0 B15R2.15371 Cc1cccc(c1C=C2CCCC2)Cl 271570a_100010378317_100000043165 [0,0,0,0,0,0|3,0,1]=4 1 B15R2.15371 Cc1cccc(c1CN2CCCC2)Cl 270004a_100000188435_100000041122 [0,0,0,0,0,0|4,0,0]=4 2 B15R2.15371 Cc1cccc(c1Sc2ncc[nH]2)Cl 62a_100000043165_100025796157 [0,0,0,0,0,0|2,0,2]=4 3 B15R2.15371 Cc1cccc(c1Sc2ncc[nH]2)Cl 62a_100025796157_100000043165 [0,0,0,0,0,0|2,0,2]=4 4 B15R2.15371 Clc1cccc(c1C=C2CCCC2)Br 271570a_100010378317_100010214488 [0,0,0,0,0,0|2,1,1]=4 5 B15R2.15371 Clc1cccc(c1C=C2CCCC2)Cl 271570a_100010378317_100000034237 [0,0,0,0,0,0|2,0,1]=3 6 B15R2.15371 Clc1cccc(c1CN2CCCC2)Br 2230a_100000188435_100010138402 [0,0,0,0,0,0|3,1,0]=4 7 B15R2.15371 Clc1cccc(c1CN2CCCC2)Br 269982a_100000188435_100010138402 [0,0,0,0,0,0|3,1,0]=4 8 B15R2.15371 Clc1cccc(c1CN2CCCC2)Br 26a_100000188435_100010214474 [0,0,0,0,0,0|3,1,0]=4 9 B15R2.15371 Clc1cccc(c1CN2CCCC2)Br 270004a_100000188435_100011249081 [0,0,0,0,0,0|3,1,0]=4 10 B15R2.15371 Clc1cccc(c1CN2CCCC2)Cl 2230a_100000188435_100000187851 [0,0,0,0,0,0|3,0,0]=3 11 B15R2.15371 Clc1cccc(c1CN2CCCC2)Cl 269982a_100000188435_100000211241 [0,0,0,0,0,0|3,0,0]=3 12 B15R2.15371 Clc1cccc(c1CN2CCCC2)Cl 26a_100000188435_100000211709 [0,0,0,0,0,0|3,0,0]=3 13 B15R2.15371 Clc1cccc(c1CN2CCCC2)Cl 270004a_100000188435_100000189306 [0,0,0,0,0,0|3,0,0]=3 14 B15R2.15371 Clc1cccc(c1CN2CCCC2)I 270004a_100000188435_100010147682 [0,0,0,0,0,0|3,1,0]=4 15 B15R2.15371 Clc1cccc(c1CN2CCSC2)Cl 2230a_100011215254_100000187851 [0,0,0,0,0,0|4,0,0]=4 16 B15R2.15371 Clc1cccc(c1CN2CCSC2)Cl 269982a_100011215254_100000211241 [0,0,0,0,0,0|4,0,0]=4 17 B15R2.15371 Clc1cccc(c1CN2CCSC2)Cl 26a_100011215254_100000211709 [0,0,0,0,0,0|4,0,0]=4 18 B15R2.15371 Clc1cccc(c1CN2CCSC2)Cl 270004a_100011215254_100000189306 [0,0,0,0,0,0|4,0,0]=4 19 B15R2.15371 Clc1cccc(c1NC2CCCC2)Cl 34a_100000210028_100000179811 [0,0,0,0,0,0|3,0,1]=4 20 B15R2.15371 Clc1cccc(c1Nc2ncns2)Cl 27a_100000210028_100000693119 [0,0,0,0,0,0|3,0,1]=4 21 B15R2.15371 Clc1cccc(c1Nc2nncs2)Cl 27a_100000210028_100000739804 [0,0,0,0,0,0|3,0,1]=4 22 B15R2.15371 Clc1cccc(c1OC2CCCC2)Cl 34a_100000211709_100000179811 [0,0,0,0,0,0|3,0,1]=4 23 B15R2.15371 Clc1cccc(c1OC2CCCC2)Cl 7a_100000211709_100000179811 [0,0,0,0,0,0|3,0,1]=4 24 B15R2.15371 Clc1cccc(c1SC2CCCC2)Cl 62a_100000034237_100000179811 [0,0,0,0,0,0|3,0,1]=4 25 B15R2.15371 Clc1cccc(c1SC2CCCC2)Cl 62a_100011217020_100000034237 [0,0,0,0,0,0|3,0,1]=4 26 B15R2.15371 Clc1cccc(c1Sc2c[nH]cn2)Cl 62a_100000034237_100000756875 [0,0,0,0,0,0|3,0,1]=4 27 B15R2.15371 Clc1cccc(c1Sc2c[nH]cn2)Cl 62a_100000756875_100000034237 [0,0,0,0,0,0|3,0,1]=4 28 B15R2.15371 Clc1cccc(c1Sc2c[nH]nn2)Cl 62a_100000034237_100009819707 [0,0,0,0,0,0|4,0,0]=4 29 B15R2.15371 Clc1cccc(c1Sc2c[nH]nn2)Cl 62a_100009819707_100000034237 [0,0,0,0,0,0|4,0,0]=4 30 B15R2.15371 Clc1cccc(c1Sc2cc[nH]n2)Cl 62a_100000034237_100000062575 [0,0,0,0,0,0|3,0,1]=4 31 B15R2.15371 Clc1cccc(c1Sc2cc[nH]n2)Cl 62a_100000062575_100000034237 [0,0,0,0,0,0|3,0,1]=4 32 B15R2.15371 Clc1cccc(c1Sc2ccon2)Cl 62a_100000034237_100009818083 [0,0,0,0,0,0|3,0,1]=4 33 B15R2.15371 Clc1cccc(c1Sc2ccon2)Cl 62a_100009818083_100000034237 [0,0,0,0,0,0|3,0,1]=4 34 B15R2.15371 Clc1cccc(c1Sc2ccsn2)Cl 62a_100000034237_100009818082 [0,0,0,0,0,0|3,0,1]=4 35 B15R2.15371 Clc1cccc(c1Sc2ccsn2)Cl 62a_100009818082_100000034237 [0,0,0,0,0,0|3,0,1]=4 36 B15R2.15371 Clc1cccc(c1Sc2cscn2)Cl 62a_100000034237_100000751502 [0,0,0,0,0,0|3,0,1]=4 37 B15R2.15371 Clc1cccc(c1Sc2cscn2)Cl 62a_100000751502_100000034237 [0,0,0,0,0,0|3,0,1]=4 38 B15R2.15371 Clc1cccc(c1Sc2nc[nH]n2)Cl 62a_100000034237_100000761765 [0,0,0,0,0,0|2,0,2]=4 39 B15R2.15371 Clc1cccc(c1Sc2nc[nH]n2)Cl 62a_100000761765_100000034237 [0,0,0,0,0,0|2,0,2]=4 40 B15R2.15371 Clc1cccc(c1Sc2ncc[nH]2)Br 62a_100010214488_100025796157 [0,0,0,0,0,0|1,1,2]=4 41 B15R2.15371 Clc1cccc(c1Sc2ncc[nH]2)Br 62a_100025796157_100010214488 [0,0,0,0,0,0|1,1,2]=4 42 B15R2.15371 Clc1cccc(c1Sc2ncc[nH]2)Cl 62a_100000034237_100025796157 [0,0,0,0,0,0|1,0,2]=3 43 B15R2.15371 Clc1cccc(c1Sc2ncc[nH]2)Cl 62a_100025796157_100000034237 [0,0,0,0,0,0|1,0,2]=3 44 B15R2.15371 Clc1cccc(c1Sc2ncco2)Cl 62a_100000034237_100011787736 [0,0,0,0,0,0|2,0,2]=4 45 B15R2.15371 Clc1cccc(c1Sc2ncco2)Cl 62a_100011787736_100000034237 [0,0,0,0,0,0|2,0,2]=4 46 B15R2.15371 Clc1cccc(c1Sc2nccs2)Cl 62a_100000034237_100000211983 [0,0,0,0,0,0|2,0,2]=4 47 B15R2.15371 Clc1cccc(c1Sc2nccs2)Cl 62a_100000211983_100000034237 [0,0,0,0,0,0|2,0,2]=4 48 B15R2.15371 Clc1cccc(c1Sc2ncns2)Cl 62a_100000034237_100000693119 [0,0,0,0,0,0|3,0,1]=4 49 B15R2.15371 Clc1cccc(c1Sc2ncns2)Cl 62a_100000693119_100000034237 [0,0,0,0,0,0|3,0,1]=4 50 B15R2.15371 Clc1cccc(c1Sc2nncs2)Cl 62a_100000034237_100000739804 [0,0,0,0,0,0|3,0,1]=4 51 B15R2.15371 Clc1cccc(c1Sc2nncs2)Cl 62a_100000739804_100000034237 [0,0,0,0,0,0|3,0,1]=4 52 B15R2.15371 Clc1ccnc(c1Sc2ncc[nH]2)Cl 62a_100000050019_100025796157 [0,0,0,0,0,0|2,0,2]=4 53 B15R2.15371 Clc1ccnc(c1Sc2ncc[nH]2)Cl 62a_100025796157_100000050019 [0,0,0,0,0,0|2,0,2]=4 54 B15R2.15371 Clc1cncc(c1C=C2CCCC2)Cl 271570a_100010378317_100000036193 [0,0,0,0,0,0|3,0,1]=4 55 B15R2.15371 Clc1cncc(c1CN2CCCC2)Cl 2230a_100000188435_200009872113 [0,0,0,0,0,0|4,0,0]=4 56 B15R2.15371 Clc1cncc(c1CN2CCCC2)Cl 269982a_100000188435_200009872113 [0,0,0,0,0,0|4,0,0]=4 57 B15R2.15371 Clc1cncc(c1CN2CCCC2)Cl 270004a_100000188435_100000067493 [0,0,0,0,0,0|4,0,0]=4 58 B15R2.15371 Clc1cncc(c1Sc2ncc[nH]2)Cl 62a_100000036193_100025796157 [0,0,0,0,0,0|2,0,2]=4 59 B15R2.15371 Clc1cncc(c1Sc2ncc[nH]2)Cl 62a_100025796157_100000036193 [0,0,0,0,0,0|2,0,2]=4 60 B15R2.15371 Fc1cccc(c1C=C2CCCC2)Cl 271570a_100010378317_100000050007 [0,0,0,0,0,0|2,1,1]=4 61 B15R2.15371 Fc1cccc(c1CN2CCCC2)Cl 2230a_100000188435_100000187852 [0,0,0,0,0,0|3,1,0]=4 62 B15R2.15371 Fc1cccc(c1CN2CCCC2)Cl 269982a_100000188435_100000187852 [0,0,0,0,0,0|3,1,0]=4 63 B15R2.15371 Fc1cccc(c1CN2CCCC2)Cl 270004a_100000188435_100000210083 [0,0,0,0,0,0|3,1,0]=4 64 B15R2.15371 Fc1cccc(c1Sc2ncc[nH]2)Cl 62a_100000050007_100025796157 [0,0,0,0,0,0|1,1,2]=4 65 B15R2.15371 Fc1cccc(c1Sc2ncc[nH]2)Cl 62a_100025796157_100000050007 [0,0,0,0,0,0|1,1,2]=4 66 B15R2.15371 Nc1cccc(c1C=C2CCCC2)Cl 271570a_100010378317_100000049713 [0,0,0,0,0,0|3,0,1]=4 67 B15R2.15371 Nc1cccc(c1Sc2ncc[nH]2)Cl 62a_100000049713_100025796157 [0,0,0,0,0,0|2,0,2]=4 68 B15R2.15371 Nc1cccc(c1Sc2ncc[nH]2)Cl 62a_100025796157_100000049713 [0,0,0,0,0,0|2,0,2]=4 69 B15R2.15371 Oc1cccc(c1C=C2CCCC2)Cl 271570a_100010378317_100000050174 [0,0,0,0,0,0|3,0,1]=4 70 B15R2.15371 Oc1cccc(c1Sc2ncc[nH]2)Cl 62a_100025796157_100000050174 [0,0,0,0,0,0|2,0,2]=4 71 B14R2.50 Clc1ccccc1C=C2CCCC2 271570a_100010378317_100000764095 [1,0,0,0,0,0|2,0,1]=4 72 B14R2.50 Clc1ccccc1CN2CCCC2 2230a_100000188435_100000187162 [1,0,0,0,0,0|3,0,0]=4 73 B14R2.50 Clc1ccccc1CN2CCCC2 269982a_100000188435_100000187162 [1,0,0,0,0,0|3,0,0]=4 74 B14R2.50 Clc1ccccc1CN2CCCC2 26a_100000188435_100000210172 [1,0,0,0,0,0|3,0,0]=4 75 B14R2.50 Clc1ccccc1CN2CCCC2 270004a_100000188435_100000210073 [1,0,0,0,0,0|3,0,0]=4 76 B14R2.50 Clc1ccccc1Sc2ncc[nH]2 62a_100000764095_100025796157 [1,0,0,0,0,0|1,0,2]=4 77 B14R2.50 Clc1ccccc1Sc2ncc[nH]2 62a_100025796157_100000764095 [1,0,0,0,0,0|1,0,2]=4 78 B16R2.6175 Cc1cc(c(c(c1)Cl)CN2CCCC2)Cl 26a_100000188435_100000034925 [0,1,0,0,0,0|3,0,0]=4 79 B16R2.6175 Cc1cc(c(c(c1)Cl)CN2CCCC2)Cl 270004a_100000188435_100000093335 [0,1,0,0,0,0|3,0,0]=4 80 B16R2.6175 Clc1cc(c(c(c1)Cl)C=C2CCCC2)Cl 271570a_100010378317_200011216440 [0,1,0,0,0,0|2,0,1]=4 81 B16R2.6175 Clc1cc(c(c(c1)Cl)CN2CCCC2)Cl 2230a_100000188435_100012339996 [0,1,0,0,0,0|3,0,0]=4 82 B16R2.6175 Clc1cc(c(c(c1)Cl)CN2CCCC2)Cl 269982a_100000188435_100012339996 [0,1,0,0,0,0|3,0,0]=4 83 B16R2.6175 Clc1cc(c(c(c1)Cl)CN2CCCC2)Cl 26a_100000188435_100000210218 [0,1,0,0,0,0|3,0,0]=4 84 B16R2.6175 Clc1cc(c(c(c1)Cl)CN2CCCC2)Cl 270004a_100000188435_100012362488 [0,1,0,0,0,0|3,0,0]=4 85 B16R2.6175 Clc1cc(c(c(c1)Cl)Sc2ncc[nH]2)Cl 62a_100025796157_200011216440 [0,1,0,0,0,0|1,0,2]=4 86 B16R2.6175 Clc1cc(c(c(c1)Cl)Sc2ncc[nH]2)Cl 62a_200011216440_100025796157 [0,1,0,0,0,0|1,0,2]=4 87 B16R2.6175 Clc1cc(cc(c1C=C2CCCC2)Cl)Br 271570a_100010378317_200011263224 [0,1,0,0,0,0|2,0,1]=4 88 B16R2.6175 Clc1cc(cc(c1CN2CCCC2)Cl)Br 26a_100000188435_100000753780 [0,1,0,0,0,0|3,0,0]=4 89 B16R2.6175 Clc1cc(cc(c1CN2CCCC2)Cl)Br 270004a_100000188435_100010238519 [0,1,0,0,0,0|3,0,0]=4 90 B16R2.6175 Clc1cc(cc(c1CN2CCCC2)Cl)I 26a_100000188435_100012339652 [0,1,0,0,0,0|3,0,0]=4 91 B16R2.6175 Clc1cc(cc(c1Sc2ncc[nH]2)Cl)Br 62a_100025796157_200011263224 [0,1,0,0,0,0|1,0,2]=4 92 B16R2.6175 Clc1cc(cc(c1Sc2ncc[nH]2)Cl)Br 62a_200011263224_100025796157 [0,1,0,0,0,0|1,0,2]=4 93 B16R2.6175 Fc1cc(c(c(c1)Cl)C=C2CCCC2)Cl 271570a_100010378317_100010175091 [0,1,0,0,0,0|2,0,1]=4 94 B16R2.6175 Fc1cc(c(c(c1)Cl)CN2CCCC2)Cl 26a_100000188435_100011217724 [0,1,0,0,0,0|3,0,0]=4 95 B16R2.6175 Fc1cc(c(c(c1)Cl)CN2CCCC2)Cl 270004a_100000188435_100010271666 [0,1,0,0,0,0|3,0,0]=4 96 B16R2.6175 Fc1cc(c(c(c1)Cl)Sc2ncc[nH]2)Cl 62a_100010175091_100025796157 [0,1,0,0,0,0|1,0,2]=4 97 B16R2.6175 Fc1cc(c(c(c1)Cl)Sc2ncc[nH]2)Cl 62a_100025796157_100010175091 [0,1,0,0,0,0|1,0,2]=4 98 B16R2.11484 C[C@@H]1CCN(C1)Cc2c(cccc2Cl)Cl 2230a_100016987628_100000187851 [0,1,0,0,0,0|3,0,0]=4 99 B16R2.11484 C[C@@H]1CCN(C1)Cc2c(cccc2Cl)Cl 269982a_100016987628_100000211241 [0,1,0,0,0,0|3,0,0]=4 100 B16R2.11484 C[C@@H]1CCN(C1)Cc2c(cccc2Cl)Cl 26a_100016987628_100000211709 [0,1,0,0,0,0|3,0,0]=4 101 B16R2.11484 C[C@@H]1CCN(C1)Cc2c(cccc2Cl)Cl 270004a_100016987628_100000189306 [0,1,0,0,0,0|3,0,0]=4 102 B16R2.11484 C[C@@H]1CCN(C1)Cc2c(cccc2Cl)Cl 34a_100016987628_100000187851 [0,1,0,0,0,0|3,0,0]=4 103 B16R2.11484 Cc1c[nH]c(n1)Sc2c(cccc2Cl)Cl 62a_100000034237_100161115468 [0,1,0,0,0,0|1,0,2]=4 104 B16R2.11484 Cc1c[nH]c(n1)Sc2c(cccc2Cl)Cl 62a_100161115468_100000034237 [0,1,0,0,0,0|1,0,2]=4 105 B16R2.11484 Cc1nc(no1)Cc2c(cccc2Cl)Cl 270196a_100000183788_100000070787 [0,1,0,0,0,0|1,0,2]=4 106 B16R2.11484 Cc1noc(n1)Cc2c(cccc2Cl)Cl 270196a_100000212224_100000211232 [0,1,0,0,0,0|2,0,1]=4 107 B16R2.11484 F[C@H]1CCN(C1)Cc2c(cccc2Cl)Cl 2230a_100015203821_100000187851 [0,1,0,0,0,0|3,0,0]=4 108 B16R2.11484 F[C@H]1CCN(C1)Cc2c(cccc2Cl)Cl 269982a_100015203821_100000211241 [0,1,0,0,0,0|3,0,0]=4 109 B16R2.11484 F[C@H]1CCN(C1)Cc2c(cccc2Cl)Cl 26a_100015203821_100000211709 [0,1,0,0,0,0|3,0,0]=4 110 B16R2.11484 F[C@H]1CCN(C1)Cc2c(cccc2Cl)Cl 270004a_100015203821_100000189306 [0,1,0,0,0,0|3,0,0]=4 111 B16R2.11484 F[C@H]1CCN(C1)Cc2c(cccc2Cl)Cl 34a_100015203821_100000187851 [0,1,0,0,0,0|3,0,0]=4 112 B16R2.11484 OC1CCN(C1)Cc2c(cccc2Cl)Cl 2230a_100011215560_100000187851 [0,1,0,0,0,0|3,0,0]=4 113 B16R2.11484 OC1CCN(C1)Cc2c(cccc2Cl)Cl 269982a_100011215560_100000211241 [0,1,0,0,0,0|3,0,0]=4 114 B16R2.11484 OC1CCN(C1)Cc2c(cccc2Cl)Cl 26a_100011215560_100000211709 [0,1,0,0,0,0|3,0,0]=4 115 B16R2.11484 OC1CCN(C1)Cc2c(cccc2Cl)Cl 270004a_100011215560_100000189306 [0,1,0,0,0,0|3,0,0]=4 116 B16R2.11484 Oc1nc(no1)Cc2c(cccc2Cl)Cl 270196a_100000183788_100015183105 [0,1,0,0,0,0|1,0,2]=4 117 B16R2.14153 C[C@@H]1CCCN1Cc2c(cccc2Cl)Cl 2230a_100015189458_100000187851 [0,1,0,0,0,0|3,0,0]=4 118 B16R2.14153 C[C@@H]1CCCN1Cc2c(cccc2Cl)Cl 269982a_100015189458_100000211241 [0,1,0,0,0,0|3,0,0]=4 119 B16R2.14153 C[C@@H]1CCCN1Cc2c(cccc2Cl)Cl 26a_100015189458_100000211709 [0,1,0,0,0,0|3,0,0]=4 120 B16R2.14153 C[C@@H]1CCCN1Cc2c(cccc2Cl)Cl 270004a_100015189458_100000189306 [0,1,0,0,0,0|3,0,0]=4 121 B16R2.14153 C[C@@H]1CCCN1Cc2c(cccc2Cl)Cl 34a_100015189458_100000187851 [0,1,0,0,0,0|3,0,0]=4 122 B16R2.14153 C[C@H]1CCCN1Cc2c(cccc2Cl)Cl 2230a_100020605311_100000187851 [0,1,0,0,0,0|3,0,0]=4 123 B16R2.14153 C[C@H]1CCCN1Cc2c(cccc2Cl)Cl 269982a_100020605311_100000211241 [0,1,0,0,0,0|3,0,0]=4 124 B16R2.14153 C[C@H]1CCCN1Cc2c(cccc2Cl)Cl 26a_100020605311_100000211709 [0,1,0,0,0,0|3,0,0]=4 125 B16R2.14153 C[C@H]1CCCN1Cc2c(cccc2Cl)Cl 270004a_100020605311_100000189306 [0,1,0,0,0,0|3,0,0]=4 126 B16R2.14153 Cn1ccnc1Sc2c(cccc2Cl)Cl 