1ccc2[nH]c(=O)[nH]c2c1 271570a_100016259895_100011221360 [0,2,0,0,0,0|1,0,1]=4 3910 B14R2.6400 CC=Cc1ccc2c(c1)NC(=O)C2 271570a_100016259895_100000760487 [0,2,0,0,0,0|2,0,0]=4 3911 B14R2.6400 CC=Cc1ccc2cc([nH]c2c1)C 271570a_100016259895_100010196937 [0,2,0,0,0,0|2,0,0]=4 3912 B14R2.6400 CC=Cc1ccc2nc([nH]c2n1)C 271570a_100016259895_100000079090 [0,2,0,0,0,0|2,0,0]=4 3913 B14R2.6400 CC=Cc1ccc2nc(oc2c1)C 271570a_100016259895_100010171164 [0,2,0,0,0,0|2,0,0]=4 3914 B14R2.6400 CC=Cc1ccc2nc(oc2c1)N 271570a_100016259895_100010000678 [0,2,0,0,0,0|2,0,0]=4 3915 B14R2.6400 CC=Cc1ccc2nc(sc2c1)C 271570a_100016259895_100009813144 [0,2,0,0,0,0|2,0,0]=4 3916 B14R2.6400 CC=Cc1ccc2nc(sc2c1)Cl 271570a_100016259895_100010163703 [0,2,0,0,0,0|2,0,0]=4 3917 B14R2.6400 CC=Cc1ccc2nc(sc2c1)N 271570a_100016259895_100102524914 [0,2,0,0,0,0|2,0,0]=4 3918 B14R2.6400 CC=Cc1ccc2oc(=O)[nH]c2c1 271570a_100016259895_100000764829 [0,2,0,0,0,0|2,0,0]=4 3919 B14R2.6400 CC=Cc1ccc2sc(=O)[nH]c2c1 271570a_100016259895_100000239354 [0,2,0,0,0,0|2,0,0]=4 3920 B14R2.6400 CC=Cc1cnc2nc([nH]c2c1)C 271570a_100016259895_100000758206 [0,2,0,0,0,0|2,0,0]=4 3921 B14R2.6400 CCNc1ccc2nc(oc2c1)C 34a_100000736495_100000210202 [0,2,0,0,0,0|2,0,0]=4 3922 B14R2.6400 CCNc1ccc2nc(sc2c1)Cl 27a_100015525214_100010163703 [0,2,0,0,0,0|2,0,0]=4 3923 B14R2.6400 CCOc1ccc2[nH]c(=O)oc2c1 7a_200000068749_100000210202 [0,2,0,0,0,0|1,0,1]=4 3924 B14R2.6400 CCOc1ccc2[nH]c(cc2c1)C 34a_100000073708_100000210202 [0,2,0,0,0,0|1,0,1]=4 3925 B14R2.6400 CCOc1ccc2[nH]c(cc2c1)C 7a_100000073708_100000210202 [0,2,0,0,0,0|1,0,1]=4 3926 B14R2.6400 CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000210202 [0,2,0,0,0,0|2,0,0]=4 3927 B14R2.6400 CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000210202 [0,2,0,0,0,0|2,0,0]=4 3928 B14R2.6400 CCOc1ccc2cc([nH]c2c1)C 34a_100000058111_100000210202 [0,2,0,0,0,0|1,0,0]=3 3929 B14R2.6400 CCOc1ccc2cc(oc2c1)C 34a_100000095638_100000210202 [0,2,0,0,0,0|2,0,0]=4 3930 B14R2.6400 CCOc1ccc2cc(oc2c1)C 7a_100000095638_100000210202 [0,2,0,0,0,0|2,0,0]=4 3931 B14R2.6400 CCOc1ccc2nc(oc2c1)C 34a_100000116946_100000210202 [0,2,0,0,0,0|1,0,0]=3 3932 B14R2.6400 CCOc1ccc2nc(oc2c1)C 7a_100000116946_100000210202 [0,2,0,0,0,0|1,0,0]=3 3933 B14R2.6400 CCOc1ccc2nc(sc2c1)Br 7a_100010063415_100000210202 [0,2,0,0,0,0|1,0,0]=3 3934 B14R2.6400 CCOc1ccc2nc(sc2c1)C 34a_100000008955_100000210202 [0,2,0,0,0,0|1,0,0]=3 3935 B14R2.6400 CCOc1ccc2nc(sc2c1)C 7a_100000008955_100000210202 [0,2,0,0,0,0|1,0,0]=3 3936 B14R2.6400 CCOc1ccc2nc(sc2c1)N 7a_100000012012_100000210202 [0,2,0,0,0,0|1,0,0]=3 3937 B14R2.6400 CCOc1ccc2nn(cc2c1)C 34a_100000106843_100000210202 [0,2,0,0,0,0|2,0,0]=4 3938 B14R2.6400 CCOc1ccc2oc(nc2c1)C 34a_100000102623_100000210202 [0,2,0,0,0,0|1,0,1]=4 3939 B14R2.6400 CCOc1ccc2oc(nc2c1)C 7a_100000102623_100000210202 [0,2,0,0,0,0|1,0,1]=4 3940 B14R2.6400 CCOc1ccc2oc(nc2c1)Cl 34a_100010673232_100000210202 [0,2,0,0,0,0|1,0,1]=4 3941 B14R2.6400 CCOc1ccc2oc(nc2c1)Cl 7a_100010673232_100000210202 [0,2,0,0,0,0|1,0,1]=4 3942 B14R2.6400 CCOc1ccc2sc(nc2c1)C 34a_100000031546_100000210202 [0,2,0,0,0,0|1,0,1]=4 3943 B14R2.6400 CCOc1ccc2sc(nc2c1)C 7a_100000031546_100000210202 [0,2,0,0,0,0|1,0,1]=4 3944 B14R2.6400 CCOc1ccc2sc(nc2c1)N 