62a_100000034237_100000707724 [0,1,0,0,0,0|1,0,2]=4 127 B16R2.14153 Cn1ccnc1Sc2c(cccc2Cl)Cl 62a_100000707724_100000034237 [0,1,0,0,0,0|1,0,2]=4 128 B16R2.14153 Cn1ncnc1Nc2c(cccc2Cl)Cl 27a_100000210028_100000732653 [0,1,0,0,0,0|2,0,1]=4 129 B16R2.14153 Cn1ncnc1Sc2c(cccc2Cl)Cl 62a_100000034237_100000732653 [0,1,0,0,0,0|2,0,1]=4 130 B16R2.14153 Cn1ncnc1Sc2c(cccc2Cl)Cl 62a_100000732653_100000034237 [0,1,0,0,0,0|2,0,1]=4 131 B16R2.26187 Cc1ccc(c(c1Cl)CN2CCCC2)Cl 2230a_100000188435_200010220899 [0,1,0,0,0,0|3,0,0]=4 132 B16R2.26187 Cc1ccc(c(c1Cl)CN2CCCC2)Cl 269982a_100000188435_200010220899 [0,1,0,0,0,0|3,0,0]=4 133 B16R2.26187 Cc1ccc(c(c1Cl)CN2CCCC2)Cl 26a_100000188435_200000087117 [0,1,0,0,0,0|3,0,0]=4 134 B16R2.26187 Clc1ccc(c(c1CN2CCCC2)Cl)Br 26a_100000188435_100010089855 [0,1,0,0,0,0|3,0,0]=4 135 B16R2.26187 Clc1ccc(c(c1CN2CCCC2)Cl)Br 270004a_100000188435_200010289272 [0,1,0,0,0,0|3,0,0]=4 136 B16R2.26187 Clc1ccc(c(c1Cl)C=C2CCCC2)Cl 271570a_100010378317_200010170825 [0,1,0,0,0,0|2,0,1]=4 137 B16R2.26187 Clc1ccc(c(c1Cl)CN2CCCC2)Cl 26a_100000188435_100000042553 [0,1,0,0,0,0|3,0,0]=4 138 B16R2.26187 Clc1ccc(c(c1Cl)CN2CCCC2)Cl 270004a_100000188435_100000211905 [0,1,0,0,0,0|3,0,0]=4 139 B16R2.26187 Clc1ccc(c(c1Cl)Sc2ncc[nH]2)Cl 62a_100025796157_200010170825 [0,1,0,0,0,0|1,0,2]=4 140 B16R2.26187 Clc1ccc(c(c1Cl)Sc2ncc[nH]2)Cl 62a_200010170825_100025796157 [0,1,0,0,0,0|1,0,2]=4 141 B16R2.26187 Fc1ccc(c(c1Cl)CN2CCCC2)Cl 270004a_100000188435_100000094348 [0,1,0,0,0,0|3,0,0]=4 142 B14R1.16281 CCN(CC)Cc1c(cccc1Cl)Cl 2230a_100000724800_100000187851 [0,0,1,0,0,0|3,0,0]=4 143 B14R1.16281 CCN(CC)Cc1c(cccc1Cl)Cl 269956a_100000042499_100000187851 [0,0,1,0,0,0|3,0,0]=4 144 B14R1.16281 CCN(CC)Cc1c(cccc1Cl)Cl 269982a_100000724800_100000211241 [0,0,1,0,0,0|3,0,0]=4 145 B14R1.16281 CCN(CC)Cc1c(cccc1Cl)Cl 270004a_100000724800_100000189306 [0,0,1,0,0,0|3,0,0]=4 146 B14R1.19171 CC#CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000763181_100000187851 [0,0,1,0,0,0|2,0,1]=4 147 B14R1.19171 CC=CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000210699_100000187851 [0,0,1,0,0,0|2,0,1]=4 148 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000211992_100010138402 [0,0,1,0,0,0|2,1,0]=4 149 B14R1.19171 CCCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210303 [0,0,1,0,0,0|2,1,0]=4 150 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210303 [0,0,1,0,0,0|2,0,0]=3 151 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211992_100000187851 [0,0,1,0,0,0|2,0,0]=3 152 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000210303 [0,0,1,0,0,0|2,1,0]=4 153 B14R1.19171 CCCC(=O)Cc1c(cccc1Cl)F 1458a_100000211992_100000187852 [0,0,1,0,0,0|2,1,0]=4 154 B14R1.19171 CCCC(=O)Cc1c(cncc1Cl)Cl 1458a_100000211992_200009872113 [0,0,1,0,0,0|3,0,0]=4 155 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100000211992 [0,0,1,0,0,0|3,0,0]=4 156 B14R1.19171 CCCC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100000211992 [0,0,1,0,0,0|3,0,0]=4 157 B14R1.19171 CCCN(C)Cc1c(cccc1Cl)Cl 2230a_100000186903_100000210303 [0,0,1,0,0,0|3,0,0]=4 158 B14R1.19171 CCCN(C)Cc1c(cccc1Cl)Cl 2230a_100000747261_100000187851 [0,0,1,0,0,0|3,0,0]=4 159 B14R1.19171 CCCN(C)Cc1c(cccc1Cl)Cl 269982a_100000186903_100000210303 [0,0,1,0,0,0|3,0,0]=4 160 B14R1.19171 CCCN(C)Cc1c(cccc1Cl)Cl 269982a_100000747261_100000211241 [0,0,1,0,0,0|3,0,0]=4 161 B14R1.19171 CCCN(C)Cc1c(cccc1Cl)Cl 26a_100000747261_100000211709 [0,0,1,0,0,0|3,0,0]=4 162 B14R1.19171 CCCN(C)Cc1c(cccc1Cl)Cl 270004a_100000747261_100000189306 [0,0,1,0,0,0|3,0,0]=4 163 B14R1.19171 CCCN(C)Cc1c(cccc1Cl)Cl 34a_100000186903_100000210303 [0,0,1,0,0,0|3,0,0]=4 164 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Br 11a_100015525214_100010209379 [0,0,1,0,0,0|1,2,0]=4 165 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Br 240690a_100015525214_100010209379 [0,0,1,0,0,0|1,2,0]=4 166 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Br 527a_100015525214_100010209379 [0,0,1,0,0,0|1,2,0]=4 167 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)C 11a_100015525214_100010147022 [0,0,1,0,0,0|2,1,0]=4 168 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)C 240690a_100015525214_100010147022 [0,0,1,0,0,0|2,1,0]=4 169 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)C 527a_100015525214_100010147022 [0,0,1,0,0,0|2,1,0]=4 170 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Cl 11a_100015525214_100013084675 [0,0,1,0,0,0|1,1,0]=3 171 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Cl 240690a_100015525214_100013084675 [0,0,1,0,0,0|1,1,0]=3 172 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)Cl 527a_100015525214_100013084675 [0,0,1,0,0,0|1,1,0]=3 173 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)F 11a_100015525214_100010172741 [0,0,1,0,0,0|1,2,0]=4 174 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)F 240690a_100015525214_100010172741 [0,0,1,0,0,0|1,2,0]=4 175 B14R1.19171 CCNC(=O)Cc1c(cccc1Br)F 527a_100015525214_100010172741 [0,0,1,0,0,0|1,2,0]=4 176 B14R1.19171 CCNC(=O)Cc1c(cccc1C)C 11a_100015525214_100000689862 [0,0,1,0,0,0|3,0,0]=4 177 B14R1.19171 CCNC(=O)Cc1c(cccc1C)C 240690a_100015525214_100000689862 [0,0,1,0,0,0|3,0,0]=4 178 B14R1.19171 CCNC(=O)Cc1c(cccc1C)C 527a_100015525214_100000689862 [0,0,1,0,0,0|3,0,0]=4 179 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)Cl 11a_100015525214_100000211232 [0,0,1,0,0,0|1,0,0]=2 180 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100015525214_100000211232 [0,0,1,0,0,0|1,0,0]=2 181 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)Cl 527a_100015525214_100000211232 [0,0,1,0,0,0|1,0,0]=2 182 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)F 11a_100015525214_100000185183 [0,0,1,0,0,0|1,1,0]=3 183 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)F 240690a_100015525214_100000185183 [0,0,1,0,0,0|1,1,0]=3 184 B14R1.19171 CCNC(=O)Cc1c(cccc1Cl)F 527a_100015525214_100000185183 [0,0,1,0,0,0|1,1,0]=3 185 B14R1.19171 CCNC(=O)Cc1c(cccc1F)F 11a_100015525214_100000684726 [0,0,1,0,0,0|1,2,0]=4 186 B14R1.19171 CCNC(=O)Cc1c(cccc1F)F 240690a_100015525214_100000684726 [0,0,1,0,0,0|1,2,0]=4 187 B14R1.19171 CCNC(=O)Cc1c(cccc1F)F 527a_100015525214_100000684726 [0,0,1,0,0,0|1,2,0]=4 188 B14R1.19171 CCNC(=O)Nc1c(cccc1Br)Cl 2430a_100102946385_100015525214 [0,0,1,0,0,0|2,1,0]=4 189 B14R1.19171 CCNC(=O)Nc1c(cccc1Cl)C 2430a_100000756524_100015525214 [0,0,1,0,0,0|3,0,0]=4 190 B14R1.19171 CCNC(=O)Nc1c(cccc1Cl)F 2430a_100000760031_100015525214 [0,0,1,0,0,0|2,1,0]=4 191 B14R1.19171 CCNC(C)Cc1c(cccc1Cl)Cl 270004a_100015525214_100000692661 [0,0,1,0,0,0|1,0,1]=3 192 B14R1.19171 CNNC(=O)Cc1c(cccc1Br)Cl 22a_100016993582_100013084675 [0,0,1,0,0,0|2,1,0]=4 193 B14R1.19171 CNNC(=O)Cc1c(cccc1Cl)Cl 22a_100016993582_100000211232 [0,0,1,0,0,0|2,0,0]=3 194 B14R1.19171 CNNC(=O)Cc1c(cccc1Cl)F 22a_100016993582_100000185183 [0,0,1,0,0,0|2,1,0]=4 195 B14R1.19171 COCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000210968_100000187851 [0,0,1,0,0,0|3,0,0]=4 196 B14R1.19171 CSCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000184570_100000187851 [0,0,1,0,0,0|3,0,0]=4 197 B14R1.19171 O=C(CCF)Cc1c(cccc1Cl)Cl 1458a_100000211232_100011217306 [0,0,1,0,0,0|3,0,0]=4 198 B14R1.19171 O=C(CCO)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000211926 [0,0,1,0,0,0|3,0,0]=4 199 B14R1.19171 O=C(CCO)Cc1c(cccc1Cl)Cl 1458a_100011216618_100000187851 [0,0,1,0,0,0|3,0,0]=4 200 B14R1.20339 C#CCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000038162 [0,0,1,0,0,0|1,0,2]=4 201 B14R1.20339 C#CCNCCc1c(cccc1Cl)Cl 34a_100000212058_100012161200 [0,0,1,0,0,0|1,0,2]=4 202 B14R1.20339 C#CCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000184674 [0,0,1,0,0,0|1,0,2]=4 203 B14R1.20339 C=CCNCCc1c(cccc1Cl)Cl 2230a_100020586998_100012161200 [0,0,1,0,0,0|1,0,2]=4 204 B14R1.20339 C=CCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000210623 [0,0,1,0,0,0|1,0,2]=4 205 B14R1.20339 C=CCNCCc1c(cccc1Cl)Cl 34a_100032004868_100015514636 [0,0,1,0,0,0|1,0,2]=4 206 B14R1.20339 CCCCC=Cc1c(cccc1Cl)Cl 271570a_100016275911_100000034237 [0,0,1,0,0,0|2,0,1]=4 207 B14R1.20339 CCCCNCc1c(cccc1Cl)Cl 207a_100000102301_100000189306 [0,0,1,0,0,0|3,0,0]=4 208 B14R1.20339 CCCCNCc1c(cccc1Cl)Cl 2230a_100000102301_100000187851 [0,0,1,0,0,0|3,0,0]=4 209 B14R1.20339 CCCCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000210211 [0,0,1,0,0,0|3,0,0]=4 210 B14R1.20339 CCCCNCc1c(cccc1Cl)Cl 270004a_100000102301_100000189306 [0,0,1,0,0,0|3,0,0]=4 211 B14R1.20339 CCCCNCc1c(cccc1Cl)Cl 34a_100000174884_100000210210 [0,0,1,0,0,0|3,0,0]=4 212 B14R1.20339 CCCCNCc1c(cccc1Cl)Cl 7a_106832991798_100000187851 [0,0,1,0,0,0|3,0,0]=4 213 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 34a_100000210227_100000187851 [0,0,1,0,0,0|3,0,0]=4 214 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 34a_100000215722_100000210210 [0,0,1,0,0,0|3,0,0]=4 215 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 7a_100000210227_100000187851 [0,0,1,0,0,0|3,0,0]=4 216 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 7a_100000215722_100000210211 [0,0,1,0,0,0|3,0,0]=4 217 B14R1.20339 CCCCSCc1c(cccc1Cl)Cl 62a_100000187851_100000210210 [0,0,1,0,0,0|3,0,0]=4 218 B14R1.20339 CCCCSCc1c(cccc1Cl)Cl 62a_100000210211_100000187851 [0,0,1,0,0,0|3,0,0]=4 219 B14R1.20339 CCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000210303 [0,0,1,0,0,0|1,0,1]=3 220 B14R1.20339 CCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000210303 [0,0,1,0,0,0|1,0,1]=3 221 B14R1.20339 CCCNCCc1c(cccc1Cl)F 2230a_100000688150_100000210303 [0,0,1,0,0,0|1,1,1]=4 222 B14R1.20339 CCCNCCc1c(cccc1Cl)F 34a_100000688150_100000210303 [0,0,1,0,0,0|1,1,1]=4 223 B14R1.20339 CCCNN=Cc1c(cccc1Cl)Cl 4a_100000740057_100000189306 [0,0,1,0,0,0|2,0,1]=4 224 B14R1.20339 CCCOCCc1c(cccc1Cl)Cl 34a_100000210258_100012161200 [0,0,1,0,0,0|2,0,1]=4 225 B14R1.20339 CCCOCCc1c(cccc1Cl)Cl 34a_100011934077_100000210303 [0,0,1,0,0,0|2,0,1]=4 226 B14R1.20339 CCCOCCc1c(cccc1Cl)Cl 7a_100011934077_100000210303 [0,0,1,0,0,0|2,0,1]=4 227 B14R1.20339 CCCSCCc1c(cccc1Cl)Cl 62a_100000210303_100012161200 [0,0,1,0,0,0|2,0,1]=4 228 B14R1.20339 CCCSCCc1c(cccc1Cl)Cl 62a_100012161200_100000210303 [0,0,1,0,0,0|2,0,1]=4 229 B14R1.20339 COCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000766300 [0,0,1,0,0,0|2,0,1]=4 230 B14R1.20339 CSCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011218213 [0,0,1,0,0,0|2,0,1]=4 231 B14R1.20339 CSCNCCc1c(cccc1Cl)Cl 34a_100032004868_100011218213 [0,0,1,0,0,0|2,0,1]=4 232 B14R1.20339 ClCCCOCc1c(cccc1Cl)Cl 34a_100000230001_100000187851 [0,0,1,0,0,0|3,0,0]=4 233 B14R1.20339 Clc1cccc(c1CCOCCBr)Cl 34a_100000211926_100012161200 [0,0,1,0,0,0|2,0,1]=4 234 B14R1.20339 Clc1cccc(c1COCCCBr)Cl 34a_100011217188_100000187851 [0,0,1,0,0,0|3,0,0]=4 235 B14R1.20339 FCCCNCc1c(cccc1Cl)Cl 207a_100015189416_100000189306 [0,0,1,0,0,0|3,0,0]=4 236 B14R1.20339 FCCCNCc1c(cccc1Cl)Cl 2230a_100000174884_100011934791 [0,0,1,0,0,0|3,0,0]=4 237 B14R1.20339 FCCCNCc1c(cccc1Cl)Cl 2230a_100015189416_100000187851 [0,0,1,0,0,0|3,0,0]=4 238 B14R1.20339 FCCCNCc1c(cccc1Cl)Cl 270004a_100015189416_100000189306 [0,0,1,0,0,0|3,0,0]=4 239 B14R1.20339 FCCCNCc1c(cccc1Cl)Cl 34a_100000174884_100011934791 [0,0,1,0,0,0|3,0,0]=4 240 B14R1.20339 FCCCNCc1c(cccc1Cl)Cl 34a_100015189416_100000187851 [0,0,1,0,0,0|3,0,0]=4 241 B14R1.20339 FCCCOCc1c(cccc1Cl)Cl 34a_100000215722_100011934791 [0,0,1,0,0,0|3,0,0]=4 242 B14R1.20339 FCCCOCc1c(cccc1Cl)Cl 34a_100000759539_100000187851 [0,0,1,0,0,0|3,0,0]=4 243 B14R1.20339 FCCCOCc1c(cccc1Cl)Cl 7a_100000215722_100011934791 [0,0,1,0,0,0|3,0,0]=4 244 B14R1.20339 FCCCSCc1c(cccc1Cl)Cl 62a_100000187851_100011934791 [0,0,1,0,0,0|3,0,0]=4 245 B14R1.20339 FCCCSCc1c(cccc1Cl)Cl 62a_100011934791_100000187851 [0,0,1,0,0,0|3,0,0]=4 246 B14R1.20339 FCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011217306 [0,0,1,0,0,0|1,0,1]=3 247 B14R1.20339 FCCNCCc1c(cccc1Cl)Cl 34a_100000724931_100012161200 [0,0,1,0,0,0|1,0,1]=3 248 B14R1.20339 FCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100011217306 [0,0,1,0,0,0|1,0,1]=3 249 B14R1.20339 FCCNCCc1c(cccc1Cl)F 2230a_100000688150_100011217306 [0,0,1,0,0,0|1,1,1]=4 250 B14R1.20339 FCCNCCc1c(cccc1Cl)F 34a_100000688150_100011217306 [0,0,1,0,0,0|1,1,1]=4 251 B14R1.20339 FCCOCCc1c(cccc1Cl)Cl 34a_100011934077_100011217306 [0,0,1,0,0,0|2,0,1]=4 252 B14R1.20339 FCCOCCc1c(cccc1Cl)Cl 7a_100011934077_100011217306 [0,0,1,0,0,0|2,0,1]=4 253 B14R1.20339 FCCSCCc1c(cccc1Cl)Cl 62a_100011217306_100012161200 [0,0,1,0,0,0|2,0,1]=4 254 B14R1.20339 FCCSCCc1c(cccc1Cl)Cl 62a_100012161200_100011217306 [0,0,1,0,0,0|2,0,1]=4 255 B14R1.20339 N#CCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011215382 [0,0,1,0,0,0|0,0,3]=4 256 B14R1.20339 NCCCOCc1c(cccc1Br)Cl 34a_100000182051_100010138402 [0,0,1,0,0,0|2,1,0]=4 257 B14R1.20339 NCCCOCc1c(cccc1Cl)Cl 34a_100000182051_100000187851 [0,0,1,0,0,0|2,0,0]=3 258 B14R1.20339 NCCCOCc1c(cccc1Cl)F 34a_100000182051_100000187852 [0,0,1,0,0,0|2,1,0]=4 259 B14R1.20339 NCCCOCc1c(cncc1Cl)Cl 34a_100000182051_200009872113 [0,0,1,0,0,0|3,0,0]=4 260 B14R1.20339 NCCOCCc1c(cccc1Cl)Cl 34a_100000210304_100012161200 [0,0,1,0,0,0|1,0,1]=3 261 B14R1.20339 NOCCOCc1c(cccc1Cl)Cl 34a_100000700252_100000187851 [0,0,1,0,0,0|3,0,0]=4 262 B14R1.20339 O=CCNCCc1c(cccc1Cl)Cl 2230a_100032004868_200015260668 [0,0,1,0,0,0|1,0,2]=4 263 B14R1.20339 O=CCNCCc1c(cccc1Cl)Cl 34a_100032004868_200009817547 [0,0,1,0,0,0|1,0,2]=4 264 B14R1.20339 OCCCNCc1c(cccc1Cl)Cl 207a_100000182051_100000189306 [0,0,1,0,0,0|3,0,0]=4 265 B14R1.20339 OCCCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000230001 [0,0,1,0,0,0|3,0,0]=4 266 B14R1.20339 OCCCNCc1c(cccc1Cl)Cl 270004a_100000182051_100000189306 [0,0,1,0,0,0|3,0,0]=4 267 B14R1.20339 OCCCNCc1c(cccc1Cl)Cl 34a_100000174884_100000230001 [0,0,1,0,0,0|3,0,0]=4 268 B14R1.20339 OCCCOCc1c(cccc1Cl)Cl 34a_100000215722_100000230001 [0,0,1,0,0,0|3,0,0]=4 269 B14R1.20339 OCCCOCc1c(cccc1Cl)Cl 7a_100000215722_100011215043 [0,0,1,0,0,0|3,0,0]=4 270 B14R1.20339 OCCCSCc1c(cccc1Cl)Cl 62a_100000187851_100011215043 [0,0,1,0,0,0|3,0,0]=4 271 B14R1.20339 OCCCSCc1c(cccc1Cl)Cl 62a_100011215043_100000187851 [0,0,1,0,0,0|3,0,0]=4 272 B14R1.20339 OCCNCCc1c(cccc1Cl)Cl 2230a_100016997473_100012161200 [0,0,1,0,0,0|1,0,1]=3 273 B14R1.20339 OCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000211926 [0,0,1,0,0,0|1,0,1]=3 274 B14R1.20339 OCCNCCc1c(cccc1Cl)Cl 34a_100016990907_100012161200 [0,0,1,0,0,0|1,0,1]=3 275 B14R1.20339 OCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000211926 [0,0,1,0,0,0|1,0,1]=3 276 B14R1.20339 OCCNCCc1c(cccc1Cl)F 2230a_100000688150_100000211926 [0,0,1,0,0,0|1,1,1]=4 277 B14R1.20339 OCCNCCc1c(cccc1Cl)F 34a_100000688150_100000211926 [0,0,1,0,0,0|1,1,1]=4 278 B14R1.20339 OCCNN=Cc1c(cccc1Cl)Cl 4a_100000210001_100000189306 [0,0,1,0,0,0|2,0,1]=4 279 B14R1.20339 OCCOCCc1c(cccc1Cl)Cl 34a_100011934077_100000211926 [0,0,1,0,0,0|2,0,1]=4 280 B14R1.20339 OCCOCCc1c(cccc1Cl)Cl 7a_100011934077_100000211926 [0,0,1,0,0,0|2,0,1]=4 281 B14R1.20339 OCCSCCc1c(cccc1Cl)Cl 62a_100000211926_100012161200 [0,0,1,0,0,0|2,0,1]=4 282 B14R1.20339 OCCSCCc1c(cccc1Cl)Cl 62a_100012161200_100000211926 [0,0,1,0,0,0|2,0,1]=4 283 B14R2.5333 Clc1cccc(c1CN2CCC2)Br 269982a_100000754969_100010138402 [0,0,0,0,1,0|2,1,0]=4 284 B14R2.5333 Clc1cccc(c1CN2CCC2)Br 26a_100000754969_100010214474 [0,0,0,0,1,0|2,1,0]=4 285 B14R2.5333 Clc1cccc(c1CN2CCC2)Cl 269982a_100000754969_100000211241 [0,0,0,0,1,0|2,0,0]=3 286 B14R2.5333 Clc1cccc(c1CN2CCC2)Cl 26a_100000754969_100000211709 [0,0,0,0,1,0|2,0,0]=3 287 B14R2.5333 Clc1cccc(c1NC2CCC2)Cl 34a_100000210028_100000749161 [0,0,0,0,1,0|2,0,1]=4 288 B14R2.5333 Clc1cccc(c1OC2CCC2)Cl 34a_100000211709_100000749161 [0,0,0,0,1,0|2,0,1]=4 289 B14R2.5333 Clc1cccc(c1SC2CCC2)Cl 62a_100000034237_100000749161 [0,0,0,0,1,0|2,0,1]=4 290 B14R2.5333 Clc1cncc(c1CN2CCC2)Cl 269982a_100000754969_200009872113 [0,0,0,0,1,0|3,0,0]=4 291 B14R2.5333 Fc1cccc(c1CN2CCC2)Cl 269982a_100000754969_100000187852 [0,0,0,0,1,0|2,1,0]=4 292 B14R2.9066 Cc1cccc(c1C2=CCCC2)Cl 271570a_100000089523_100000043165 [0,0,0,0,1,0|3,0,0]=4 293 B14R2.9066 Cc1cccc(c1c2ncc[nH]2)Cl 271570a_100016988920_100000043165 [0,0,0,0,1,0|1,0,2]=4 294 B14R2.9066 Clc1cccc(c1C2=CCCC2)Br 271570a_100000089523_100010214488 [0,0,0,0,1,0|2,1,0]=4 295 B14R2.9066 Clc1cccc(c1C2=CCCC2)Cl 271570a_100000089523_100000034237 [0,0,0,0,1,0|2,0,0]=3 296 B14R2.9066 Clc1cccc(c1C2=CCOC2)Cl 271570a_100009872500_100000034237 [0,0,0,0,1,0|3,0,0]=4 297 B14R2.9066 Clc1cccc(c1C2=COCC2)Cl 271570a_100000118173_100000034237 [0,0,0,0,1,0|3,0,0]=4 298 B14R2.9066 Clc1cccc(c1c2cc[nH]n2)Cl 271570a_100000062414_100000034237 [0,0,0,0,1,0|2,0,1]=4 299 B14R2.9066 Clc1cccc(c1c2ncc[nH]2)Br 271570a_100016988920_100010214488 [0,0,0,0,1,0|0,1,2]=4 300 B14R2.9066 Clc1cccc(c1c2ncc[nH]2)Cl 271570a_100016988920_100000034237 [0,0,0,0,1,0|0,0,2]=3 301 B14R2.9066 Clc1cncc(c1C2=CCCC2)Cl 271570a_100000089523_100000036193 [0,0,0,0,1,0|3,0,0]=4 302 B14R2.9066 Clc1cncc(c1c2ncc[nH]2)Cl 271570a_100010140905_100025796157 [0,0,0,0,1,0|1,0,2]=4 303 B14R2.9066 Clc1cncc(c1c2ncc[nH]2)Cl 271570a_100016988920_100000036193 [0,0,0,0,1,0|1,0,2]=4 304 B14R2.9066 Fc1cccc(c1C2=CCCC2)Cl 271570a_100000089523_100000050007 [0,0,0,0,1,0|2,1,0]=4 305 B14R2.9066 Fc1cccc(c1c2ncc[nH]2)Cl 271570a_100016988920_100000050007 [0,0,0,0,1,0|0,1,2]=4 306 B14R2.9066 Nc1cccc(c1C2=CCCC2)Cl 271570a_100000089523_100000049713 [0,0,0,0,1,0|3,0,0]=4 307 B14R2.9066 Nc1cccc(c1c2ncc[nH]2)Cl 271570a_100016988920_100000049713 [0,0,0,0,1,0|1,0,2]=4 308 B14R2.9066 Oc1cccc(c1C2=CCCC2)Cl 271570a_100000089523_100000050174 [0,0,0,0,1,0|3,0,0]=4 309 B14R2.9066 Oc1cccc(c1c2ncc[nH]2)Cl 271570a_100016988920_100000050174 [0,0,0,0,1,0|1,0,2]=4 310 B16R2.3259 Clc1cccc(c1CN2CCCOC2)Cl 2230a_100000131196_100000187851 [0,0,0,0,0,1|3,0,0]=4 311 B16R2.3259 Clc1cccc(c1CN2CCCOC2)Cl 269982a_100000131196_100000211241 [0,0,0,0,0,1|3,0,0]=4 312 B16R2.3259 Clc1cccc(c1CN2CCCOC2)Cl 26a_100000131196_100000211709 [0,0,0,0,0,1|3,0,0]=4 313 B16R2.3259 Clc1cccc(c1CN2CCCOC2)Cl 270004a_100000131196_100000189306 [0,0,0,0,0,1|3,0,0]=4 314 B16R2.3259 Clc1cccc(c1CN2CCCOC2)Cl 34a_100000131196_100000187851 [0,0,0,0,0,1|3,0,0]=4 315 B16R2.3259 Clc1cccc(c1CN2CCOCC2)Cl 2230a_100015191051_100000187851 [0,0,0,0,0,1|3,0,0]=4 316 B16R2.3259 Clc1cccc(c1CN2CCOCC2)Cl 269982a_100015191051_100000211241 [0,0,0,0,0,1|3,0,0]=4 317 B16R2.3259 Clc1cccc(c1CN2CCOCC2)Cl 26a_100015191051_100000211709 [0,0,0,0,0,1|3,0,0]=4 318 B16R2.3259 Clc1cccc(c1CN2CCOCC2)Cl 270004a_100015191051_100000189306 [0,0,0,0,0,1|3,0,0]=4 319 B16R2.3259 Clc1cccc(c1CN2CCOCC2)Cl 34a_100015191051_100000187851 [0,0,0,0,0,1|3,0,0]=4 320 B16R2.3259 Clc1cccc(c1CN2CCSCC2)Cl 2230a_100000737611_100000187851 [0,0,0,0,0,1|3,0,0]=4 321 B16R2.3259 Clc1cccc(c1CN2CCSCC2)Cl 269982a_100000737611_100000211241 [0,0,0,0,0,1|3,0,0]=4 322 B16R2.3259 Clc1cccc(c1CN2CCSCC2)Cl 26a_100000737611_100000211709 [0,0,0,0,0,1|3,0,0]=4 323 B16R2.3259 Clc1cccc(c1CN2CCSCC2)Cl 270004a_100000737611_100000189306 [0,0,0,0,0,1|3,0,0]=4 324 B16R2.25778 Brc1cccc(c1NCC2=NCCN2)Br 34a_100000690995_100000737910 [0,0,0,0,0,1|0,2,0]=3 325 B16R2.25778 Brc1cccc(c1OCC2=NCCN2)Br 34a_100000736428_100000737910 [0,0,0,0,0,1|0,2,0]=3 326 B16R2.25778 Brc1cccc(c1OCC2=NCCN2)Br 7a_100000736428_100000737910 [0,0,0,0,0,1|0,2,0]=3 327 B16R2.25778 Brc1cccc(c1OCC2=NCCN2)I 34a_100010084509_100000737910 [0,0,0,0,0,1|0,2,0]=3 328 B16R2.25778 Brc1cccc(c1OCC2=NCCN2)I 7a_100010084509_100000737910 [0,0,0,0,0,1|0,2,0]=3 329 B16R2.25778 Brc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100009994525 [0,0,0,0,0,1|0,2,0]=3 330 B16R2.25778 Brc1cccc(c1SCC2=NCCN2)Br 62a_100009994525_100000737910 [0,0,0,0,0,1|0,2,0]=3 331 B16R2.25778 Brc1cncc(c1SCC2=NCCN2)Br 62a_100000737910_100010172828 [0,0,0,0,0,1|1,2,0]=4 332 B16R2.25778 Brc1cncc(c1SCC2=NCCN2)Br 62a_100010172828_100000737910 [0,0,0,0,0,1|1,2,0]=4 333 B16R2.25778 Cc1ccc[n+](c1SCC2=NCCN2)[O-] 62a_100000737910_100116209805 [0,0,0,0,0,1|3,0,0]=4 334 B16R2.25778 Cc1cccc(c1NCC2=NCCN2)Br 34a_100011834072_100000737910 [0,0,0,0,0,1|1,1,0]=3 335 B16R2.25778 Cc1cccc(c1NCC2=NCCN2)C 34a_100000185769_100000737910 [0,0,0,0,0,1|2,0,0]=3 336 B16R2.25778 Cc1cccc(c1NCC2=NCCN2)Cl 34a_100000756524_100000737910 [0,0,0,0,0,1|1,0,0]=2 337 B16R2.25778 Cc1cccc(c1NCC2=NCCN2)F 34a_100000766463_100000737910 [0,0,0,0,0,1|1,1,0]=3 338 B16R2.25778 Cc1cccc(c1NCC2=NCCN2)O 34a_100000743429_100000737910 [0,0,0,0,0,1|2,0,0]=3 339 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)Cl 34a_100000756524_100016991755 [0,0,0,0,0,1|1,0,2]=4 340 B16R2.25778 Cc1cccc(c1NCc2nnn[nH]2)Cl 34a_100000756524_100000765167 [0,0,0,0,0,1|3,0,0]=4 341 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)Br 34a_100009817157_100000737910 [0,0,0,0,0,1|1,1,0]=3 342 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)Br 7a_100009817157_100000737910 [0,0,0,0,0,1|1,1,0]=3 343 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)C 34a_100000210341_100000737910 [0,0,0,0,0,1|2,0,0]=3 344 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)C 7a_100000210341_100000737910 [0,0,0,0,0,1|2,0,0]=3 345 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)Cl 34a_100000033731_100000737910 [0,0,0,0,0,1|1,0,0]=2 346 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)Cl 7a_100000033731_100000737910 [0,0,0,0,0,1|1,0,0]=2 347 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)F 34a_100011659162_100000737910 [0,0,0,0,0,1|1,1,0]=3 348 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)F 7a_100011659162_100000737910 [0,0,0,0,0,1|1,1,0]=3 349 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)N 34a_100000756359_100000737910 [0,0,0,0,0,1|2,0,0]=3 350 B16R2.25778 Cc1cccc(c1OCC2=NCCN2)N 7a_100000756359_100000737910 [0,0,0,0,0,1|2,0,0]=3 351 B16R2.25778 Cc1cccc(c1OCc2ncc[nH]2)Cl 34a_100000033731_100016991755 [0,0,0,0,0,1|1,0,2]=4 352 B16R2.25778 Cc1cccc(c1OCc2ncc[nH]2)Cl 7a_100000033731_100000753453 [0,0,0,0,0,1|1,0,2]=4 353 B16R2.25778 Cc1cccc(c1OCc2nnn[nH]2)Cl 34a_100000033731_100000765167 [0,0,0,0,0,1|3,0,0]=4 354 B16R2.25778 Cc1cccc(c1OCc2nnn[nH]2)Cl 7a_100000033731_100000765167 [0,0,0,0,0,1|3,0,0]=4 355 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100010141302 [0,0,0,0,0,1|1,1,0]=3 356 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)Br 62a_100010141302_100000737910 [0,0,0,0,0,1|1,1,0]=3 357 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)C 62a_100000033847_100000737910 [0,0,0,0,0,1|2,0,0]=3 358 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)C 62a_100000737910_100000033847 [0,0,0,0,0,1|2,0,0]=3 359 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)Cl 62a_100000043165_100000737910 [0,0,0,0,0,1|1,0,0]=2 360 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)Cl 62a_100000737910_100000043165 [0,0,0,0,0,1|1,0,0]=2 361 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100011218421 [0,0,0,0,0,1|1,1,0]=3 362 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)F 62a_100011218421_100000737910 [0,0,0,0,0,1|1,1,0]=3 363 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)N 62a_100000684715_100000737910 [0,0,0,0,0,1|2,0,0]=3 364 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)N 62a_100000737910_100000684715 [0,0,0,0,0,1|2,0,0]=3 365 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)O 62a_100000686692_100000737910 [0,0,0,0,0,1|2,0,0]=3 366 B16R2.25778 Cc1cccc(c1SCC2=NCCN2)O 62a_100000737910_100000686692 [0,0,0,0,0,1|2,0,0]=3 367 B16R2.25778 Cc1cccc(c1SCc2ncc[nH]2)Cl 62a_100000043165_100016991755 [0,0,0,0,0,1|1,0,2]=4 368 B16R2.25778 Cc1cccc(c1SCc2ncc[nH]2)Cl 62a_100016991755_100000043165 [0,0,0,0,0,1|1,0,2]=4 369 B16R2.25778 Cc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000043165_100000765167 [0,0,0,0,0,1|3,0,0]=4 370 B16R2.25778 Cc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000765167_100000043165 [0,0,0,0,0,1|3,0,0]=4 371 B16R2.25778 Cc1ccnc(c1OCC2=NCCN2)C 34a_100011934651_100000737910 [0,0,0,0,0,1|3,0,0]=4 372 B16R2.25778 Cc1ccnc(c1OCC2=NCCN2)C 7a_100011934651_100000737910 [0,0,0,0,0,1|3,0,0]=4 373 B16R2.25778 Cc1ccnc(c1OCC2=NCCN2)Cl 34a_100000696282_100000737910 [0,0,0,0,0,1|2,0,0]=3 374 B16R2.25778 Cc1ccnc(c1OCC2=NCCN2)Cl 7a_100000696282_100000737910 [0,0,0,0,0,1|2,0,0]=3 375 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)C 62a_100000737910_100012000501 [0,0,0,0,0,1|3,0,0]=4 376 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)C 62a_100012000501_100000737910 [0,0,0,0,0,1|3,0,0]=4 377 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)Cl 62a_100000737910_100010248874 [0,0,0,0,0,1|2,0,0]=3 378 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)Cl 62a_100010248874_100000737910 [0,0,0,0,0,1|2,0,0]=3 379 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)F 62a_100000737910_100009818256 [0,0,0,0,0,1|2,1,0]=4 380 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)F 62a_100009818256_100000737910 [0,0,0,0,0,1|2,1,0]=4 381 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)N 62a_100000737910_100011998619 [0,0,0,0,0,1|3,0,0]=4 382 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)N 62a_100011998619_100000737910 [0,0,0,0,0,1|3,0,0]=4 383 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)O 62a_100000737910_100012000493 [0,0,0,0,0,1|3,0,0]=4 384 B16R2.25778 Cc1ccnc(c1SCC2=NCCN2)O 62a_100012000493_100000737910 [0,0,0,0,0,1|3,0,0]=4 385 B16R2.25778 Cc1cncc(c1SCC2=NCCN2)C 62a_100000737910_100009817138 [0,0,0,0,0,1|3,0,0]=4 386 B16R2.25778 Cc1cncc(c1SCC2=NCCN2)C 62a_100009817138_100000737910 [0,0,0,0,0,1|3,0,0]=4 387 B16R2.25778 Cc1nccc(c1SCC2=NCCN2)N 62a_100000737910_100010243816 [0,0,0,0,0,1|3,0,0]=4 388 B16R2.25778 Cc1nccc(c1SCC2=NCCN2)N 62a_100010243816_100000737910 [0,0,0,0,0,1|3,0,0]=4 389 B16R2.25778 Cc1ncnc(c1SCC2=NCCN2)Cl 62a_100000737910_100012356128 [0,0,0,0,0,1|3,0,0]=4 390 B16R2.25778 Cc1ncnc(c1SCC2=NCCN2)Cl 62a_100012356128_100000737910 [0,0,0,0,0,1|3,0,0]=4 391 B16R2.25778 Cc1occc(=O)c1OCC2=NCCN2 34a_100000031901_100000737910 [0,0,0,0,0,1|3,0,0]=4 392 B16R2.25778 Clc1cccc(c1CCN2CCCC2)Cl 2230a_100000188435_100012161200 [0,0,0,0,0,1|3,0,0]=4 393 B16R2.25778 Clc1cccc(c1CCN2CCCC2)Cl 269982a_100000188435_100012161200 [0,0,0,0,0,1|3,0,0]=4 394 B16R2.25778 Clc1cccc(c1CNC2CCCC2)Cl 207a_100000211070_100000189306 [0,0,0,0,0,1|2,0,1]=4 395 B16R2.25778 Clc1cccc(c1CNC2CCCC2)Cl 2230a_100000174884_100000179811 [0,0,0,0,0,1|2,0,1]=4 396 B16R2.25778 Clc1cccc(c1CNC2CCCC2)Cl 2230a_100000211070_100000187851 [0,0,0,0,0,1|2,0,1]=4 397 B16R2.25778 Clc1cccc(c1CNC2CCCC2)Cl 270004a_100000174884_100000210133 [0,0,0,0,0,1|2,0,1]=4 398 B16R2.25778 Clc1cccc(c1CNC2CCCC2)Cl 270004a_100000211070_100000189306 [0,0,0,0,0,1|2,0,1]=4 399 B16R2.25778 Clc1cccc(c1CNC2CCCC2)Cl 34a_100000174884_100000179811 [0,0,0,0,0,1|2,0,1]=4 400 B16R2.25778 Clc1cccc(c1CNC2CCCC2)Cl 34a_100000211070_100000187851 [0,0,0,0,0,1|2,0,1]=4 401 B16R2.25778 Clc1cccc(c1CNc2ncns2)Cl 27a_100000174884_100000693119 [0,0,0,0,0,1|2,0,1]=4 402 B16R2.25778 Clc1cccc(c1CNc2nncs2)Cl 27a_100000174884_100000739804 [0,0,0,0,0,1|2,0,1]=4 403 B16R2.25778 Clc1cccc(c1COC2CCCC2)Cl 34a_100000210269_100000187851 [0,0,0,0,0,1|2,0,1]=4 404 B16R2.25778 Clc1cccc(c1COC2CCCC2)Cl 34a_100000215722_100000179811 [0,0,0,0,0,1|2,0,1]=4 405 B16R2.25778 Clc1cccc(c1COC2CCCC2)Cl 7a_100000210269_100000187851 [0,0,0,0,0,1|2,0,1]=4 406 B16R2.25778 Clc1cccc(c1COC2CCCC2)Cl 7a_100000215722_100000179811 [0,0,0,0,0,1|2,0,1]=4 407 B16R2.25778 Clc1cccc(c1COC2CCCO2)Cl 34a_100000085407_100000187851 [0,0,0,0,0,1|2,0,1]=4 408 B16R2.25778 Clc1cccc(c1CSC2CCCC2)Cl 62a_100000187851_100000179811 [0,0,0,0,0,1|2,0,1]=4 409 B16R2.25778 Clc1cccc(c1CSC2CCCC2)Cl 62a_100011217020_100000187851 [0,0,0,0,0,1|2,0,1]=4 410 B16R2.25778 Clc1cccc(c1CSc2c[nH]cn2)Cl 62a_100000187851_100000756875 [0,0,0,0,0,1|2,0,1]=4 411 B16R2.25778 Clc1cccc(c1CSc2c[nH]cn2)Cl 62a_100000756875_100000187851 [0,0,0,0,0,1|2,0,1]=4 412 B16R2.25778 Clc1cccc(c1CSc2c[nH]nn2)Cl 62a_100000187851_100009819707 [0,0,0,0,0,1|3,0,0]=4 413 B16R2.25778 Clc1cccc(c1CSc2c[nH]nn2)Cl 62a_100009819707_100000187851 [0,0,0,0,0,1|3,0,0]=4 414 B16R2.25778 Clc1cccc(c1CSc2cc[nH]n2)Cl 62a_100000062575_100000187851 [0,0,0,0,0,1|2,0,1]=4 415 B16R2.25778 Clc1cccc(c1CSc2cc[nH]n2)Cl 62a_100000187851_100000062575 [0,0,0,0,0,1|2,0,1]=4 416 B16R2.25778 Clc1cccc(c1CSc2ccon2)Cl 62a_100000187851_100009818083 [0,0,0,0,0,1|2,0,1]=4 417 B16R2.25778 Clc1cccc(c1CSc2ccon2)Cl 62a_100009818083_100000187851 [0,0,0,0,0,1|2,0,1]=4 418 B16R2.25778 Clc1cccc(c1CSc2ccsn2)Cl 62a_100000187851_100009818082 [0,0,0,0,0,1|2,0,1]=4 419 B16R2.25778 Clc1cccc(c1CSc2ccsn2)Cl 62a_100009818082_100000187851 [0,0,0,0,0,1|2,0,1]=4 420 B16R2.25778 Clc1cccc(c1CSc2cscn2)Cl 62a_100000187851_100000751502 [0,0,0,0,0,1|2,0,1]=4 421 B16R2.25778 Clc1cccc(c1CSc2cscn2)Cl 62a_100000751502_100000187851 [0,0,0,0,0,1|2,0,1]=4 422 B16R2.25778 Clc1cccc(c1CSc2nc[nH]n2)Cl 62a_100000187851_100000761765 [0,0,0,0,0,1|1,0,2]=4 423 B16R2.25778 Clc1cccc(c1CSc2nc[nH]n2)Cl 62a_100000761765_100000187851 [0,0,0,0,0,1|1,0,2]=4 424 B16R2.25778 Clc1cccc(c1CSc2ncc[nH]2)Br 62a_100010138402_100025796157 [0,0,0,0,0,1|0,1,2]=4 425 B16R2.25778 Clc1cccc(c1CSc2ncc[nH]2)Br 62a_100025796157_100010138402 [0,0,0,0,0,1|0,1,2]=4 426 B16R2.25778 Clc1cccc(c1CSc2ncc[nH]2)Cl 62a_100000187851_100025796157 [0,0,0,0,0,1|0,0,2]=3 427 B16R2.25778 Clc1cccc(c1CSc2ncc[nH]2)Cl 62a_100025796157_100000187851 [0,0,0,0,0,1|0,0,2]=3 428 B16R2.25778 Clc1cccc(c1CSc2ncco2)Cl 62a_100000187851_100011787736 [0,0,0,0,0,1|1,0,2]=4 429 B16R2.25778 Clc1cccc(c1CSc2ncco2)Cl 62a_100011787736_100000187851 [0,0,0,0,0,1|1,0,2]=4 430 B16R2.25778 Clc1cccc(c1CSc2nccs2)Cl 62a_100000187851_100000211983 [0,0,0,0,0,1|1,0,2]=4 431 B16R2.25778 Clc1cccc(c1CSc2nccs2)Cl 62a_100000211983_100000187851 [0,0,0,0,0,1|1,0,2]=4 432 B16R2.25778 Clc1cccc(c1CSc2ncns2)Cl 62a_100000187851_100000693119 [0,0,0,0,0,1|2,0,1]=4 433 B16R2.25778 Clc1cccc(c1CSc2ncns2)Cl 62a_100000693119_100000187851 [0,0,0,0,0,1|2,0,1]=4 434 B16R2.25778 Clc1cccc(c1CSc2nncs2)Cl 62a_100000187851_100000739804 [0,0,0,0,0,1|2,0,1]=4 435 B16R2.25778 Clc1cccc(c1CSc2nncs2)Cl 62a_100000739804_100000187851 [0,0,0,0,0,1|2,0,1]=4 436 B16R2.25778 Clc1cccc(c1NCC2=NCCN2)Br 34a_100102946385_100000737910 [0,0,0,0,0,1|0,1,0]=2 437 B16R2.25778 Clc1cccc(c1NCC2=NCCN2)Cl 34a_100000210028_100000737910 [0,0,0,0,0,1|0,0,0]=1 438 B16R2.25778 Clc1cccc(c1NCC2CCCC2)Cl 34a_100000210028_100000740388 [0,0,0,0,0,1|2,0,1]=4 439 B16R2.25778 Clc1cccc(c1NCC2OCCO2)Cl 34a_100000210028_100000755774 [0,0,0,0,0,1|2,0,1]=4 440 B16R2.25778 Clc1cccc(c1NCc2c[nH]cn2)Cl 34a_100000210028_100000707719 [0,0,0,0,0,1|2,0,1]=4 441 B16R2.25778 Clc1cccc(c1NCc2ccn[nH]2)Cl 34a_100000210028_100000728653 [0,0,0,0,0,1|2,0,1]=4 442 B16R2.25778 Clc1cccc(c1NCc2ccon2)Cl 34a_100000210028_100000234950 [0,0,0,0,0,1|2,0,1]=4 443 B16R2.25778 Clc1cccc(c1NCc2cscn2)Cl 34a_100000210028_100000205941 [0,0,0,0,0,1|2,0,1]=4 444 B16R2.25778 Clc1cccc(c1NCc2ncc[nH]2)Br 34a_100102946385_100016991755 [0,0,0,0,0,1|0,1,2]=4 445 B16R2.25778 Clc1cccc(c1NCc2ncc[nH]2)Cl 34a_100000210028_100016991755 [0,0,0,0,0,1|0,0,2]=3 446 B16R2.25778 Clc1cccc(c1NCc2ncco2)Cl 34a_100000210028_103436540062 [0,0,0,0,0,1|1,0,2]=4 447 B16R2.25778 Clc1cccc(c1NCc2nccs2)Cl 34a_100000210028_100015184050 [0,0,0,0,0,1|1,0,2]=4 448 B16R2.25778 Clc1cccc(c1NCc2ncon2)Cl 34a_100000210028_100000233494 [0,0,0,0,0,1|1,0,2]=4 449 B16R2.25778 Clc1cccc(c1NCc2nnn[nH]2)Br 34a_100102946385_100000765167 [0,0,0,0,0,1|2,1,0]=4 450 B16R2.25778 Clc1cccc(c1NCc2nnn[nH]2)Cl 34a_100000210028_100000765167 [0,0,0,0,0,1|2,0,0]=3 451 B16R2.25778 Clc1cccc(c1NN=C2CCCC2)Cl 4a_100000688888_100000210133 [0,0,0,0,0,1|3,0,0]=4 452 B16R2.25778 Clc1cccc(c1OCC2=NCCN2)Br 34a_100010214474_100000737910 [0,0,0,0,0,1|0,1,0]=2 453 B16R2.25778 Clc1cccc(c1OCC2=NCCN2)Br 7a_100010214474_100000737910 [0,0,0,0,0,1|0,1,0]=2 454 B16R2.25778 Clc1cccc(c1OCC2=NCCN2)Cl 34a_100000211709_100000737910 [0,0,0,0,0,1|0,0,0]=1 455 B16R2.25778 Clc1cccc(c1OCC2=NCCN2)Cl 7a_100000211709_100000737910 [0,0,0,0,0,1|0,0,0]=1 456 B16R2.25778 Clc1cccc(c1OCC2=NCCN2)I 34a_100010202889_100000737910 [0,0,0,0,0,1|0,1,0]=2 457 B16R2.25778 Clc1cccc(c1OCC2=NCCN2)I 7a_100010202889_100000737910 [0,0,0,0,0,1|0,1,0]=2 458 B16R2.25778 Clc1cccc(c1OCC2CCCC2)Cl 34a_100000211709_100000740388 [0,0,0,0,0,1|2,0,1]=4 459 B16R2.25778 Clc1cccc(c1OCC2CCCC2)Cl 7a_100000211709_100000740388 [0,0,0,0,0,1|2,0,1]=4 460 B16R2.25778 Clc1cccc(c1OCC2CCCO2)Cl 7a_100000211709_100000203698 [0,0,0,0,0,1|2,0,1]=4 461 B16R2.25778 Clc1cccc(c1OCC2OCCO2)Cl 34a_100000211709_100000755774 [0,0,0,0,0,1|2,0,1]=4 462 B16R2.25778 Clc1cccc(c1OCC2OCCO2)Cl 7a_100000211709_100000755774 [0,0,0,0,0,1|2,0,1]=4 463 B16R2.25778 Clc1cccc(c1OCc2c[nH]cn2)Cl 34a_100000211709_100000707719 [0,0,0,0,0,1|2,0,1]=4 464 B16R2.25778 Clc1cccc(c1OCc2ccn[nH]2)Cl 34a_100000211709_100000728653 [0,0,0,0,0,1|2,0,1]=4 465 B16R2.25778 Clc1cccc(c1OCc2ccn[nH]2)Cl 7a_100000211709_100000728653 [0,0,0,0,0,1|2,0,1]=4 466 B16R2.25778 Clc1cccc(c1OCc2ccon2)Cl 34a_100000211709_100000234950 [0,0,0,0,0,1|2,0,1]=4 467 B16R2.25778 Clc1cccc(c1OCc2ccon2)Cl 7a_100000211709_100000234950 [0,0,0,0,0,1|2,0,1]=4 468 B16R2.25778 Clc1cccc(c1OCc2cscn2)Cl 34a_100000211709_100000205941 [0,0,0,0,0,1|2,0,1]=4 469 B16R2.25778 Clc1cccc(c1OCc2cscn2)Cl 7a_100000211709_100000205941 [0,0,0,0,0,1|2,0,1]=4 470 B16R2.25778 Clc1cccc(c1OCc2ncc[nH]2)Br 34a_100010214474_100016991755 [0,0,0,0,0,1|0,1,2]=4 471 B16R2.25778 Clc1cccc(c1OCc2ncc[nH]2)Br 7a_100010214474_100000753453 [0,0,0,0,0,1|0,1,2]=4 472 B16R2.25778 Clc1cccc(c1OCc2ncc[nH]2)Cl 34a_100000211709_100016991755 [0,0,0,0,0,1|0,0,2]=3 473 B16R2.25778 Clc1cccc(c1OCc2ncc[nH]2)Cl 7a_100000211709_100000753453 [0,0,0,0,0,1|0,0,2]=3 474 B16R2.25778 Clc1cccc(c1OCc2ncc[nH]2)I 34a_100010202889_100016991755 [0,0,0,0,0,1|0,1,2]=4 475 B16R2.25778 Clc1cccc(c1OCc2ncc[nH]2)I 7a_100010202889_100000753453 [0,0,0,0,0,1|0,1,2]=4 476 B16R2.25778 Clc1cccc(c1OCc2ncco2)Cl 34a_100000211709_103436540062 [0,0,0,0,0,1|1,0,2]=4 477 B16R2.25778 Clc1cccc(c1OCc2ncco2)Cl 7a_100000211709_103436540062 [0,0,0,0,0,1|1,0,2]=4 478 B16R2.25778 Clc1cccc(c1OCc2nccs2)Cl 34a_100000211709_100015184050 [0,0,0,0,0,1|1,0,2]=4 479 B16R2.25778 Clc1cccc(c1OCc2nccs2)Cl 7a_100000211709_100015184050 [0,0,0,0,0,1|1,0,2]=4 480 B16R2.25778 Clc1cccc(c1OCc2ncon2)Cl 34a_100000211709_100000233494 [0,0,0,0,0,1|1,0,2]=4 481 B16R2.25778 Clc1cccc(c1OCc2nnn[nH]2)Br 34a_100010214474_100000765167 [0,0,0,0,0,1|2,1,0]=4 482 B16R2.25778 Clc1cccc(c1OCc2nnn[nH]2)Br 7a_100010214474_100000765167 [0,0,0,0,0,1|2,1,0]=4 483 B16R2.25778 Clc1cccc(c1OCc2nnn[nH]2)Cl 34a_100000211709_100000765167 [0,0,0,0,0,1|2,0,0]=3 484 B16R2.25778 Clc1cccc(c1OCc2nnn[nH]2)Cl 7a_100000211709_100000765167 [0,0,0,0,0,1|2,0,0]=3 485 B16R2.25778 Clc1cccc(c1OCc2nnn[nH]2)I 34a_100010202889_100000765167 [0,0,0,0,0,1|2,1,0]=4 486 B16R2.25778 Clc1cccc(c1OCc2nnn[nH]2)I 7a_100010202889_100000765167 [0,0,0,0,0,1|2,1,0]=4 487 B16R2.25778 Clc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100010214488 [0,0,0,0,0,1|0,1,0]=2 488 B16R2.25778 Clc1cccc(c1SCC2=NCCN2)Br 62a_100010214488_100000737910 [0,0,0,0,0,1|0,1,0]=2 489 B16R2.25778 Clc1cccc(c1SCC2=NCCN2)Cl 62a_100000034237_100000737910 [0,0,0,0,0,1|0,0,0]=1 490 B16R2.25778 Clc1cccc(c1SCC2=NCCN2)Cl 62a_100000737910_100000034237 [0,0,0,0,0,1|0,0,0]=1 491 B16R2.25778 Clc1cccc(c1SCC2CCCC2)Cl 62a_100000034237_100000740388 [0,0,0,0,0,1|2,0,1]=4 492 B16R2.25778 Clc1cccc(c1SCC2CCCC2)Cl 62a_100000740388_100000034237 [0,0,0,0,0,1|2,0,1]=4 493 B16R2.25778 Clc1cccc(c1SCC2CCCO2)Cl 62a_100000034237_100000203698 [0,0,0,0,0,1|2,0,1]=4 494 B16R2.25778 Clc1cccc(c1SCC2CCCO2)Cl 62a_100000203698_100000034237 [0,0,0,0,0,1|2,0,1]=4 495 B16R2.25778 Clc1cccc(c1SCC2OCCO2)Cl 62a_100000034237_100000755774 [0,0,0,0,0,1|2,0,1]=4 496 B16R2.25778 Clc1cccc(c1SCC2OCCO2)Cl 62a_100000755774_100000034237 [0,0,0,0,0,1|2,0,1]=4 497 B16R2.25778 