7a_100000066538_100000210202 [0,2,0,0,0,0|1,0,1]=4 3945 B14R2.6400 CCSc1cc2[nH]c(nc2cn1)O 62a_100000210202_100010516660 [0,2,0,0,0,0|1,1,0]=4 3946 B14R2.6400 CCSc1ccc2[nH]c(=O)[nH]c2c1 62a_100000210202_200011356815 [0,2,0,0,0,0|0,1,1]=4 3947 B14R2.6400 CCSc1ccc2c(c1)NC(=O)C2 62a_100000210202_100000760487 [0,2,0,0,0,0|1,1,0]=4 3948 B14R2.6400 CCSc1ccc2cc([nH]c2c1)C 62a_100000210202_100010196937 [0,2,0,0,0,0|1,1,0]=4 3949 B14R2.6400 CCSc1ccc2nc([nH]c2c1)Cl 62a_100000210202_100010204286 [0,2,0,0,0,0|0,1,0]=3 3950 B14R2.6400 CCSc1ccc2nc([nH]c2n1)C 62a_100010074185_100000210202 [0,2,0,0,0,0|1,1,0]=4 3951 B14R2.6400 CCSc1ccc2nc(oc2c1)C 62a_100000210202_100010171164 [0,2,0,0,0,0|1,1,0]=4 3952 B14R2.6400 CCSc1ccc2nc(sc2c1)C 62a_100000210202_100009813144 [0,2,0,0,0,0|1,1,0]=4 3953 B14R2.6400 CCSc1ccc2nc(sc2c1)C 62a_100009813144_100000210202 [0,2,0,0,0,0|1,1,0]=4 3954 B14R2.6400 CCSc1ccc2nc(sc2c1)Cl 62a_100000210202_100010163703 [0,2,0,0,0,0|1,1,0]=4 3955 B14R2.6400 CCSc1ccc2nc(sc2c1)N 62a_100102524914_100000210202 [0,2,0,0,0,0|1,1,0]=4 3956 B14R2.6400 CCSc1cnc2nc([nH]c2c1)C 62a_100000210202_100000758206 [0,2,0,0,0,0|1,1,0]=4 3957 B14R2.6400 CNCc1ccc2[nH]c(=O)[nH]c2c1 207a_100102657272_100000709728 [0,2,0,0,0,0|1,0,1]=4 3958 B14R2.6400 CNCc1ccc2[nH]c(=O)[nH]c2c1 2230a_100000697230_200000210301 [0,2,0,0,0,0|1,0,1]=4 3959 B14R2.6400 CNCc1ccc2[nH]c(=O)[nH]c2c1 270004a_106832991635_100000709728 [0,2,0,0,0,0|1,0,1]=4 3960 B14R2.6400 CNCc1ccc2nc(oc2c1)C 207a_100102657272_100010272349 [0,2,0,0,0,0|2,0,0]=4 3961 B14R2.6400 CNCc1ccc2nc(oc2c1)C 270004a_106832991635_100010272349 [0,2,0,0,0,0|2,0,0]=4 3962 B14R2.6400 CNCc1ccc2nc(sc2c1)Br 26a_100102657272_100010063415 [0,2,0,0,0,0|2,0,0]=4 3963 B14R2.6400 CNCc1ccc2nc(sc2c1)Br 270004a_106832991635_200010272093 [0,2,0,0,0,0|2,0,0]=4 3964 B14R2.6400 COCc1ccc2nc(oc2c1)C 34a_100010326561_200000210301 [0,2,0,0,0,0|1,0,0]=3 3965 B14R2.6400 COCc1ccc2nc(oc2c1)C 7a_100010326561_200000210301 [0,2,0,0,0,0|1,0,0]=3 3966 B14R2.6400 COCc1ccc2nc(sc2c1)N 7a_100012180491_200000210301 [0,2,0,0,0,0|1,0,0]=3 3967 B14R2.6400 COCc1ccc2nn(cc2c1)C 34a_100000106857_200000210301 [0,2,0,0,0,0|2,0,0]=4 3968 B14R2.6400 COCc1ccc2oc(nc2c1)C 34a_200009878806_200000210301 [0,2,0,0,0,0|1,0,1]=4 3969 B14R2.6400 COCc1ccc2oc(nc2c1)C 7a_200009878806_200000210301 [0,2,0,0,0,0|1,0,1]=4 3970 B14R2.6400 Cc1cc2cc(ccc2[nH]1)OCF 34a_100000073708_100015361967 [0,2,0,0,0,0|1,0,1]=4 3971 B14R2.6400 Cc1cc2cc(ccc2[nH]1)OCF 7a_100000073708_100015361967 [0,2,0,0,0,0|1,0,1]=4 3972 B14R2.6400 Cc1cc2ccc(cc2[nH]1)OCF 34a_100000058111_100015361967 [0,2,0,0,0,0|1,0,0]=3 3973 B14R2.6400 Cc1cc2ccc(cc2[nH]1)SCF 62a_100015361967_100010196937 [0,2,0,0,0,0|1,1,0]=4 3974 B14R2.6400 Cc1cc2ccc(cc2o1)OCF 34a_100000095638_100015361967 [0,2,0,0,0,0|2,0,0]=4 3975 B14R2.6400 Cc1cc2ccc(cc2o1)OCF 7a_100000095638_100015361967 [0,2,0,0,0,0|2,0,0]=4 3976 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 34a_200009878806_200025704644 [0,2,0,0,0,0|1,0,1]=4 3977 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 7a_200009878806_200025704644 [0,2,0,0,0,0|1,0,1]=4 3978 B14R2.6400 Cc1nc2cc(ccc2o1)OCF 34a_100000102623_100015361967 [0,2,0,0,0,0|1,0,1]=4 3979 B14R2.6400 Cc1nc2cc(ccc2o1)OCF 7a_100000102623_100015361967 [0,2,0,0,0,0|1,0,1]=4 3980 B14R2.6400 Cc1nc2cc(ccc2s1)OCF 34a_100000031546_100015361967 [0,2,0,0,0,0|1,0,1]=4 3981 B14R2.6400 Cc1nc2cc(ccc2s1)OCF 7a_100000031546_100015361967 [0,2,0,0,0,0|1,0,1]=4 3982 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 34a_100010326561_200025704644 [0,2,0,0,0,0|1,0,0]=3 3983 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 7a_100010326561_200025704644 [0,2,0,0,0,0|1,0,0]=3 3984 B14R2.6400 Cc1nc2ccc(cc2o1)NCF 34a_100000736495_100015361967 [0,2,0,0,0,0|2,0,0]=4 3985 B14R2.6400 Cc1nc2ccc(cc2o1)OCF 34a_100000116946_100015361967 [0,2,0,0,0,0|1,0,0]=3 3986 B14R2.6400 Cc1nc2ccc(cc2o1)OCF 7a_100000116946_100015361967 [0,2,0,0,0,0|1,0,0]=3 3987 B14R2.6400 Cc1nc2ccc(cc2o1)SCF 62a_100015361967_100010171164 [0,2,0,0,0,0|1,1,0]=4 3988 B14R2.6400 Cc1nc2ccc(cc2s1)OCF 34a_100000008955_100015361967 [0,2,0,0,0,0|1,0,0]=3 3989 B14R2.6400 Cc1nc2ccc(cc2s1)OCF 7a_100000008955_100015361967 [0,2,0,0,0,0|1,0,0]=3 3990 B14R2.6400 Cc1nc2ccc(cc2s1)SCF 62a_100009813144_100015361967 [0,2,0,0,0,0|1,1,0]=4 3991 B14R2.6400 Cc1nc2ccc(cc2s1)SCF 62a_100015361967_100009813144 [0,2,0,0,0,0|1,1,0]=4 3992 B14R2.6400 Cc1nc2ccc(nc2[nH]1)SCF 62a_100010074185_100015361967 [0,2,0,0,0,0|1,1,0]=4 3993 B14R2.6400 Cc1nc2ncc(cc2[nH]1)SCF 62a_100015361967_100000758206 [0,2,0,0,0,0|1,1,0]=4 3994 B14R2.6400 Cn1cc2cc(ccc2n1)CO[13CH3] 34a_100000106857_200025704644 [0,2,0,0,0,0|2,0,0]=4 3995 B14R2.6400 Cn1cc2cc(ccc2n1)OCF 34a_100000106843_100015361967 [0,2,0,0,0,0|2,0,0]=4 3996 B14R2.6400 FCOc1ccc2nc(sc2c1)Br 7a_100010063415_100015361967 [0,2,0,0,0,0|1,0,0]=3 3997 B14R2.6400 FCOc1ccc2oc(nc2c1)Cl 34a_100010673232_100015361967 [0,2,0,0,0,0|1,0,1]=4 3998 B14R2.6400 FCOc1ccc2oc(nc2c1)Cl 7a_100010673232_100015361967 [0,2,0,0,0,0|1,0,1]=4 3999 B14R2.6400 FCSc1ccc2nc([nH]c2c1)Cl 62a_100015361967_100010204286 [0,2,0,0,0,0|0,1,0]=3 4000 B14R2.6400 FCSc1ccc2nc(sc2c1)Cl 62a_100015361967_100010163703 [0,2,0,0,0,0|1,1,0]=4 4001 B14R2.6400 Nc1nc2cc(ccc2s1)OCF 7a_100000066538_100015361967 [0,2,0,0,0,0|1,0,1]=4 4002 B14R2.6400 Nc1nc2ccc(cc2s1)OCF 7a_100000012012_100015361967 [0,2,0,0,0,0|1,0,0]=3 4003 B14R2.6400 Nc1nc2ccc(cc2s1)SCF 62a_100102524914_100015361967 [0,2,0,0,0,0|1,1,0]=4 4004 B14R2.6400 O=C1Cc2cc(ccc2O1)OCF 34a_100000035078_100015361967 [0,2,0,0,0,0|2,0,0]=4 4005 B14R2.6400 O=C1Cc2cc(ccc2O1)OCF 7a_100000035078_100015361967 [0,2,0,0,0,0|2,0,0]=4 4006 B14R2.6400 O=C1Cc2ccc(cc2N1)SCF 62a_100015361967_100000760487 [0,2,0,0,0,0|1,1,0]=4 4007 B14R2.6400 O=c1[nH]c2ccc(cc2[nH]1)SCF 62a_100015361967_200011356815 [0,2,0,0,0,0|0,1,1]=4 4008 B14R2.6400 O=c1[nH]c2ccc(cc2o1)OCF 7a_200000068749_100015361967 [0,2,0,0,0,0|1,0,1]=4 4009 B14R2.6400 Oc1nc2cnc(cc2[nH]1)SCF 62a_100015361967_100010516660 [0,2,0,0,0,0|1,1,0]=4 4010 B14R2.6400 [13CH3]NCc1ccc2[nH]c(=O)[nH]c2c1 2230a_100000697230_200025704644 [0,2,0,0,0,0|1,0,1]=4 4011 B14R2.6400 [13CH3]OCc1ccc2nc(sc2c1)N 7a_100012180491_200025704644 [0,2,0,0,0,0|1,0,0]=3 4012 B14R2.6412 CC=Cc1ccc2c(c[nH]c2c1)C 271570a_100016259895_100010209589 [0,2,0,0,0,0|2,0,0]=4 4013 B14R2.6412 CCOc1ccc2c(c1)ncn2C 34a_100000028553_100000210202 [0,2,0,0,0,0|0,0,2]=4 4014 B14R2.6412 CCSc1ccc2c(c[nH]c2c1)C 62a_100000210202_100010209589 [0,2,0,0,0,0|1,1,0]=4 