Clc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000034237_100000707719 [0,0,0,0,0,1|2,0,1]=4 498 B16R2.25778 Clc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000034237 [0,0,0,0,0,1|2,0,1]=4 499 B16R2.25778 Clc1cccc(c1SCc2ccn[nH]2)Cl 62a_100000034237_100000728653 [0,0,0,0,0,1|2,0,1]=4 500 B16R2.25778 Clc1cccc(c1SCc2ccn[nH]2)Cl 62a_100000728653_100000034237 [0,0,0,0,0,1|2,0,1]=4 501 B16R2.25778 Clc1cccc(c1SCc2ccon2)Cl 62a_100000034237_100000234950 [0,0,0,0,0,1|2,0,1]=4 502 B16R2.25778 Clc1cccc(c1SCc2ccon2)Cl 62a_100000234950_100000034237 [0,0,0,0,0,1|2,0,1]=4 503 B16R2.25778 Clc1cccc(c1SCc2cscn2)Cl 62a_100000034237_100000205941 [0,0,0,0,0,1|2,0,1]=4 504 B16R2.25778 Clc1cccc(c1SCc2cscn2)Cl 62a_100000205941_100000034237 [0,0,0,0,0,1|2,0,1]=4 505 B16R2.25778 Clc1cccc(c1SCc2ncc[nH]2)Br 62a_100010214488_100016991755 [0,0,0,0,0,1|0,1,2]=4 506 B16R2.25778 Clc1cccc(c1SCc2ncc[nH]2)Br 62a_100016991755_100010214488 [0,0,0,0,0,1|0,1,2]=4 507 B16R2.25778 Clc1cccc(c1SCc2ncc[nH]2)Cl 62a_100000034237_100016991755 [0,0,0,0,0,1|0,0,2]=3 508 B16R2.25778 Clc1cccc(c1SCc2ncc[nH]2)Cl 62a_100016991755_100000034237 [0,0,0,0,0,1|0,0,2]=3 509 B16R2.25778 Clc1cccc(c1SCc2ncco2)Cl 62a_100000034237_103436540062 [0,0,0,0,0,1|1,0,2]=4 510 B16R2.25778 Clc1cccc(c1SCc2ncco2)Cl 62a_103436540062_100000034237 [0,0,0,0,0,1|1,0,2]=4 511 B16R2.25778 Clc1cccc(c1SCc2nccs2)Cl 62a_100000034237_100015184050 [0,0,0,0,0,1|1,0,2]=4 512 B16R2.25778 Clc1cccc(c1SCc2nccs2)Cl 62a_100015184050_100000034237 [0,0,0,0,0,1|1,0,2]=4 513 B16R2.25778 Clc1cccc(c1SCc2ncon2)Cl 62a_100000034237_100000233494 [0,0,0,0,0,1|1,0,2]=4 514 B16R2.25778 Clc1cccc(c1SCc2ncon2)Cl 62a_100000233494_100000034237 [0,0,0,0,0,1|1,0,2]=4 515 B16R2.25778 Clc1cccc(c1SCc2nnn[nH]2)Br 62a_100000765167_100010214488 [0,0,0,0,0,1|2,1,0]=4 516 B16R2.25778 Clc1cccc(c1SCc2nnn[nH]2)Br 62a_100010214488_100000765167 [0,0,0,0,0,1|2,1,0]=4 517 B16R2.25778 Clc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000034237_100000765167 [0,0,0,0,0,1|2,0,0]=3 518 B16R2.25778 Clc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000765167_100000034237 [0,0,0,0,0,1|2,0,0]=3 519 B16R2.25778 Clc1ccnc(c1OCC2=NCCN2)Cl 34a_100000118450_100000737910 [0,0,0,0,0,1|1,0,0]=2 520 B16R2.25778 Clc1ccnc(c1OCC2=NCCN2)Cl 7a_100000118450_100000737910 [0,0,0,0,0,1|1,0,0]=2 521 B16R2.25778 Clc1ccnc(c1OCc2ncc[nH]2)Cl 34a_100000118450_100016991755 [0,0,0,0,0,1|1,0,2]=4 522 B16R2.25778 Clc1ccnc(c1OCc2ncc[nH]2)Cl 7a_100000118450_100000753453 [0,0,0,0,0,1|1,0,2]=4 523 B16R2.25778 Clc1ccnc(c1OCc2nnn[nH]2)Cl 34a_100000118450_100000765167 [0,0,0,0,0,1|3,0,0]=4 524 B16R2.25778 Clc1ccnc(c1OCc2nnn[nH]2)Cl 7a_100000118450_100000765167 [0,0,0,0,0,1|3,0,0]=4 525 B16R2.25778 Clc1ccnc(c1SCC2=NCCN2)Cl 62a_100000050019_100000737910 [0,0,0,0,0,1|1,0,0]=2 526 B16R2.25778 Clc1ccnc(c1SCC2=NCCN2)Cl 62a_100000737910_100000050019 [0,0,0,0,0,1|1,0,0]=2 527 B16R2.25778 Clc1ccnc(c1SCc2ncc[nH]2)Cl 62a_100000050019_100016991755 [0,0,0,0,0,1|1,0,2]=4 528 B16R2.25778 Clc1ccnc(c1SCc2ncc[nH]2)Cl 62a_100016991755_100000050019 [0,0,0,0,0,1|1,0,2]=4 529 B16R2.25778 Clc1ccnc(c1SCc2nnn[nH]2)Cl 62a_100000050019_100000765167 [0,0,0,0,0,1|3,0,0]=4 530 B16R2.25778 Clc1ccnc(c1SCc2nnn[nH]2)Cl 62a_100000765167_100000050019 [0,0,0,0,0,1|3,0,0]=4 531 B16R2.25778 Clc1cncc(c1CSc2ncc[nH]2)Cl 62a_100025796157_200009872113 [0,0,0,0,0,1|1,0,2]=4 532 B16R2.25778 Clc1cncc(c1CSc2ncc[nH]2)Cl 62a_200009872113_100025796157 [0,0,0,0,0,1|1,0,2]=4 533 B16R2.25778 Clc1cncc(c1SCC2=NCCN2)Cl 62a_100000036193_100000737910 [0,0,0,0,0,1|1,0,0]=2 534 B16R2.25778 Clc1cncc(c1SCC2=NCCN2)Cl 62a_100000737910_100000036193 [0,0,0,0,0,1|1,0,0]=2 535 B16R2.25778 Clc1cncc(c1SCc2ncc[nH]2)Cl 62a_100000036193_100016991755 [0,0,0,0,0,1|1,0,2]=4 536 B16R2.25778 Clc1cncc(c1SCc2ncc[nH]2)Cl 62a_100016991755_100000036193 [0,0,0,0,0,1|1,0,2]=4 537 B16R2.25778 Clc1cncc(c1SCc2nnn[nH]2)Cl 62a_100000036193_100000765167 [0,0,0,0,0,1|3,0,0]=4 538 B16R2.25778 Clc1cncc(c1SCc2nnn[nH]2)Cl 62a_100000765167_100000036193 [0,0,0,0,0,1|3,0,0]=4 539 B16R2.25778 Clc1nccc(c1OCC2=NCCN2)I 34a_100010067911_100000737910 [0,0,0,0,0,1|1,1,0]=3 540 B16R2.25778 Clc1nccc(c1OCC2=NCCN2)I 7a_100010067911_100000737910 [0,0,0,0,0,1|1,1,0]=3 541 B16R2.25778 Clc1nccc(c1SCC2=NCCN2)Br 62a_100000737910_100009814607 [0,0,0,0,0,1|1,1,0]=3 542 B16R2.25778 Clc1nccc(c1SCC2=NCCN2)Br 62a_100009814607_100000737910 [0,0,0,0,0,1|1,1,0]=3 543 B16R2.25778 Clc1ncnc(c1OCC2=NCCN2)Cl 34a_100009876168_100000737910 [0,0,0,0,0,1|2,0,0]=3 544 B16R2.25778 Clc1ncnc(c1OCC2=NCCN2)Cl 7a_100009876168_100000737910 [0,0,0,0,0,1|2,0,0]=3 545 B16R2.25778 Clc1ncnc(c1SCC2=NCCN2)Cl 62a_100000737910_100012348147 [0,0,0,0,0,1|2,0,0]=3 546 B16R2.25778 Fc1cccc(c1CSc2ncc[nH]2)Cl 62a_100000187852_100025796157 [0,0,0,0,0,1|0,1,2]=4 547 B16R2.25778 Fc1cccc(c1CSc2ncc[nH]2)Cl 62a_100025796157_100000187852 [0,0,0,0,0,1|0,1,2]=4 548 B16R2.25778 Fc1cccc(c1NCC2=NCCN2)Br 34a_100000684712_100000737910 [0,0,0,0,0,1|0,2,0]=3 549 B16R2.25778 Fc1cccc(c1NCC2=NCCN2)Cl 34a_100000760031_100000737910 [0,0,0,0,0,1|0,1,0]=2 550 B16R2.25778 Fc1cccc(c1NCC2=NCCN2)F 34a_100000210704_100000737910 [0,0,0,0,0,1|0,2,0]=3 551 B16R2.25778 Fc1cccc(c1NCC2=NCCN2)I 34a_100000042321_100000737910 [0,0,0,0,0,1|0,2,0]=3 552 B16R2.25778 Fc1cccc(c1NCc2ncc[nH]2)Cl 34a_100000760031_100016991755 [0,0,0,0,0,1|0,1,2]=4 553 B16R2.25778 Fc1cccc(c1NCc2nnn[nH]2)Cl 34a_100000760031_100000765167 [0,0,0,0,0,1|2,1,0]=4 554 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)Br 34a_100009813666_100000737910 [0,0,0,0,0,1|0,2,0]=3 555 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)Br 7a_100009813666_100000737910 [0,0,0,0,0,1|0,2,0]=3 556 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)Cl 34a_100000694953_100000737910 [0,0,0,0,0,1|0,1,0]=2 557 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)Cl 7a_100000694953_100000737910 [0,0,0,0,0,1|0,1,0]=2 558 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)F 34a_100000230165_100000737910 [0,0,0,0,0,1|0,2,0]=3 559 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)F 7a_100000230165_100000737910 [0,0,0,0,0,1|0,2,0]=3 560 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)I 34a_100010186298_100000737910 [0,0,0,0,0,1|0,2,0]=3 561 B16R2.25778 Fc1cccc(c1OCC2=NCCN2)I 7a_100010186298_100000737910 [0,0,0,0,0,1|0,2,0]=3 562 B16R2.25778 Fc1cccc(c1OCc2ncc[nH]2)Cl 34a_100000694953_100016991755 [0,0,0,0,0,1|0,1,2]=4 563 B16R2.25778 Fc1cccc(c1OCc2ncc[nH]2)Cl 7a_100000694953_100000753453 [0,0,0,0,0,1|0,1,2]=4 564 B16R2.25778 Fc1cccc(c1OCc2nnn[nH]2)Cl 34a_100000694953_100000765167 [0,0,0,0,0,1|2,1,0]=4 565 B16R2.25778 Fc1cccc(c1OCc2nnn[nH]2)Cl 7a_100000694953_100000765167 [0,0,0,0,0,1|2,1,0]=4 566 B16R2.25778 Fc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100011219512 [0,0,0,0,0,1|0,2,0]=3 567 B16R2.25778 Fc1cccc(c1SCC2=NCCN2)Br 62a_100011219512_100000737910 [0,0,0,0,0,1|0,2,0]=3 568 B16R2.25778 Fc1cccc(c1SCC2=NCCN2)Cl 62a_100000050007_100000737910 [0,0,0,0,0,1|0,1,0]=2 569 B16R2.25778 Fc1cccc(c1SCC2=NCCN2)Cl 62a_100000737910_100000050007 [0,0,0,0,0,1|0,1,0]=2 570 B16R2.25778 Fc1cccc(c1SCC2=NCCN2)F 62a_100000693133_100000737910 [0,0,0,0,0,1|0,2,0]=3 571 B16R2.25778 Fc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100000693133 [0,0,0,0,0,1|0,2,0]=3 572 B16R2.25778 Fc1cccc(c1SCc2ncc[nH]2)Cl 62a_100000050007_100016991755 [0,0,0,0,0,1|0,1,2]=4 573 B16R2.25778 Fc1cccc(c1SCc2ncc[nH]2)Cl 62a_100016991755_100000050007 [0,0,0,0,0,1|0,1,2]=4 574 B16R2.25778 Fc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000050007_100000765167 [0,0,0,0,0,1|2,1,0]=4 575 B16R2.25778 Fc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000765167_100000050007 [0,0,0,0,0,1|2,1,0]=4 576 B16R2.25778 Fc1ccnc(c1OCC2=NCCN2)Cl 34a_100009867227_100000737910 [0,0,0,0,0,1|1,1,0]=3 577 B16R2.25778 Fc1ccnc(c1OCC2=NCCN2)Cl 7a_100009867227_100000737910 [0,0,0,0,0,1|1,1,0]=3 578 B16R2.25778 Fc1ccnc(c1SCC2=NCCN2)Cl 62a_100000716511_100000737910 [0,0,0,0,0,1|1,1,0]=3 579 B16R2.25778 Fc1ccnc(c1SCC2=NCCN2)Cl 62a_100000737910_100000716511 [0,0,0,0,0,1|1,1,0]=3 580 B16R2.25778 Fc1ccnc(c1SCC2=NCCN2)F 62a_100000737910_100009874084 [0,0,0,0,0,1|1,2,0]=4 581 B16R2.25778 Fc1ccnc(c1SCC2=NCCN2)F 62a_100009874084_100000737910 [0,0,0,0,0,1|1,2,0]=4 582 B16R2.25778 Fc1cncc(c1SCC2=NCCN2)F 62a_100000737910_100000760538 [0,0,0,0,0,1|1,2,0]=4 583 B16R2.25778 Fc1cncc(c1SCC2=NCCN2)F 62a_100000760538_100000737910 [0,0,0,0,0,1|1,2,0]=4 584 B16R2.25778 Nc1cccc(c1OCC2=NCCN2)Br 34a_100011934915_100000737910 [0,0,0,0,0,1|1,1,0]=3 585 B16R2.25778 Nc1cccc(c1OCC2=NCCN2)Cl 34a_100000754742_100000737910 [0,0,0,0,0,1|1,0,0]=2 586 B16R2.25778 Nc1cccc(c1OCC2=NCCN2)F 34a_100011934987_100000737910 [0,0,0,0,0,1|1,1,0]=3 587 B16R2.25778 Nc1cccc(c1OCC2=NCCN2)I 34a_100010084371_100000737910 [0,0,0,0,0,1|1,1,0]=3 588 B16R2.25778 Nc1cccc(c1OCC2=NCCN2)N 34a_200016994477_100000737910 [0,0,0,0,0,1|2,0,0]=3 589 B16R2.25778 Nc1cccc(c1OCc2ncc[nH]2)Cl 34a_100000754742_100016991755 [0,0,0,0,0,1|1,0,2]=4 590 B16R2.25778 Nc1cccc(c1OCc2nnn[nH]2)Cl 34a_100000754742_100000765167 [0,0,0,0,0,1|3,0,0]=4 591 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100020590159 [0,0,0,0,0,1|1,1,0]=3 592 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)Br 62a_100020590159_100000737910 [0,0,0,0,0,1|1,1,0]=3 593 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)Cl 62a_100000049713_100000737910 [0,0,0,0,0,1|1,0,0]=2 594 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)Cl 62a_100000737910_100000049713 [0,0,0,0,0,1|1,0,0]=2 595 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)F 62a_100000690935_100000737910 [0,0,0,0,0,1|1,1,0]=3 596 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100000690935 [0,0,0,0,0,1|1,1,0]=3 597 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)O 62a_100000737910_100012183704 [0,0,0,0,0,1|2,0,0]=3 598 B16R2.25778 Nc1cccc(c1SCC2=NCCN2)O 62a_100012183704_100000737910 [0,0,0,0,0,1|2,0,0]=3 599 B16R2.25778 Nc1cccc(c1SCc2ncc[nH]2)Cl 62a_100000049713_100016991755 [0,0,0,0,0,1|1,0,2]=4 600 B16R2.25778 Nc1cccc(c1SCc2ncc[nH]2)Cl 62a_100016991755_100000049713 [0,0,0,0,0,1|1,0,2]=4 601 B16R2.25778 Nc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000049713_100000765167 [0,0,0,0,0,1|3,0,0]=4 602 B16R2.25778 Nc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000765167_100000049713 [0,0,0,0,0,1|3,0,0]=4 603 B16R2.25778 Nc1ccnc(c1OCC2=NCCN2)Cl 34a_100009844647_100000737910 [0,0,0,0,0,1|2,0,0]=3 604 B16R2.25778 Nc1ccnc(c1OCC2=NCCN2)Cl 7a_100009844647_100000737910 [0,0,0,0,0,1|2,0,0]=3 605 B16R2.25778 Nc1ccnc(c1SCC2=NCCN2)Cl 62a_100000737910_100010208016 [0,0,0,0,0,1|2,0,0]=3 606 B16R2.25778 Nc1ccnc(c1SCC2=NCCN2)Cl 62a_100010208016_100000737910 [0,0,0,0,0,1|2,0,0]=3 607 B16R2.25778 Nc1ccnc(c1SCC2=NCCN2)F 62a_100000737910_100010381272 [0,0,0,0,0,1|2,1,0]=4 608 B16R2.25778 Nc1ccnc(c1SCC2=NCCN2)F 62a_100010381272_100000737910 [0,0,0,0,0,1|2,1,0]=4 609 B16R2.25778 Nc1nccc(c1SCC2=NCCN2)Cl 62a_100000737910_100010199028 [0,0,0,0,0,1|2,0,0]=3 610 B16R2.25778 Nc1nccc(c1SCC2=NCCN2)Cl 62a_100010199028_100000737910 [0,0,0,0,0,1|2,0,0]=3 611 B16R2.25778 Nc1ncnc(c1OCC2=NCCN2)Cl 34a_100000124137_100000737910 [0,0,0,0,0,1|3,0,0]=4 612 B16R2.25778 Nc1ncnc(c1OCC2=NCCN2)Cl 7a_100000124137_100000737910 [0,0,0,0,0,1|3,0,0]=4 613 B16R2.25778 Nc1ncnc(c1SCC2=NCCN2)Cl 62a_100000737910_100010371481 [0,0,0,0,0,1|3,0,0]=4 614 B16R2.25778 Nc1ncnc(c1SCC2=NCCN2)Cl 62a_100010371481_100000737910 [0,0,0,0,0,1|3,0,0]=4 615 B16R2.25778 Oc1cccc(c1NCC2=NCCN2)Br 34a_100011934926_100000737910 [0,0,0,0,0,1|1,1,0]=3 616 B16R2.25778 Oc1cccc(c1NCC2=NCCN2)Cl 34a_100012022510_100000737910 [0,0,0,0,0,1|1,0,0]=2 617 B16R2.25778 Oc1cccc(c1NCC2=NCCN2)F 34a_100020591140_100000737910 [0,0,0,0,0,1|1,1,0]=3 618 B16R2.25778 Oc1cccc(c1NCc2ncc[nH]2)Cl 34a_100012022510_100016991755 [0,0,0,0,0,1|1,0,2]=4 619 B16R2.25778 Oc1cccc(c1NCc2nnn[nH]2)Cl 34a_100012022510_100000765167 [0,0,0,0,0,1|3,0,0]=4 620 B16R2.25778 Oc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100010187912 [0,0,0,0,0,1|1,1,0]=3 621 B16R2.25778 Oc1cccc(c1SCC2=NCCN2)Br 62a_100010187912_100000737910 [0,0,0,0,0,1|1,1,0]=3 622 B16R2.25778 Oc1cccc(c1SCC2=NCCN2)Cl 62a_100000737910_100000050174 [0,0,0,0,0,1|1,0,0]=2 623 B16R2.25778 Oc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100009820682 [0,0,0,0,0,1|1,1,0]=3 624 B16R2.25778 Oc1cccc(c1SCC2=NCCN2)F 62a_100009820682_100000737910 [0,0,0,0,0,1|1,1,0]=3 625 B16R2.25778 Oc1cccc(c1SCC2=NCCN2)O 62a_100000737910_100010205330 [0,0,0,0,0,1|2,0,0]=3 626 B16R2.25778 Oc1cccc(c1SCc2ncc[nH]2)Cl 62a_100016991755_100000050174 [0,0,0,0,0,1|1,0,2]=4 627 B16R2.25778 Oc1cccc(c1SCc2nnn[nH]2)Cl 62a_100000765167_100000050174 [0,0,0,0,0,1|3,0,0]=4 628 B16R2.25778 Oc1ccnc(c1SCC2=NCCN2)O 62a_100000737910_200009817435 [0,0,0,0,0,1|3,0,0]=4 629 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Cl 1458a_100000210414_100010138402 [1,0,1,0,0,0|1,1,0]=4 630 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210202 [1,0,1,0,0,0|1,1,0]=4 631 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000210414_100000187851 [1,0,1,0,0,0|1,0,0]=3 632 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210202 [1,0,1,0,0,0|1,0,0]=3 633 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000210202 [1,0,1,0,0,0|1,1,0]=4 634 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)F 1458a_100000210414_100000187852 [1,0,1,0,0,0|1,1,0]=4 635 B13R1.4928 CCC(=O)Cc1c(cncc1Cl)Cl 1458a_100000210414_200009872113 [1,0,1,0,0,0|2,0,0]=4 636 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100000210414 [1,0,1,0,0,0|2,0,0]=4 637 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100000210414 [1,0,1,0,0,0|2,0,0]=4 638 B13R1.4928 CCN(C)Cc1c(cccc1Cl)Cl 2230a_100000186903_100000210202 [1,0,1,0,0,0|2,0,0]=4 639 B13R1.4928 CCN(C)Cc1c(cccc1Cl)Cl 2230a_100000225621_100000187851 [1,0,1,0,0,0|2,0,0]=4 640 B13R1.4928 CCN(C)Cc1c(cccc1Cl)Cl 269982a_100000186903_100000204670 [1,0,1,0,0,0|2,0,0]=4 641 B13R1.4928 CCN(C)Cc1c(cccc1Cl)Cl 269982a_100000225621_100000211241 [1,0,1,0,0,0|2,0,0]=4 642 B13R1.4928 CCN(C)Cc1c(cccc1Cl)Cl 26a_100000225621_100000211709 [1,0,1,0,0,0|2,0,0]=4 643 B13R1.4928 CCN(C)Cc1c(cccc1Cl)Cl 34a_100000186903_100000210202 [1,0,1,0,0,0|2,0,0]=4 644 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 11a_106832991635_100013084675 [1,0,1,0,0,0|1,1,0]=4 645 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 1626a_100102657272_100013084675 [1,0,1,0,0,0|1,1,0]=4 646 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 240690a_100102657272_100013084675 [1,0,1,0,0,0|1,1,0]=4 647 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 527a_100102657272_100013084675 [1,0,1,0,0,0|1,1,0]=4 648 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 11a_106832991635_100000211232 [1,0,1,0,0,0|1,0,0]=3 649 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 1626a_100102657272_100000211232 [1,0,1,0,0,0|1,0,0]=3 650 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 240690a_100102657272_100000211232 [1,0,1,0,0,0|1,0,0]=3 651 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 527a_100102657272_100000211232 [1,0,1,0,0,0|1,0,0]=3 652 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 11a_106832991635_100000185183 [1,0,1,0,0,0|1,1,0]=4 653 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 1626a_100102657272_100000185183 [1,0,1,0,0,0|1,1,0]=4 654 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 240690a_100102657272_100000185183 [1,0,1,0,0,0|1,1,0]=4 655 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 527a_100102657272_100000185183 [1,0,1,0,0,0|1,1,0]=4 656 B13R1.4928 CNC(C)Cc1c(cccc1Cl)Cl 270004a_106832991635_100000692661 [1,0,1,0,0,0|0,0,1]=3 657 B13R1.4928 O=C(CF)Cc1c(cccc1Cl)Cl 1458a_100000211232_100015361967 [1,0,1,0,0,0|2,0,0]=4 658 B13R1.4928 O=C(CO)Cc1c(cccc1Cl)Cl 1458a_100000210174_100000187851 [1,0,1,0,0,0|2,0,0]=4 659 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210303 [1,0,1,0,0,0|2,0,0]=4 660 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000211992_100000187162 [1,0,1,0,0,0|2,0,0]=4 661 B13R1.470 CCNC(=O)Cc1ccccc1Br 11a_100015525214_100000751119 [1,0,1,0,0,0|1,1,0]=4 662 B13R1.470 CCNC(=O)Cc1ccccc1Br 240690a_100015525214_100000751119 [1,0,1,0,0,0|1,1,0]=4 663 B13R1.470 CCNC(=O)Cc1ccccc1Br 527a_100015525214_100000751119 [1,0,1,0,0,0|1,1,0]=4 664 B13R1.470 CCNC(=O)Cc1ccccc1C 11a_100015525214_100000212180 [1,0,1,0,0,0|2,0,0]=4 665 B13R1.470 CCNC(=O)Cc1ccccc1C 240690a_100015525214_100000212180 [1,0,1,0,0,0|2,0,0]=4 666 B13R1.470 CCNC(=O)Cc1ccccc1C 527a_100015525214_100000212180 [1,0,1,0,0,0|2,0,0]=4 667 B13R1.470 CCNC(=O)Cc1ccccc1Cl 11a_100015525214_100000183793 [1,0,1,0,0,0|1,0,0]=3 668 B13R1.470 CCNC(=O)Cc1ccccc1Cl 240690a_100015525214_100000183793 [1,0,1,0,0,0|1,0,0]=3 669 B13R1.470 CCNC(=O)Cc1ccccc1Cl 527a_100015525214_100000183793 [1,0,1,0,0,0|1,0,0]=3 670 B13R1.470 CCNC(=O)Cc1ccccc1F 11a_100015525214_100000212012 [1,0,1,0,0,0|1,1,0]=4 671 B13R1.470 CCNC(=O)Cc1ccccc1F 240690a_100015525214_100000212012 [1,0,1,0,0,0|1,1,0]=4 672 B13R1.470 CCNC(=O)Cc1ccccc1F 527a_100015525214_100000212012 [1,0,1,0,0,0|1,1,0]=4 673 B13R1.470 CCNC(=O)Cc1ccccc1I 11a_100015525214_100000036491 [1,0,1,0,0,0|1,1,0]=4 674 B13R1.470 CCNC(=O)Cc1ccccc1I 240690a_100015525214_100000036491 [1,0,1,0,0,0|1,1,0]=4 675 B13R1.470 CCNC(=O)Cc1ccccc1I 527a_100015525214_100000036491 [1,0,1,0,0,0|1,1,0]=4 676 B13R1.470 CCNC(=O)Cc1ccccc1O 240690a_100015525214_100000743006 [1,0,1,0,0,0|2,0,0]=4 677 B13R1.470 CCNC(=O)Cc1ccccc1O 271570a_203496583355_200009816148 [1,0,1,0,0,0|2,0,0]=4 678 B13R1.470 CCNC(=O)Cc1ccccc1O 527a_100015525214_100000743006 [1,0,1,0,0,0|2,0,0]=4 679 B13R1.470 CCNC(=O)Cc1cccnc1Cl 11a_100015525214_100000093521 [1,0,1,0,0,0|2,0,0]=4 680 B13R1.470 CCNC(=O)Cc1cccnc1Cl 240690a_100015525214_100000093521 [1,0,1,0,0,0|2,0,0]=4 681 B13R1.470 CCNC(=O)Cc1cccnc1Cl 527a_100015525214_100000093521 [1,0,1,0,0,0|2,0,0]=4 682 B13R1.470 CCNC(=O)Cc1ncccc1Cl 11a_100015525214_100011998755 [1,0,1,0,0,0|2,0,0]=4 683 B13R1.470 CCNC(=O)Cc1ncccc1Cl 240690a_100015525214_100011998755 [1,0,1,0,0,0|2,0,0]=4 684 B13R1.470 CCNC(=O)Cc1ncccc1Cl 527a_100015525214_100011998755 [1,0,1,0,0,0|2,0,0]=4 685 B13R1.470 CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100015525214 [1,0,1,0,0,0|2,0,0]=4 686 B13R1.470 CCNC(C)Cc1ccccc1Cl 270004a_100015525214_100000758791 [1,0,1,0,0,0|1,0,1]=4 687 B13R1.470 CNNC(=O)Cc1ccccc1Cl 22a_100016993582_100000183793 [1,0,1,0,0,0|2,0,0]=4 688 B13R1.8919 C#CCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000038162 [1,0,1,0,0,0|1,0,1]=4 689 B13R1.8919 C#CCNCc1c(cccc1Cl)Cl 34a_100000174884_100000184674 [1,0,1,0,0,0|1,0,1]=4 690 B13R1.8919 C#CCNCc1c(cccc1Cl)Cl 34a_100000212058_100000187851 [1,0,1,0,0,0|1,0,1]=4 691 B13R1.8919 C=CCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000210623 [1,0,1,0,0,0|1,0,1]=4 692 B13R1.8919 C=CCNCc1c(cccc1Cl)Cl 2230a_100020586998_100000187851 [1,0,1,0,0,0|1,0,1]=4 693 B13R1.8919 C=CCNCc1c(cccc1Cl)Cl 270004a_100020586998_100000189306 [1,0,1,0,0,0|1,0,1]=4 694 B13R1.8919 C=CCNCc1c(cccc1Cl)Cl 34a_100000174884_100015514636 [1,0,1,0,0,0|1,0,1]=4 695 B13R1.8919 CCCC=Cc1c(cccc1Cl)Cl 271570a_100016258520_100000034237 [1,0,1,0,0,0|1,0,1]=4 696 B13R1.8919 CCCNCc1c(cccc1Br)Cl 207a_100020643023_100011249081 [1,0,1,0,0,0|1,1,0]=4 697 B13R1.8919 CCCNCc1c(cccc1Br)Cl 270004a_100020643023_100011249081 [1,0,1,0,0,0|1,1,0]=4 698 B13R1.8919 CCCNCc1c(cccc1Cl)C 207a_100020643023_100000041122 [1,0,1,0,0,0|2,0,0]=4 699 B13R1.8919 CCCNCc1c(cccc1Cl)C 270004a_100020643023_100000041122 [1,0,1,0,0,0|2,0,0]=4 700 B13R1.8919 CCCNCc1c(cccc1Cl)Cl 207a_100020643023_100000189306 [1,0,1,0,0,0|1,0,0]=3 701 B13R1.8919 CCCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000210303 [1,0,1,0,0,0|1,0,0]=3 702 B13R1.8919 CCCNCc1c(cccc1Cl)Cl 270004a_100020643023_100000189306 [1,0,1,0,0,0|1,0,0]=3 703 B13R1.8919 CCCNCc1c(cccc1Cl)Cl 34a_100000174884_100000210303 [1,0,1,0,0,0|1,0,0]=3 704 B13R1.8919 CCCNCc1c(cccc1Cl)F 207a_100020643023_100000210083 [1,0,1,0,0,0|1,1,0]=4 705 B13R1.8919 CCCNCc1c(cccc1Cl)F 270004a_100020643023_100000210083 [1,0,1,0,0,0|1,1,0]=4 706 B13R1.8919 CCCNCc1c(cccc1Cl)F 34a_100000174883_100000210303 [1,0,1,0,0,0|1,1,0]=4 707 B13R1.8919 CCCNCc1c(cccc1I)Cl 207a_100020643023_100010147682 [1,0,1,0,0,0|1,1,0]=4 708 B13R1.8919 CCCNCc1c(cccc1I)Cl 270004a_100020643023_100010147682 [1,0,1,0,0,0|1,1,0]=4 709 B13R1.8919 CCCNCc1c(cncc1Cl)Cl 207a_100020643023_100000067493 [1,0,1,0,0,0|2,0,0]=4 710 B13R1.8919 CCCNCc1c(cncc1Cl)Cl 270004a_100020643023_100000067493 [1,0,1,0,0,0|2,0,0]=4 711 B13R1.8919 CCCOCc1c(cccc1Cl)Cl 34a_100000210258_100000187851 [1,0,1,0,0,0|2,0,0]=4 712 B13R1.8919 CCCOCc1c(cccc1Cl)Cl 34a_100000215722_100000210303 [1,0,1,0,0,0|2,0,0]=4 713 B13R1.8919 CCCOCc1c(cccc1Cl)Cl 7a_100000215722_100000210303 [1,0,1,0,0,0|2,0,0]=4 714 B13R1.8919 CCCSCc1c(cccc1Cl)Cl 62a_100000187851_100000210303 [1,0,1,0,0,0|2,0,0]=4 715 B13R1.8919 CCCSCc1c(cccc1Cl)Cl 62a_100000210303_100000187851 [1,0,1,0,0,0|2,0,0]=4 716 B13R1.8919 CCNCCc1c(cccc1Cl)Cl 2230a_100015525214_100012161200 [1,0,1,0,0,0|0,0,1]=3 717 B13R1.8919 CCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000210202 [1,0,1,0,0,0|0,0,1]=3 718 B13R1.8919 CCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000210202 [1,0,1,0,0,0|0,0,1]=3 719 B13R1.8919 CCNCCc1c(cccc1Cl)F 2230a_100000688150_100000210202 [1,0,1,0,0,0|0,1,1]=4 720 B13R1.8919 CCNCCc1c(cccc1Cl)F 34a_100000688150_100000210202 [1,0,1,0,0,0|0,1,1]=4 721 B13R1.8919 CCNN=Cc1c(cccc1Cl)Cl 4a_100000756455_100000189306 [1,0,1,0,0,0|1,0,1]=4 722 B13R1.8919 CCOC=Cc1c(cccc1Cl)Cl 271570a_100016256518_100000034237 [1,0,1,0,0,0|1,0,1]=4 723 B13R1.8919 CCOCCc1c(cccc1Cl)Cl 34a_100011934077_100000210202 [1,0,1,0,0,0|1,0,1]=4 724 B13R1.8919 CCOCCc1c(cccc1Cl)Cl 34a_100121572206_100012161200 [1,0,1,0,0,0|1,0,1]=4 725 B13R1.8919 CCOCCc1c(cccc1Cl)Cl 7a_100011934077_100000210202 [1,0,1,0,0,0|1,0,1]=4 726 B13R1.8919 CCSCCc1c(cccc1Cl)Cl 62a_100000210202_100012161200 [1,0,1,0,0,0|1,0,1]=4 727 B13R1.8919 CCSCCc1c(cccc1Cl)Cl 62a_100012161200_100000210202 [1,0,1,0,0,0|1,0,1]=4 728 B13R1.8919 COCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000766300 [1,0,1,0,0,0|2,0,0]=4 729 B13R1.8919 CSCNCc1c(cccc1Cl)Cl 2230a_100000174884_100011218213 [1,0,1,0,0,0|2,0,0]=4 730 B13R1.8919 CSCNCc1c(cccc1Cl)Cl 34a_100000174884_100011218213 [1,0,1,0,0,0|2,0,0]=4 731 B13R1.8919 Cc1cccc(c1CNCCO)Cl 207a_100000210304_100000041122 [1,0,1,0,0,0|2,0,0]=4 732 B13R1.8919 Cc1cccc(c1CNCCO)Cl 270004a_100000210304_100000041122 [1,0,1,0,0,0|2,0,0]=4 733 B13R1.8919 Clc1cccc(c1COCCBr)Cl 34a_100000211926_100000187851 [1,0,1,0,0,0|2,0,0]=4 734 B13R1.8919 FCCNCc1c(cccc1Br)Cl 34a_100000724931_100010138402 [1,0,1,0,0,0|1,1,0]=4 735 B13R1.8919 FCCNCc1c(cccc1Cl)Cl 2230a_100000174884_100011217306 [1,0,1,0,0,0|1,0,0]=3 736 B13R1.8919 FCCNCc1c(cccc1Cl)Cl 34a_100000174884_100011217306 [1,0,1,0,0,0|1,0,0]=3 737 B13R1.8919 FCCNCc1c(cccc1Cl)Cl 34a_100000724931_100000187851 [1,0,1,0,0,0|1,0,0]=3 738 B13R1.8919 FCCNCc1c(cccc1Cl)F 34a_100000174883_100011217306 [1,0,1,0,0,0|1,1,0]=4 739 B13R1.8919 FCCNCc1c(cccc1Cl)F 34a_100000724931_100000187852 [1,0,1,0,0,0|1,1,0]=4 740 B13R1.8919 FCCNCc1c(cncc1Cl)Cl 34a_100000724931_200009872113 [1,0,1,0,0,0|2,0,0]=4 741 B13R1.8919 FCCOCc1c(cccc1Cl)Cl 34a_100000215722_100011217306 [1,0,1,0,0,0|2,0,0]=4 742 B13R1.8919 FCCOCc1c(cccc1Cl)Cl 7a_100000215722_100011217306 [1,0,1,0,0,0|2,0,0]=4 743 B13R1.8919 FCCSCc1c(cccc1Cl)Cl 62a_100000187851_100011217306 [1,0,1,0,0,0|2,0,0]=4 744 B13R1.8919 FCCSCc1c(cccc1Cl)Cl 62a_100011217306_100000187851 [1,0,1,0,0,0|2,0,0]=4 745 B13R1.8919 FCNCCc1c(cccc1Cl)Cl 34a_100032004868_100015361967 [1,0,1,0,0,0|1,0,1]=4 746 B13R1.8919 N#CCNCc1c(cccc1Cl)Cl 2230a_100000174884_100011215382 [1,0,1,0,0,0|0,0,2]=4 747 B13R1.8919 NCCOCc1c(cccc1Br)Cl 34a_100000210304_100010138402 [1,0,1,0,0,0|1,1,0]=4 748 B13R1.8919 NCCOCc1c(cccc1Cl)Cl 34a_100000210304_100000187851 [1,0,1,0,0,0|1,0,0]=3 749 B13R1.8919 NCCOCc1c(cccc1Cl)F 34a_100000210304_100000187852 [1,0,1,0,0,0|1,1,0]=4 750 B13R1.8919 NCCOCc1c(cncc1Cl)Cl 34a_100000210304_200009872113 [1,0,1,0,0,0|2,0,0]=4 751 B13R1.8919 O=CCNCc1c(cccc1Cl)Cl 2230a_100000174884_200015260668 [1,0,1,0,0,0|1,0,1]=4 752 B13R1.8919 O=CCNCc1c(cccc1Cl)Cl 34a_100000174884_200009817547 [1,0,1,0,0,0|1,0,1]=4 753 B13R1.8919 OCCNCc1c(cccc1Br)Cl 207a_100000210304_100011249081 [1,0,1,0,0,0|1,1,0]=4 754 B13R1.8919 OCCNCc1c(cccc1Br)Cl 2230a_100016997473_100010138402 [1,0,1,0,0,0|1,1,0]=4 755 B13R1.8919 OCCNCc1c(cccc1Br)Cl 270004a_100000210304_100011249081 [1,0,1,0,0,0|1,1,0]=4 756 B13R1.8919 OCCNCc1c(cccc1Br)Cl 34a_100016990907_100010138402 [1,0,1,0,0,0|1,1,0]=4 757 B13R1.8919 OCCNCc1c(cccc1Cl)Cl 207a_100000210304_100000189306 [1,0,1,0,0,0|1,0,0]=3 758 B13R1.8919 OCCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000211926 [1,0,1,0,0,0|1,0,0]=3 759 B13R1.8919 OCCNCc1c(cccc1Cl)Cl 2230a_100016997473_100000187851 [1,0,1,0,0,0|1,0,0]=3 760 B13R1.8919 OCCNCc1c(cccc1Cl)Cl 270004a_100000210304_100000189306 [1,0,1,0,0,0|1,0,0]=3 761 B13R1.8919 OCCNCc1c(cccc1Cl)Cl 34a_100000174884_100000211926 [1,0,1,0,0,0|1,0,0]=3 762 B13R1.8919 OCCNCc1c(cccc1Cl)Cl 34a_100016990907_100000187851 [1,0,1,0,0,0|1,0,0]=3 763 B13R1.8919 OCCNCc1c(cccc1Cl)F 207a_100000210304_100000210083 [1,0,1,0,0,0|1,1,0]=4 764 B13R1.8919 OCCNCc1c(cccc1Cl)F 2230a_100016997473_100000187852 [1,0,1,0,0,0|1,1,0]=4 765 B13R1.8919 OCCNCc1c(cccc1Cl)F 270004a_100000210304_100000210083 [1,0,1,0,0,0|1,1,0]=4 766 B13R1.8919 OCCNCc1c(cccc1Cl)F 34a_100000174883_100000211926 [1,0,1,0,0,0|1,1,0]=4 767 B13R1.8919 OCCNCc1c(cccc1Cl)F 34a_100016990907_100000187852 [1,0,1,0,0,0|1,1,0]=4 768 B13R1.8919 OCCNCc1c(cccc1I)Cl 207a_100000210304_100010147682 [1,0,1,0,0,0|1,1,0]=4 769 B13R1.8919 OCCNCc1c(cccc1I)Cl 270004a_100000210304_100010147682 [1,0,1,0,0,0|1,1,0]=4 770 B13R1.8919 OCCNCc1c(cncc1Cl)Cl 207a_100000210304_100000067493 [1,0,1,0,0,0|2,0,0]=4 771 B13R1.8919 OCCNCc1c(cncc1Cl)Cl 2230a_100016997473_200009872113 [1,0,1,0,0,0|2,0,0]=4 772 B13R1.8919 OCCNCc1c(cncc1Cl)Cl 270004a_100000210304_100000067493 [1,0,1,0,0,0|2,0,0]=4 773 B13R1.8919 OCCNCc1c(cncc1Cl)Cl 34a_100016990907_200009872113 [1,0,1,0,0,0|2,0,0]=4 774 B13R1.8919 OCCOCc1c(cccc1Cl)Cl 34a_100000215722_100000211926 [1,0,1,0,0,0|2,0,0]=4 775 B13R1.8919 OCCOCc1c(cccc1Cl)Cl 7a_100000215722_100000211926 [1,0,1,0,0,0|2,0,0]=4 776 B13R1.8919 OCCSCc1c(cccc1Cl)Cl 62a_100000187851_100000211926 [1,0,1,0,0,0|2,0,0]=4 777 B13R1.8919 OCCSCc1c(cccc1Cl)Cl 62a_100000211926_100000187851 [1,0,1,0,0,0|2,0,0]=4 778 B13R1.555 CCCNCCc1ccccc1Cl 2230a_100011207228_100000210303 [1,0,1,0,0,0|1,0,1]=4 779 B13R1.555 CCCNCCc1ccccc1Cl 270004a_100020643023_200011713468 [1,0,1,0,0,0|1,0,1]=4 780 B13R1.555 CCCNCCc1ccccc1Cl 34a_100011207228_100000210303 [1,0,1,0,0,0|1,0,1]=4 781 B13R1.555 CCNN=CCc1ccccc1Cl 4a_100000756455_200011713468 [1,0,1,0,0,0|2,0,0]=4 782 B13R1.555 FCCNCCc1ccccc1Cl 2230a_100011207228_100011217306 [1,0,1,0,0,0|1,0,1]=4 783 B13R1.555 FCCNCCc1ccccc1Cl 34a_100000724931_100011713703 [1,0,1,0,0,0|1,0,1]=4 784 B13R1.555 FCCNCCc1ccccc1Cl 34a_100011207228_100011217306 [1,0,1,0,0,0|1,0,1]=4 785 B13R1.555 NCCCOCc1ccccc1Cl 34a_100000182051_100000187162 [1,0,1,0,0,0|2,0,0]=4 786 B13R1.555 NCCOCCc1ccccc1Cl 34a_100000210304_100011713703 [1,0,1,0,0,0|1,0,1]=4 787 B13R1.555 OCCNCCc1ccccc1Cl 2230a_100011207228_100000211926 [1,0,1,0,0,0|1,0,1]=4 788 B13R1.555 OCCNCCc1ccccc1Cl 2230a_100016997473_100011713703 [1,0,1,0,0,0|1,0,1]=4 789 B13R1.555 OCCNCCc1ccccc1Cl 270004a_100000210304_200011713468 [1,0,1,0,0,0|1,0,1]=4 790 B13R1.555 OCCNCCc1ccccc1Cl 34a_100011207228_100000211926 [1,0,1,0,0,0|1,0,1]=4 791 B13R1.555 OCCNCCc1ccccc1Cl 34a_100016990907_100011713703 [1,0,1,0,0,0|1,0,1]=4 792 B15R1.2565 CCCC(=O)Cc1c(ccc(c1Cl)C)Cl 1458a_100000211992_200010220899 [0,1,1,0,0,0|2,0,0]=4 793 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)C)F 11a_100015525214_100000038137 [0,1,1,0,0,0|1,1,0]=4 794 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)C)F 240690a_100015525214_100000038137 [0,1,1,0,0,0|1,1,0]=4 795 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)C)F 527a_100015525214_100000038137 [0,1,1,0,0,0|1,1,0]=4 796 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)Cl)F 11a_100015525214_100000062034 [0,1,1,0,0,0|1,1,0]=4 797 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)Cl)F 240690a_100015525214_100000062034 [0,1,1,0,0,0|1,1,0]=4 798 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)Cl)F 527a_100015525214_100000062034 [0,1,1,0,0,0|1,1,0]=4 799 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)F)F 11a_100015525214_100000037411 [0,1,1,0,0,0|1,1,0]=4 800 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)F)F 240690a_100015525214_100000037411 [0,1,1,0,0,0|1,1,0]=4 801 B15R1.2565 CCNC(=O)Cc1c(ccc(c1Cl)F)F 527a_100015525214_100000037411 [0,1,1,0,0,0|1,1,0]=4 802 B15R1.2565 CCNC(=O)Cc1c(ccc(c1F)C)Cl 11a_100015525214_100000035286 [0,1,1,0,0,0|1,1,0]=4 803 B15R1.2565 CCNC(=O)Cc1c(ccc(c1F)C)Cl 240690a_100015525214_100000035286 [0,1,1,0,0,0|1,1,0]=4 804 B15R1.2565 CCNC(=O)Cc1c(ccc(c1F)C)Cl 527a_100015525214_100000035286 [0,1,1,0,0,0|1,1,0]=4 805 B15R1.8287 CC(C)CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000210554_100000187851 [0,1,1,0,0,0|2,0,0]=4 806 B15R1.8287 CC(C)CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210624 [0,1,1,0,0,0|2,0,0]=4 807 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Br)Cl 11a_100138425928_100013084675 [0,1,1,0,0,0|1,1,0]=4 808 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Br)Cl 1626a_100138425928_100013084675 [0,1,1,0,0,0|1,1,0]=4 809 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Br)Cl 240690a_100138425928_100013084675 [0,1,1,0,0,0|1,1,0]=4 810 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Br)Cl 527a_100138425928_100013084675 [0,1,1,0,0,0|1,1,0]=4 811 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)Cl 11a_100138425928_100000211232 [0,1,1,0,0,0|1,0,0]=3 812 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)Cl 1626a_100138425928_100000211232 [0,1,1,0,0,0|1,0,0]=3 813 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)Cl 240690a_100138425928_100000211232 [0,1,1,0,0,0|1,0,0]=3 814 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)Cl 527a_100138425928_100000211232 [0,1,1,0,0,0|1,0,0]=3 815 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)F 11a_100138425928_100000185183 [0,1,1,0,0,0|1,1,0]=4 816 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)F 1626a_100138425928_100000185183 [0,1,1,0,0,0|1,1,0]=4 817 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)F 240690a_100138425928_100000185183 [0,1,1,0,0,0|1,1,0]=4 818 B15R1.8287 CC(C)NC(=O)Cc1c(cccc1Cl)F 527a_100138425928_100000185183 [0,1,1,0,0,0|1,1,0]=4 819 B15R1.8287 CC(O)CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100011218427 [0,1,1,0,0,0|2,0,0]=4 820 B15R1.8287 C[C@@H](O)CC(=O)Cc1c(cccc1Cl)Cl 1458a_100011933948_100000187851 [0,1,1,0,0,0|2,0,0]=4 821 B15R1.13264 CCC(C)C(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000758301 [0,1,1,0,0,0|2,0,0]=4 822 B15R1.13264 CCC(C)C(=O)Cc1c(cccc1Cl)Cl 1458a_100011192722_100000187851 [0,1,1,0,0,0|2,0,0]=4 823 B15R1.13264 CCC(O)C(=O)Cc1c(cccc1Cl)Cl 1458a_100011196387_100000187851 [0,1,1,0,0,0|2,0,0]=4 824 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Br)Cl 11a_100000225621_100013084675 [0,1,1,0,0,0|1,1,0]=4 825 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Br)Cl 1626a_100000225621_100013084675 [0,1,1,0,0,0|1,1,0]=4 826 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Br)Cl 240690a_100000225621_100013084675 [0,1,1,0,0,0|1,1,0]=4 827 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Br)Cl 527a_100000225621_100013084675 [0,1,1,0,0,0|1,1,0]=4 828 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)Cl 11a_100000225621_100000211232 [0,1,1,0,0,0|1,0,0]=3 829 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)Cl 1626a_100000225621_100000211232 [0,1,1,0,0,0|1,0,0]=3 830 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)Cl 240690a_100000225621_100000211232 [0,1,1,0,0,0|1,0,0]=3 831 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)Cl 527a_100000225621_100000211232 [0,1,1,0,0,0|1,0,0]=3 832 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)F 11a_100000225621_100000185183 [0,1,1,0,0,0|1,1,0]=4 833 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)F 1626a_100000225621_100000185183 [0,1,1,0,0,0|1,1,0]=4 834 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)F 240690a_100000225621_100000185183 [0,1,1,0,0,0|1,1,0]=4 835 B15R1.13264 CCN(C)C(=O)Cc1c(cccc1Cl)F 527a_100000225621_100000185183 [0,1,1,0,0,0|1,1,0]=4 836 B15R1.37637 CCCC(=O)Cc1c(cc(cc1Cl)Cl)Cl 1458a_100000211992_100012339996 [0,1,1,0,0,0|2,0,0]=4 837 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)C)Cl 2430a_100011996032_100015525214 [0,1,1,0,0,0|2,0,0]=4 838 B15R1.45718 C#CCNC(=O)Cc1c(cccc1Cl)Cl 11a_100000212058_100000211232 [0,1,1,0,0,0|1,0,1]=4 839 B15R1.45718 C#CCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100000212058_100000211232 [0,1,1,0,0,0|1,0,1]=4 840 B15R1.45718 C#CCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100000212058_100000211232 [0,1,1,0,0,0|1,0,1]=4 841 B15R1.45718 C#CCNC(=O)Cc1c(cccc1Cl)Cl 527a_100000212058_100000211232 [0,1,1,0,0,0|1,0,1]=4 842 B15R1.45718 C=CCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100020586998_100000211232 [0,1,1,0,0,0|1,0,1]=4 843 B15R1.45718 C=CCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100020586998_100000211232 [0,1,1,0,0,0|1,0,1]=4 844 B15R1.45718 C=CCNC(=O)Cc1c(cccc1Cl)Cl 527a_100020586998_100000211232 [0,1,1,0,0,0|1,0,1]=4 845 B15R1.45718 CC(Cc1c(cccc1Cl)Cl)NCCO 270004a_100000210304_100000692661 [0,1,1,0,0,0|1,0,1]=4 846 B15R1.45718 CC=NNC(=O)Cc1c(cccc1Cl)Cl 4a_200000189825_200000210099 [0,1,1,0,0,0|1,0,1]=4 847 B15R1.45718 CCC#CC(=O)Cc1c(cccc1Cl)Cl 1458a_100011827653_100000187851 [0,1,1,0,0,0|2,0,0]=4 848 B15R1.45718 CCC=CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000212282_100000187851 [0,1,1,0,0,0|2,0,0]=4 849 B15R1.45718 CCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000210183_100000187851 [0,1,1,0,0,0|2,0,0]=4 850 B15R1.45718 CCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210211 [0,1,1,0,0,0|2,0,0]=4 851 B15R1.45718 CCCNC(=O)Cc1c(cccc1Br)Cl 11a_100020643023_100013084675 [0,1,1,0,0,0|1,1,0]=4 852 B15R1.45718 CCCNC(=O)Cc1c(cccc1Br)Cl 1626a_100020643023_100013084675 [0,1,1,0,0,0|1,1,0]=4 853 B15R1.45718 CCCNC(=O)Cc1c(cccc1Br)Cl 240690a_100020643023_100013084675 [0,1,1,0,0,0|1,1,0]=4 854 B15R1.45718 CCCNC(=O)Cc1c(cccc1Br)Cl 527a_100020643023_100013084675 [0,1,1,0,0,0|1,1,0]=4 855 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)Cl 11a_100020643023_100000211232 [0,1,1,0,0,0|1,0,0]=3 856 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100020643023_100000211232 [0,1,1,0,0,0|1,0,0]=3 857 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100020643023_100000211232 [0,1,1,0,0,0|1,0,0]=3 858 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)Cl 527a_100020643023_100000211232 [0,1,1,0,0,0|1,0,0]=3 859 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)F 11a_100020643023_100000185183 [0,1,1,0,0,0|1,1,0]=4 860 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)F 1626a_100020643023_100000185183 [0,1,1,0,0,0|1,1,0]=4 861 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)F 240690a_100020643023_100000185183 [0,1,1,0,0,0|1,1,0]=4 862 B15R1.45718 CCCNC(=O)Cc1c(cccc1Cl)F 527a_100020643023_100000185183 [0,1,1,0,0,0|1,1,0]=4 863 B15R1.45718 CCCNC(C)Cc1c(cccc1Cl)Cl 270004a_100020643023_100000692661 [0,1,1,0,0,0|1,0,1]=4 864 B15R1.45718 CCNCC(=O)Nc1c(cccc1Cl)Cl 2230a_100015525214_100000182350 [0,1,1,0,0,0|2,0,0]=4 865 B15R1.45718 CCNNC(=O)Cc1c(cccc1Br)Cl 22a_100000756455_100013084675 [0,1,1,0,0,0|1,1,0]=4 866 B15R1.45718 CCNNC(=O)Cc1c(cccc1Cl)Cl 22a_100000756455_100000211232 [0,1,1,0,0,0|1,0,0]=3 