4015 B14R2.6412 COCc1ccc2c(c1)ncn2C 34a_100000028697_200000210301 [0,2,0,0,0,0|0,0,2]=4 4016 B14R2.6412 Cc1c[nH]c2c1ccc(c2)SCF 62a_100015361967_100010209589 [0,2,0,0,0,0|1,1,0]=4 4017 B14R2.6412 Cn1cnc2c1ccc(c2)CO[13CH3] 34a_100000028697_200025704644 [0,2,0,0,0,0|0,0,2]=4 4018 B14R2.6412 Cn1cnc2c1ccc(c2)OCF 34a_100000028553_100015361967 [0,2,0,0,0,0|0,0,2]=4 4019 B14R2.82 C=Cc1cc2[nH]ccc2cc1OC 271570a_100011290941_100010245486 [0,2,0,0,0,0|1,0,1]=4 4020 B14R2.82 C=Cc1cc2cc[nH]c2cc1OC 271570a_100011290941_100010245498 [0,2,0,0,0,0|1,0,0]=3 4021 B14R2.82 C=Cc1cc2cc[nH]c2nc1OC 271570a_100011290941_100010168744 [0,2,0,0,0,0|2,0,0]=4 4022 B14R2.82 C=Cc1cc2nc[nH]c2cc1OC 271570a_100011290941_100010062394 [0,2,0,0,0,0|0,0,0]=2 4023 B14R2.82 COc1cc2[nH]ccc2cc1SC 62a_200000210301_100010245498 [0,2,0,0,0,0|1,0,0]=3 4024 B14R2.82 COc1cc2[nH]ccc2cc1S[13CH3] 62a_200025704644_100010245498 [0,2,0,0,0,0|1,0,0]=3 4025 B14R2.82 COc1cc2[nH]cnc2cc1SC 62a_200000210301_100010062394 [0,2,0,0,0,0|0,0,0]=2 4026 B14R2.82 COc1cc2[nH]cnc2cc1S[13CH3] 62a_200025704644_100010062394 [0,2,0,0,0,0|0,0,0]=2 4027 B14R2.82 COc1cc2cc[nH]c2cc1SC 62a_200000210301_100010245486 [0,2,0,0,0,0|1,0,1]=4 4028 B14R2.82 COc1cc2cc[nH]c2cc1S[13CH3] 62a_200025704644_100010245486 [0,2,0,0,0,0|1,0,1]=4 4029 B14R2.82 COc1nc2[nH]ccc2cc1SC 62a_200000210301_100010168744 [0,2,0,0,0,0|2,0,0]=4 4030 B14R2.82 COc1nc2[nH]ccc2cc1S[13CH3] 62a_200025704644_100010168744 [0,2,0,0,0,0|2,0,0]=4 4031 B14R2.1197 COc1cc2cn(nc2cc1Br)C 34a_100010742938_200000210301 [0,2,0,0,0,0|2,0,0]=4 4032 B14R2.1197 COc1cc2cn(nc2cc1Br)C 7a_100010742938_200000210301 [0,2,0,0,0,0|2,0,0]=4 4033 B14R2.1197 CSc1cc2[nH]c(=O)[nH]c2cc1C 62a_200000210301_100010107294 [0,2,0,0,0,0|0,1,1]=4 4034 B14R2.1197 CSc1cc2c(cc1F)CC(=O)N2 62a_200000210301_200010218348 [0,2,0,0,0,0|1,1,0]=4 4035 B14R2.1197 CSc1cc2sc(nc2cc1C)C 62a_200000210301_200010762721 [0,2,0,0,0,0|1,1,0]=4 4036 B14R2.1197 CSc1cc2sc(nc2cc1C)C 62a_200010762721_200000210301 [0,2,0,0,0,0|1,1,0]=4 4037 B14R2.1197 Cc1cc2[nH]c(=O)[nH]c2cc1S[13CH3] 62a_200025704644_100010107294 [0,2,0,0,0,0|0,1,1]=4 4038 B14R2.1197 Cc1nc2cc(c(cc2s1)S[13CH3])C 62a_200010762721_200025704644 [0,2,0,0,0,0|1,1,0]=4 4039 B14R2.1197 Cc1nc2cc(c(cc2s1)S[13CH3])C 62a_200025704644_200010762721 [0,2,0,0,0,0|1,1,0]=4 4040 B14R2.1197 Cn1cc2cc(c(cc2n1)Br)O[13CH3] 34a_100010742938_200025704644 [0,2,0,0,0,0|2,0,0]=4 4041 B14R2.1197 Cn1cc2cc(c(cc2n1)Br)O[13CH3] 7a_100010742938_200025704644 [0,2,0,0,0,0|2,0,0]=4 4042 B14R2.1197 [13CH3]Sc1cc2c(cc1F)CC(=O)N2 62a_200025704644_200010218348 [0,2,0,0,0,0|1,1,0]=4 4043 B14R2.11787 CNc1cc2[nH]cnc2c(c1C)C 34a_200015187713_200000210301 [0,2,0,0,0,0|1,0,0]=3 4044 B14R2.11787 Cc1c(cc2[nH]cnc2c1C)N[13CH3] 34a_200015187713_200025704644 [0,2,0,0,0,0|1,0,0]=3 4045 B14R2.1101 C=Cc1cc(cc2c1cc[nH]2)OC 271570a_100011290941_100010006585 [0,2,0,0,0,0|1,0,0]=3 4046 B14R2.1101 C=Cc1cc(cc2c1cn[nH]2)OC 271570a_100011290941_100010188275 [0,2,0,0,0,0|2,0,0]=4 4047 B14R2.1101 C=Cc1cc(cc2c1nc[nH]2)C#N 271570a_100011290941_100010718406 [0,2,0,0,0,0|2,0,0]=4 4048 B14R2.1101 C=Cc1cc(cc2c1nc[nH]2)OC 271570a_100011290941_100102526192 [0,2,0,0,0,0|0,0,0]=2 4049 B14R2.1101 COc1cc(c2cc[nH]c2c1)SC 62a_200000210301_100010006585 [0,2,0,0,0,0|1,0,0]=3 4050 B14R2.1101 COc1cc(c2cc[nH]c2c1)S[13CH3] 62a_200025704644_100010006585 [0,2,0,0,0,0|1,0,0]=3 4051 B14R2.1101 COc1cc(c2cn[nH]c2c1)SC 62a_200000210301_100010188275 [0,2,0,0,0,0|2,0,0]=4 4052 B14R2.1101 COc1cc(c2cn[nH]c2c1)S[13CH3] 62a_200025704644_100010188275 [0,2,0,0,0,0|2,0,0]=4 4053 B14R2.1101 COc1cc(c2nc[nH]c2c1)SC 62a_200000210301_100102526192 [0,2,0,0,0,0|0,0,0]=2 4054 B14R2.1101 COc1cc(c2nc[nH]c2c1)S[13CH3] 62a_200025704644_100102526192 [0,2,0,0,0,0|0,0,0]=2 4055 B14R2.1101 COc1cc(cc2c1cc[nH]2)SC 62a_200000210301_100010006603 [0,2,0,0,0,0|1,1,0]=4 4056 B14R2.1101 COc1cc(cc2c1cc[nH]2)S[13CH3] 62a_200025704644_100010006603 [0,2,0,0,0,0|1,1,0]=4 4057 B14R2.1101 CSc1cc(cc2c1nc[nH]2)C#N 62a_200000210301_100010718406 [0,2,0,0,0,0|2,0,0]=4 4058 B14R2.1101 [13CH3]Sc1cc(cc2c1nc[nH]2)C#N 62a_200025704644_100010718406 [0,2,0,0,0,0|2,0,0]=4 4059 B14R2.2301 COc1cc(c2sc(nc2c1)N)O 271570a_203496583355_200160480953 [0,2,0,0,0,0|1,0,1]=4 4060 B14R2.2301 CSc1cc(c2nc(sc2c1)C)F 62a_100000719245_200000210301 [0,2,0,0,0,0|1,1,0]=4 4061 B14R2.2301 CSc1cc(c2nc(sc2c1)C)F 62a_200000210301_100000719245 [0,2,0,0,0,0|1,1,0]=4 4062 B14R2.2301 CSc1cc(c2nc(sc2c1)N)F 62a_100011246640_200000210301 [0,2,0,0,0,0|1,1,0]=4 4063 B14R2.2301 Cc1nc2c(cc(cc2s1)S[13CH3])F 62a_100000719245_200025704644 [0,2,0,0,0,0|1,1,0]=4 4064 B14R2.2301 Cc1nc2c(cc(cc2s1)S[13CH3])F 62a_200025704644_100000719245 [0,2,0,0,0,0|1,1,0]=4 4065 B14R2.2301 [13CH3]Sc1cc(c2nc(sc2c1)N)F 62a_100011246640_200025704644 [0,2,0,0,0,0|1,1,0]=4 4066 B14R2.36882 COc1cc(c2c(n[nH]c2c1)O)C 271570a_203496583355_100000049625 [0,2,0,0,0,0|2,0,0]=4 4067 B14R2.1812 COc1ccc2c(nn(c2c1)C)N 34a_200000117609_200000210301 [0,2,0,0,0,0|2,0,0]=4 4068 B14R2.1812 COc1ccc2c(nn(c2c1)C)O 271570a_203496583355_200010989029 [0,2,0,0,0,0|2,0,0]=4 4069 B14R2.1812 Cn1nc(c2c1cc(cc2)O[13CH3])N 34a_200000117609_200025704644 [0,2,0,0,0,0|2,0,0]=4 4070 B14R2.2497 COc1ccc2[nH]cc(c2c1)C#N 7a_100000059741_200000210301 [0,2,0,0,0,0|1,0,1]=4 4071 B14R2.2497 [13CH3]Oc1ccc2[nH]cc(c2c1)C#N 7a_100000059741_200025704644 [0,2,0,0,0,0|1,0,1]=4 4072 B14R2.3274 C=Cc1ccc2nc(n(c2c1)C)C 271570a_100011290941_200010218347 [0,2,0,0,0,0|1,0,1]=4 4073 B14R2.3274 CN1C(=O)Cc2c1cc(cc2)S[13CH3] 62a_200025704644_100010285470 [0,2,0,0,0,0|1,1,0]=4 4074 B14R2.3274 CSc1ccc2c(c1)N(C(=O)C2)C 62a_200000210301_100010285470 [0,2,0,0,0,0|1,1,0]=4 4075 B14R2.3274 CSc1ccc2nc(n(c2c1)C)C 62a_200000210301_200010218347 [0,2,0,0,0,0|0,1,0]=3 4076 B14R2.3274 CSc1ccc2nc(n(c2c1)C)C 62a_200010218347_200000210301 [0,2,0,0,0,0|0,1,0]=3 4077 B14R2.3274 Cc1nc2ccc(cc2n1C)S[13CH3] 62a_200010218347_200025704644 [0,2,0,0,0,0|0,1,0]=3 4078 B14R2.3274 Cc1nc2ccc(cc2n1C)S[13CH3] 62a_200025704644_200010218347 [0,2,0,0,0,0|0,1,0]=3 4079 B14R2.1815 CC1C(=O)Nc2c1ccc(c2)S[13CH3] 62a_200025704644_100010201481 [0,2,0,0,0,0|1,1,0]=4 4080 B14R2.1815 COc1ccc2c(c1)cc(n2C)C 34a_100000079728_200000210301 [0,2,0,0,0,0|1,0,1]=4 4081 B14R2.1815 COc1ccc2c(c1)cc(n2C)C 7a_100000079728_200000210301 [0,2,0,0,0,0|1,0,1]=4 4082 B14R2.1815 CSc1ccc2c(c1)NC(=O)C2=O 62a_100000239657_200000210301 [0,2,0,0,0,0|1,1,0]=4 4083 B14R2.1815 CSc1ccc2c(c1)NC(=O)C2=O 62a_200000210301_100000049690 [0,2,0,0,0,0|1,1,0]=4 4084 B14R2.1815 CSc1ccc2c(c1)NC(=O)C2C 62a_200000210301_100010201481 [0,2,0,0,0,0|1,1,0]=4 4085 B14R2.1815 Cc1cc2cc(ccc2n1C)O[13CH3] 34a_100000079728_200025704644 [0,2,0,0,0,0|1,0,1]=4 4086 B14R2.1815 Cc1cc2cc(ccc2n1C)O[13CH3] 7a_100000079728_200025704644 [0,2,0,0,0,0|1,0,1]=4 4087 B14R2.1815 [13CH3]Sc1ccc2c(c1)NC(=O)C2=O 62a_100000239657_200025704644 [0,2,0,0,0,0|1,1,0]=4 4088 B14R2.1815 [13CH3]Sc1ccc2c(c1)NC(=O)C2=O 62a_200025704644_100000049690 [0,2,0,0,0,0|1,1,0]=4 4089 B14R2.3304 C=Cc1ccc2nc([nH]c2c1)C=O 271570a_100011290941_200011361486 [0,2,0,0,0,0|1,0,1]=4 4090 B14R2.3304 C=Cc1nc2ccc(cc2s1)OC 271570a_100011290941_100010195960 [0,2,0,0,0,0|1,0,0]=3 4091 B14R2.3304 CNc1ccc2nc(sc2c1)C#N 7a_100000070184_200000210301 [0,2,0,0,0,0|2,0,0]=4 4092 B14R2.3304 CNc1nc2ccc(cc2s1)OC 27a_100102657272_100010195960 [0,2,0,0,0,0|1,0,0]=3 4093 B14R2.3304 CNc1nc2ccc(cc2s1)SC 62a_100012351673_200000210301 [0,2,0,0,0,0|1,1,0]=4 4094 B14R2.3304 CNc1nc2ccc(cc2s1)S[13CH3] 62a_100012351673_200025704644 [0,2,0,0,0,0|1,1,0]=4 4095 B14R2.3304 COc1ccc2nc(sc2c1)C#N 7a_100000075907_200000210301 [0,2,0,0,0,0|1,0,0]=3 4096 B14R2.3304 COc1ccc2nc(sc2c1)SC 62a_200000210301_100010195960 [0,2,0,0,0,0|1,0,0]=3 4097 B14R2.3304 COc1ccc2nc(sc2c1)SC 7a_100009853011_200000210301 [0,2,0,0,0,0|1,0,0]=3 4098 B14R2.3304 COc1ccc2nc(sc2c1)S[13CH3] 62a_200025704644_100010195960 [0,2,0,0,0,0|1,0,0]=3 4099 B14R2.3304 CSc1ccc2cc([nH]c2c1)C#N 62a_200000210301_100010739539 [0,2,0,0,0,0|1,1,0]=4 4100 B14R2.3304 CSc1ccc2cc([nH]c2c1)C=O 62a_200000210301_100000736022 [0,2,0,0,0,0|1,1,0]=4 4101 B14R2.3304 CSc1ccc2cc([nH]c2c1)CO 62a_200000210301_100000735881 [0,2,0,0,0,0|1,1,0]=4 4102 B14R2.3304 CSc1ccc2nc(sc2c1)NN 62a_100009816745_200000210301 [0,2,0,0,0,0|1,1,0]=4 4103 B14R2.3304 CSc1ccc2nc(sc2c1)SC 62a_200000210301_100010193624 [0,2,0,0,0,0|1,1,0]=4 4104 B14R2.3304 CSc1cnc2nc([nH]c2c1)CO 62a_100000757314_200000210301 [0,2,0,0,0,0|1,1,0]=4 4105 B14R2.3304 CSc1cnc2nc([nH]c2c1)CO 62a_200000210301_100000757314 [0,2,0,0,0,0|1,1,0]=4 4106 B14R2.3304 CSc1nc2ccc(cc2s1)O[13CH3] 7a_100009853011_200025704644 [0,2,0,0,0,0|1,0,0]=3 4107 B14R2.3304 CSc1nc2ccc(cc2s1)S[13CH3] 62a_200025704644_100010193624 [0,2,0,0,0,0|1,1,0]=4 4108 B14R2.3304 [13CH3]Nc1ccc2nc(sc2c1)C#N 7a_100000070184_200025704644 [0,2,0,0,0,0|2,0,0]=4 4109 B14R2.3304 [13CH3]Oc1ccc2nc(sc2c1)C#N 7a_100000075907_200025704644 [0,2,0,0,0,0|1,0,0]=3 4110 B14R2.3304 [13CH3]Sc1ccc2cc([nH]c2c1)C#N 62a_200025704644_100010739539 [0,2,0,0,0,0|1,1,0]=4 4111 B14R2.3304 [13CH3]Sc1ccc2cc([nH]c2c1)C=O 62a_200025704644_100000736022 [0,2,0,0,0,0|1,1,0]=4 4112 B14R2.3304 [13CH3]Sc1ccc2cc([nH]c2c1)CO 62a_200025704644_100000735881 [0,2,0,0,0,0|1,1,0]=4 4113 B14R2.3304 [13CH3]Sc1ccc2nc(sc2c1)NN 62a_100009816745_200025704644 [0,2,0,0,0,0|1,1,0]=4 4114 B14R2.3304 [13CH3]Sc1cnc2nc([nH]c2c1)CO 62a_100000757314_200025704644 [0,2,0,0,0,0|1,1,0]=4 4115 B14R2.3304 [13CH3]Sc1cnc2nc([nH]c2c1)CO 62a_200025704644_100000757314 [0,2,0,0,0,0|1,1,0]=4 4116 B14R2.152 C=Cc1c[nH]c2c1cnc(c2)OC 271570a_100011290941_200010168631 [0,2,0,0,0,0|2,0,0]=4 4117 B14R2.152 C=Cc1c[nH]c2c1ncc(c2)OC 271570a_100011290941_200010168573 [0,2,0,0,0,0|2,0,0]=4 4118 B14R2.152 C=Cc1n[nH]c2c1ccc(c2)OC 271570a_100011290941_100000049672 [0,2,0,0,0,0|2,0,0]=4 4119 B14R2.152 COc1cc2[nH]cc(c2cn1)SC 62a_200000210301_200010168631 [0,2,0,0,0,0|2,0,0]=4 4120 B14R2.152 COc1cc2[nH]cc(c2cn1)S[13CH3] 62a_200025704644_200010168631 [0,2,0,0,0,0|2,0,0]=4 4121 B14R2.152 COc1ccc2c(n[nH]c2c1)SC 62a_200000210301_100000049672 [0,2,0,0,0,0|2,0,0]=4 4122 B14R2.152 COc1ccc2c(n[nH]c2c1)S[13CH3] 62a_200025704644_100000049672 [0,2,0,0,0,0|2,0,0]=4 4123 B14R2.152 COc1cnc2c(c[nH]c2c1)SC 62a_200000210301_200010168573 [0,2,0,0,0,0|2,0,0]=4 4124 B14R2.152 COc1cnc2c(c[nH]c2c1)S[13CH3] 62a_200025704644_200010168573 [0,2,0,0,0,0|2,0,0]=4 4125 B14R2.152 CSc1ccc2c(c[nH]c2c1)C#N 62a_200000210301_100012359395 [0,2,0,0,0,0|1,1,0]=4 4126 B14R2.152 CSc1ccc2c(c[nH]c2c1)C=O 62a_200000210301_100011361519 [0,2,0,0,0,0|1,1,0]=4 4127 B14R2.152 [13CH3]Sc1ccc2c(c[nH]c2c1)C#N 62a_200025704644_100012359395 [0,2,0,0,0,0|1,1,0]=4 4128 B14R2.152 [13CH3]Sc1ccc2c(c[nH]c2c1)C=O 62a_200025704644_100011361519 [0,2,0,0,0,0|1,1,0]=4 4129 B12R2.1 C=Cc1ncn2c1cccc2 271570a_100011290941_100000688344 [0,0,1,1,0,0|1,0,1]=4 4130 B12R2.6 O=C1C=C(CC1)c2c[nH]cn2 271570a_100010737933_100000756875 [0,0,1,1,0,0|2,0,0]=4 4131 B12R2.10 Cc1[nH]cnc1C2=CCOC2 271570a_100009872500_100009816806 [0,0,1,1,0,0|0,0,2]=4 4132 B12R2.10 Cc1[nH]cnc1c2ccoc2 271570a_100011218838_100009816806 [0,0,1,1,0,0|0,0,2]=4 4133 B12R2.315 C=Cc1cccc2c1nc[nH]2 271570a_100011290941_100011935113 [0,0,1,1,0,0|1,0,1]=4 4134 B12R2.315 CNc1cccc2c1nco2 34a_100000717946_200000210301 [0,0,1,1,0,0|2,0,0]=4 4135 B12R2.315 CNc1ccnc2c1nc[nH]2 27a_100102657272_100009820729 [0,0,1,1,0,0|2,0,0]=4 4136 B12R2.315 COc1cccc2c1CCN2 34a_100000703684_200000210301 [0,0,1,1,0,0|1,0,1]=4 4137 B12R2.315 COc1cccc2c1cc[nH]2 34a_100000763377_200000210301 [0,0,1,1,0,0|1,0,0]=3 4138 B12R2.315 COc1cccc2c1ccs2 34a_100000077759_200000210301 [0,0,1,1,0,0|2,0,0]=4 4139 B12R2.315 COc1cccc2c1ccs2 7a_100000077759_200000210301 [0,0,1,1,0,0|2,0,0]=4 4140 B12R2.315 COc1cccc2c1ncs2 34a_100000101385_200000210301 [0,0,1,1,0,0|1,0,0]=3 4141 B12R2.315 COc1cccc2c1ncs2 7a_100000101385_200000210301 [0,0,1,1,0,0|1,0,0]=3 4142 B12R2.315 COc1cccn2c1ncc2 34a_100000068405_200000210301 [0,0,1,1,0,0|2,0,0]=4 4143 B12R2.315 COc1cccn2c1ncc2 7a_100000068405_200000210301 [0,0,1,1,0,0|2,0,0]=4 4144 B12R2.315 CSc1cccc2c1cc[nH]2 62a_200000210301_100000685724 [0,0,1,1,0,0|1,1,0]=4 4145 B12R2.315 CSc1cccc2c1nc[nH]2 62a_200000210301_100011935113 [0,0,1,1,0,0|0,1,0]=3 4146 B12R2.315 CSc1cccc2c1nco2 62a_200000210301_100009816834 [0,0,1,1,0,0|1,1,0]=4 4147 B12R2.315 CSc1cccc2c1ncs2 62a_200000210301_100000726125 [0,0,1,1,0,0|1,1,0]=4 4148 B12R2.315 CSc1ccnc2c1nc[nH]2 62a_200000210301_100009820729 [0,0,1,1,0,0|1,1,0]=4 4149 B12R2.315 CSc1nccc2c1nc[nH]2 62a_200000210301_100009820035 [0,0,1,1,0,0|1,1,0]=4 4150 B12R2.315 [13CH3]Nc1cccc2c1nco2 34a_100000717946_200025704644 [0,0,1,1,0,0|2,0,0]=4 4151 B12R2.315 [13CH3]Oc1cccc2c1CCN2 34a_100000703684_200025704644 [0,0,1,1,0,0|1,0,1]=4 4152 B12R2.315 [13CH3]Oc1cccc2c1cc[nH]2 34a_100000763377_200025704644 [0,0,1,1,0,0|1,0,0]=3 4153 B12R2.315 [13CH3]Oc1cccc2c1ccs2 34a_100000077759_200025704644 [0,0,1,1,0,0|2,0,0]=4 4154 B12R2.315 [13CH3]Oc1cccc2c1ccs2 7a_100000077759_200025704644 [0,0,1,1,0,0|2,0,0]=4 4155 B12R2.315 [13CH3]Oc1cccc2c1ncs2 34a_100000101385_200025704644 [0,0,1,1,0,0|1,0,0]=3 4156 B12R2.315 [13CH3]Oc1cccc2c1ncs2 7a_100000101385_200025704644 [0,0,1,1,0,0|1,0,0]=3 4157 B12R2.315 [13CH3]Oc1cccn2c1ncc2 34a_100000068405_200025704644 [0,0,1,1,0,0|2,0,0]=4 4158 B12R2.315 [13CH3]Oc1cccn2c1ncc2 7a_100000068405_200025704644 [0,0,1,1,0,0|2,0,0]=4 4159 B12R2.315 [13CH3]Sc1cccc2c1cc[nH]2 62a_200025704644_100000685724 [0,0,1,1,0,0|1,1,0]=4 4160 B12R2.315 [13CH3]Sc1cccc2c1nc[nH]2 62a_200025704644_100011935113 [0,0,1,1,0,0|0,1,0]=3 4161 B12R2.315 [13CH3]Sc1cccc2c1nco2 62a_200025704644_100009816834 [0,0,1,1,0,0|1,1,0]=4 4162 B12R2.315 [13CH3]Sc1cccc2c1ncs2 62a_200025704644_100000726125 [0,0,1,1,0,0|1,1,0]=4 4163 B12R2.315 [13CH3]Sc1ccnc2c1nc[nH]2 62a_200025704644_100009820729 [0,0,1,1,0,0|1,1,0]=4 4164 B12R2.315 [13CH3]Sc1nccc2c1nc[nH]2 62a_200025704644_100009820035 [0,0,1,1,0,0|1,1,0]=4 4165 B14R3.3015 c1cc2ccc(cc2[nH]1)C3CC3 271570a_100011220607_100000743809 [0,1,0,1,0,0|2,0,0]=4 4166 B14R3.3015 c1cc2nn[nH]c2cc1C3CC3 271570a_100011220607_100009817464 [0,1,0,1,0,0|2,0,0]=4 4167 B14R3.3015 c1nc2ccc(cc2o1)C3CC3 271570a_100011220607_100009817590 [0,1,0,1,0,0|2,0,0]=4 4168 B14R3.3015 c1nc2ccc(cc2s1)C3CC3 271570a_100011220607_100009816678 [0,1,0,1,0,0|2,0,0]=4 4169 B14R3.3015 c1nc2ccc(nc2[nH]1)C3CC3 271570a_100011220607_100000077665 [0,1,0,1,0,0|2,0,0]=4 4170 B14R3.3015 c1nc2ncc(cc2[nH]1)C3CC3 271570a_100011220607_100000760087 [0,1,0,1,0,0|2,0,0]=4 4171 B10R1.149 COC(=O)c1[nH]cnc1O 271570a_203496583355_100010290838 [0,0,1,0,1,0|2,0,0]=4 4172 B10R2.31 Oc1ccc2c(c1)CC2 271570a_203496583355_100009818592 [1,0,0,0,1,0|1,0,1]=4 4173 B12R1.267 COCC=Cc1ncc[nH]c1=O 271570a_100016286323_100000763361 [0,0,1,0,0,1|1,0,1]=4 4174 B12R2.24 Oc1cc2nccnc2cn1 271570a_203496583355_100010370699 [1,0,0,0,0,1|1,0,1]=4 4175 B12R2.24 Oc1ccc2c(c1)CNCC2 271570a_203496583355_100015189961 [1,0,0,0,0,1|1,0,1]=4 4176 B12R2.24 Oc1ccc2c(c1)NCCC2 271570a_203496583355_100010196366 [1,0,0,0,0,1|1,0,1]=4 4177 B12R2.24 Oc1ccc2c(c1)NCCO2 271570a_203496583355_100000708519 [1,0,0,0,0,1|1,0,1]=4 4178 B12R2.24 Oc1ccc2c(c1)NCCS2 271570a_203496583355_100013243616 [1,0,0,0,0,1|1,0,1]=4 4179 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [1,0,0,0,0,1|2,0,0]=4 4180 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [1,0,0,0,0,1|1,0,1]=4 4181 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [1,0,0,0,0,1|1,0,1]=4 4182 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [1,0,0,0,0,1|1,0,0]=3 4183 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [1,0,0,0,0,1|0,0,1]=3 4184 B12R2.24 Oc1ccc2cnncc2c1 271570a_203496583355_100010198781 [1,0,0,0,0,1|2,0,0]=4 4185 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [1,0,0,0,0,1|1,0,0]=3 4186 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [1,0,0,0,0,1|2,0,0]=4 4187 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [1,0,0,0,0,1|0,0,1]=3 4188 B12R2.24 Oc1ccc2nccnc2n1 271570a_203496583355_100012351543 [1,0,0,0,0,1|1,0,1]=4 4189 B12R2.24 Oc1ccc2ncncc2c1 271570a_203496583355_100009989443 [1,0,0,0,0,1|0,0,1]=3 4190 B12R2.24 Oc1ccc2nnccc2c1 271570a_203496583355_100010209549 [1,0,0,0,0,1|1,0,0]=3 4191 B12R2.24 Oc1cnc2nccnc2c1 271570a_203496583355_100000753224 [1,0,0,0,0,1|1,0,1]=4