867 B15R1.45718 CCNNC(=O)Cc1c(cccc1Cl)F 22a_100000756455_100000185183 [0,1,1,0,0,0|1,1,0]=4 868 B15R1.45718 CCOCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211967_100000187851 [0,1,1,0,0,0|2,0,0]=4 869 B15R1.45718 CCSCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000230394_100000187851 [0,1,1,0,0,0|2,0,0]=4 870 B15R1.45718 COCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000233755 [0,1,1,0,0,0|2,0,0]=4 871 B15R1.45718 COCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000749529_100000187851 [0,1,1,0,0,0|2,0,0]=4 872 B15R1.45718 CSCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000174002_100000187851 [0,1,1,0,0,0|2,0,0]=4 873 B15R1.45718 CSCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000751147 [0,1,1,0,0,0|2,0,0]=4 874 B15R1.45718 N#CCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100000734998_100000211232 [0,1,1,0,0,0|1,0,1]=4 875 B15R1.45718 N#CCNC(=O)Cc1c(cccc1Cl)Cl 527a_100000734998_100000211232 [0,1,1,0,0,0|1,0,1]=4 876 B15R1.45718 O=C(CCCF)Cc1c(cccc1Cl)Cl 1458a_100000211232_100011934791 [0,1,1,0,0,0|2,0,0]=4 877 B15R1.45718 O=C(CCCO)Cc1c(cccc1Cl)Cl 1458a_100000211232_100011215043 [0,1,1,0,0,0|2,0,0]=4 878 B15R1.45718 O=C(Cc1c(cccc1Br)Cl)NCCF 11a_100000724931_100013084675 [0,1,1,0,0,0|1,1,0]=4 879 B15R1.45718 O=C(Cc1c(cccc1Br)Cl)NCCF 1626a_100000724931_100013084675 [0,1,1,0,0,0|1,1,0]=4 880 B15R1.45718 O=C(Cc1c(cccc1Br)Cl)NCCF 240690a_100000724931_100013084675 [0,1,1,0,0,0|1,1,0]=4 881 B15R1.45718 O=C(Cc1c(cccc1Br)Cl)NCCF 527a_100000724931_100013084675 [0,1,1,0,0,0|1,1,0]=4 882 B15R1.45718 O=C(Cc1c(cccc1Br)Cl)NCCO 240690a_100000210304_100013084675 [0,1,1,0,0,0|1,1,0]=4 883 B15R1.45718 O=C(Cc1c(cccc1Br)Cl)NCCO 527a_100000210304_100013084675 [0,1,1,0,0,0|1,1,0]=4 884 B15R1.45718 O=C(Cc1c(cccc1Cl)Cl)NCCF 11a_100000724931_100000211232 [0,1,1,0,0,0|1,0,0]=3 885 B15R1.45718 O=C(Cc1c(cccc1Cl)Cl)NCCF 1626a_100000724931_100000211232 [0,1,1,0,0,0|1,0,0]=3 886 B15R1.45718 O=C(Cc1c(cccc1Cl)Cl)NCCF 240690a_100000724931_100000211232 [0,1,1,0,0,0|1,0,0]=3 887 B15R1.45718 O=C(Cc1c(cccc1Cl)Cl)NCCF 527a_100000724931_100000211232 [0,1,1,0,0,0|1,0,0]=3 888 B15R1.45718 O=C(Cc1c(cccc1Cl)Cl)NCCO 240690a_100000210304_100000211232 [0,1,1,0,0,0|1,0,0]=3 889 B15R1.45718 O=C(Cc1c(cccc1Cl)Cl)NCCO 527a_100000210304_100000211232 [0,1,1,0,0,0|1,0,0]=3 890 B15R1.45718 O=C(Cc1c(cccc1Cl)F)NCCF 11a_100000724931_100000185183 [0,1,1,0,0,0|1,1,0]=4 891 B15R1.45718 O=C(Cc1c(cccc1Cl)F)NCCF 1626a_100000724931_100000185183 [0,1,1,0,0,0|1,1,0]=4 892 B15R1.45718 O=C(Cc1c(cccc1Cl)F)NCCF 240690a_100000724931_100000185183 [0,1,1,0,0,0|1,1,0]=4 893 B15R1.45718 O=C(Cc1c(cccc1Cl)F)NCCF 527a_100000724931_100000185183 [0,1,1,0,0,0|1,1,0]=4 894 B15R1.45718 O=C(Cc1c(cccc1Cl)F)NCCO 240690a_100000210304_100000185183 [0,1,1,0,0,0|1,1,0]=4 895 B15R1.45718 O=C(Cc1c(cccc1Cl)F)NCCO 527a_100000210304_100000185183 [0,1,1,0,0,0|1,1,0]=4 896 B15R1.50751 CCNS(=O)(=O)Cc1c(cccc1Cl)Cl 270084a_100015525214_100000751942 [0,1,1,0,0,0|2,0,0]=4 897 B15R1.50751 CCNS(=O)(=O)Cc1c(cccc1Cl)Cl 274078a_100015525214_100000751942 [0,1,1,0,0,0|2,0,0]=4 898 B15R1.51699 CCNC(=O)N(C)c1c(cccc1Cl)Cl 512a_100015525214_100000691019 [0,1,1,0,0,0|2,0,0]=4 899 B15R1.8290 CC(C)CNCCc1c(cccc1Cl)Cl 2230a_100000210953_100012161200 [0,1,1,0,0,0|1,0,1]=4 900 B15R1.8290 CC(C)CNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000210760 [0,1,1,0,0,0|1,0,1]=4 901 B15R1.8290 CC(C)CNCCc1c(cccc1Cl)Cl 270004a_100032004868_100000210432 [0,1,1,0,0,0|1,0,1]=4 902 B15R1.8290 CC(C)CNCCc1c(cccc1Cl)Cl 34a_100000210953_100012161200 [0,1,1,0,0,0|1,0,1]=4 903 B15R1.8290 CC(C)CNCCc1c(cccc1Cl)Cl 34a_100032004868_100000210624 [0,1,1,0,0,0|1,0,1]=4 904 B15R1.8290 CC(O)CNCCc1c(cccc1Cl)Cl 2230a_100000210904_100012161200 [0,1,1,0,0,0|1,0,1]=4 905 B15R1.8290 CC(O)CNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011218427 [0,1,1,0,0,0|1,0,1]=4 906 B15R1.8290 CC(O)CNCCc1c(cccc1Cl)Cl 34a_100000210904_100012161200 [0,1,1,0,0,0|1,0,1]=4 907 B15R1.8290 CC(O)CNCCc1c(cccc1Cl)Cl 34a_100032004868_100011218427 [0,1,1,0,0,0|1,0,1]=4 908 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1Cl)Cl 34a_100000706166_100000187851 [0,1,1,0,0,0|2,0,0]=4 909 B15R1.8290 C[C@@H](N)COCCc1c(cccc1Cl)Cl 34a_100000737577_100012161200 [0,1,1,0,0,0|1,0,1]=4 910 B15R1.8290 C[C@@H](O)CNCCc1c(cccc1Cl)Cl 2230a_100032004868_100009817552 [0,1,1,0,0,0|1,0,1]=4 911 B15R1.8290 C[C@@H](O)CNCCc1c(cccc1Cl)Cl 34a_100032004868_100009817552 [0,1,1,0,0,0|1,0,1]=4 912 B15R1.8290 FC(F)CNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011934356 [0,1,1,0,0,0|1,0,1]=4 913 B15R1.8290 FC(F)CNCCc1c(cccc1Cl)Cl 34a_100000765723_100012161200 [0,1,1,0,0,0|1,0,1]=4 914 B15R1.8290 FC(F)CNCCc1c(cccc1Cl)Cl 34a_100032004868_100011934356 [0,1,1,0,0,0|1,0,1]=4 915 B15R1.9189 Cc1ccc(c(c1Cl)COCCCN)Cl 34a_100000182051_200010220899 [0,1,1,0,0,0|2,0,0]=4 916 B15R1.36731 CCCN(C)CCc1c(cccc1Cl)Cl 2230a_100000747261_100012161200 [0,1,1,0,0,0|1,0,1]=4 917 B15R1.36731 CCCN(C)CCc1c(cccc1Cl)Cl 269982a_100000747261_100012161200 [0,1,1,0,0,0|1,0,1]=4 918 B15R1.36731 CN(CCO)CCc1c(cccc1Cl)Cl 2230a_100000210263_100012161200 [0,1,1,0,0,0|1,0,1]=4 919 B15R1.36731 CN(CCO)CCc1c(cccc1Cl)Cl 269982a_100000210263_100012161200 [0,1,1,0,0,0|1,0,1]=4 920 B15R1.40620 NCCCOCc1c(cc(cc1Cl)Cl)Cl 34a_100000182051_100012339996 [0,1,1,0,0,0|2,0,0]=4 921 B15R1.42427 CC(CN)COCc1c(cccc1Cl)Cl 34a_100000744482_100000187851 [0,1,1,0,0,0|2,0,0]=4 922 B15R1.42427 CC(CN)OCCc1c(cccc1Cl)Cl 34a_100000210904_100012161200 [0,1,1,0,0,0|1,0,1]=4 923 B15R1.42427 CC(CO)NCCc1c(cccc1Cl)Cl 2230a_100032004868_100012180447 [0,1,1,0,0,0|1,0,1]=4 924 B15R1.42427 CC(CO)NCCc1c(cccc1Cl)Cl 34a_100032004868_100012180447 [0,1,1,0,0,0|1,0,1]=4 925 B15R1.42427 CCC(C)NCCc1c(cccc1Cl)Cl 2230a_100000209981_100012161200 [0,1,1,0,0,0|1,0,1]=4 926 B15R1.42427 CCC(C)NCCc1c(cccc1Cl)Cl 2230a_100032004868_100000758301 [0,1,1,0,0,0|1,0,1]=4 927 B15R1.42427 CCC(C)NCCc1c(cccc1Cl)Cl 34a_100032004868_100011215416 [0,1,1,0,0,0|1,0,1]=4 928 B15R1.42427 C[C@H](CO)NCCc1c(cccc1Cl)Cl 2230a_100000737577_100012161200 [0,1,1,0,0,0|1,0,1]=4 929 B15R1.42427 NC[C@@H](F)COCc1c(cccc1Cl)Cl 34a_100015665980_100000187851 [0,1,1,0,0,0|2,0,0]=4 930 B15R1.44685 C#CCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000688953 [0,1,1,0,0,0|1,0,1]=4 931 B15R1.44685 C#CCCNCCc1c(cccc1Cl)Cl 34a_100000755551_100012161200 [0,1,1,0,0,0|1,0,1]=4 932 B15R1.44685 C#CCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000688953 [0,1,1,0,0,0|1,0,1]=4 933 B15R1.44685 C=CCCNCCc1c(cccc1Cl)Cl 2230a_100015191253_100012161200 [0,1,1,0,0,0|1,0,1]=4 934 B15R1.44685 C=CCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000754431 [0,1,1,0,0,0|1,0,1]=4 935 B15R1.44685 C=CCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000754431 [0,1,1,0,0,0|1,0,1]=4 936 B15R1.44685 CCCCNCCc1c(cccc1Cl)Cl 2230a_100000102301_100012161200 [0,1,1,0,0,0|1,0,1]=4 937 B15R1.44685 CCCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000210211 [0,1,1,0,0,0|1,0,1]=4 938 B15R1.44685 CCCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000210210 [0,1,1,0,0,0|1,0,1]=4 939 B15R1.44685 CCCCNCCc1c(cccc1Cl)Cl 7a_106832991798_100012161200 [0,1,1,0,0,0|1,0,1]=4 940 B15R1.44685 CNCCCOCc1c(cccc1Cl)Cl 34a_100000213112_100000187851 [0,1,1,0,0,0|2,0,0]=4 941 B15R1.44685 COCCNCCc1c(cccc1Cl)Cl 2230a_100000209980_100012161200 [0,1,1,0,0,0|1,0,1]=4 942 B15R1.44685 COCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011201679 [0,1,1,0,0,0|1,0,1]=4 943 B15R1.44685 COCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100011201679 [0,1,1,0,0,0|1,0,1]=4 944 B15R1.44685 CSCCNCCc1c(cccc1Cl)Cl 2230a_100020590264_100012161200 [0,1,1,0,0,0|1,0,1]=4 945 B15R1.44685 CSCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000751147 [0,1,1,0,0,0|1,0,1]=4 946 B15R1.44685 CSCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000212216 [0,1,1,0,0,0|1,0,1]=4 947 B15R1.44685 FCCCNCCc1c(cccc1Cl)Cl 2230a_100015189416_100012161200 [0,1,1,0,0,0|1,0,1]=4 948 B15R1.44685 FCCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011934791 [0,1,1,0,0,0|1,0,1]=4 949 B15R1.44685 FCCCNCCc1c(cccc1Cl)Cl 34a_100015189416_100012161200 [0,1,1,0,0,0|1,0,1]=4 950 B15R1.44685 FCCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100011934791 [0,1,1,0,0,0|1,0,1]=4 951 B15R1.44685 FCCNCCOc1c(cccc1Cl)Cl 34a_100000724931_100000184560 [0,1,1,0,0,0|1,0,1]=4 952 B15R1.44685 N#CCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100011215226 [0,1,1,0,0,0|0,0,2]=4 953 B15R1.44685 NCCCCOCc1c(cccc1Cl)Cl 34a_100000750430_100000187851 [0,1,1,0,0,0|1,0,1]=4 954 B15R1.44685 NCCCOCCc1c(cccc1Cl)Cl 34a_100000182051_100012161200 [0,1,1,0,0,0|1,0,1]=4 955 B15R1.44685 NCCOCCOc1c(cccc1Cl)Cl 34a_100000210304_100000184560 [0,1,1,0,0,0|1,0,1]=4 956 B15R1.44685 NOCCOCCc1c(cccc1Cl)Cl 34a_100000700252_100012161200 [0,1,1,0,0,0|1,0,1]=4 957 B15R1.44685 OCCCNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000230001 [0,1,1,0,0,0|1,0,1]=4 958 B15R1.44685 OCCCNCCc1c(cccc1Cl)Cl 34a_100032004868_100000230001 [0,1,1,0,0,0|1,0,1]=4 959 B15R1.44685 OCCNCCOc1c(cccc1Cl)Cl 2230a_100016997473_100000184560 [0,1,1,0,0,0|1,0,1]=4 960 B15R1.44685 OCCNCCOc1c(cccc1Cl)Cl 34a_100016990907_100000184560 [0,1,1,0,0,0|1,0,1]=4 961 B15R2.359 CN1CCCC1Cc2ccccc2Cl 2230a_100000744037_200000210301 [1,1,0,0,0,0|1,0,1]=4 962 B15R2.359 CN1CCCC1Cc2ccccc2Cl 269982a_100000744037_200000210301 [1,1,0,0,0,0|1,0,1]=4 963 B15R2.359 CN1CCCC1Cc2ccccc2Cl 34a_100000744037_200000210301 [1,1,0,0,0,0|1,0,1]=4 964 B15R2.359 [13CH3]N1CCCC1Cc2ccccc2Cl 2230a_100000744037_200025704644 [1,1,0,0,0,0|1,0,1]=4 965 B15R2.359 [13CH3]N1CCCC1Cc2ccccc2Cl 269982a_100000744037_200025704644 [1,1,0,0,0,0|1,0,1]=4 966 B15R2.359 [13CH3]N1CCCC1Cc2ccccc2Cl 34a_100000744037_200025704644 [1,1,0,0,0,0|1,0,1]=4 967 B15R2.4203 Cc1cc(c(c(c1)Cl)CN2CCC2)Cl 26a_100000754969_100000034925 [0,1,0,0,1,0|2,0,0]=4 968 B15R2.4203 Clc1cc(c(c(c1)Cl)CN2CCC2)Cl 269982a_100000754969_100012339996 [0,1,0,0,1,0|2,0,0]=4 969 B15R2.4203 Clc1cc(c(c(c1)Cl)CN2CCC2)Cl 26a_100000754969_100000210218 [0,1,0,0,1,0|2,0,0]=4 970 B15R2.4203 Clc1cc(cc(c1CN2CCC2)Cl)Br 26a_100000754969_100000753780 [0,1,0,0,1,0|2,0,0]=4 971 B15R2.4203 Clc1cc(cc(c1CN2CCC2)Cl)I 26a_100000754969_100012339652 [0,1,0,0,1,0|2,0,0]=4 972 B15R2.4203 Fc1cc(c(c(c1)Cl)CN2CCC2)Cl 26a_100000754969_100011217724 [0,1,0,0,1,0|2,0,0]=4 973 B15R2.15370 CC1CCN1Cc2c(cccc2Cl)Cl 269982a_100000755817_100000211241 [0,1,0,0,1,0|2,0,0]=4 974 B15R2.15370 CC1CCN1Cc2c(cccc2Cl)Cl 26a_100000755817_100000211709 [0,1,0,0,1,0|2,0,0]=4 975 B15R2.15370 CC1CCN1Cc2c(cccc2Cl)Cl 34a_100000755817_100000187851 [0,1,0,0,1,0|2,0,0]=4 976 B15R2.15644 Cc1ccc(c(c1Cl)CN2CCC2)Cl 269982a_100000754969_200010220899 [0,1,0,0,1,0|2,0,0]=4 977 B15R2.15644 Cc1ccc(c(c1Cl)CN2CCC2)Cl 26a_100000754969_200000087117 [0,1,0,0,1,0|2,0,0]=4 978 B15R2.15644 Clc1ccc(c(c1CN2CCC2)Cl)Br 26a_100000754969_100010089855 [0,1,0,0,1,0|2,0,0]=4 979 B15R2.15644 Clc1ccc(c(c1Cl)CN2CCC2)Cl 26a_100000754969_100000042553 [0,1,0,0,1,0|2,0,0]=4 980 B15R2.48035 CC1CN(C1)Cc2c(cccc2Cl)Cl 2230a_100000702820_100000187851 [0,1,0,0,1,0|2,0,0]=4 981 B15R2.48035 CC1CN(C1)Cc2c(cccc2Cl)Cl 269982a_100000702820_100000211241 [0,1,0,0,1,0|2,0,0]=4 982 B15R2.48035 CC1CN(C1)Cc2c(cccc2Cl)Cl 26a_100000702820_100000211709 [0,1,0,0,1,0|2,0,0]=4 983 B15R2.48035 CC1CN(C1)Cc2c(cccc2Cl)Cl 270004a_100000702820_100000189306 [0,1,0,0,1,0|2,0,0]=4 984 B15R2.48035 CC1CN(C1)Cc2c(cccc2Cl)Cl 34a_100000702820_100000187851 [0,1,0,0,1,0|2,0,0]=4 985 B15R2.48035 FC1CN(C1)Cc2c(cccc2Cl)Cl 2230a_100000690557_100000187851 [0,1,0,0,1,0|2,0,0]=4 986 B15R2.48035 FC1CN(C1)Cc2c(cccc2Cl)Cl 269982a_100000690557_100000211241 [0,1,0,0,1,0|2,0,0]=4 987 B15R2.48035 FC1CN(C1)Cc2c(cccc2Cl)Cl 26a_100000690557_100000211709 [0,1,0,0,1,0|2,0,0]=4 988 B15R2.48035 FC1CN(C1)Cc2c(cccc2Cl)Cl 270004a_100000690557_100000189306 [0,1,0,0,1,0|2,0,0]=4 989 B15R2.48035 FC1CN(C1)Cc2c(cccc2Cl)Cl 34a_100000690557_100000187851 [0,1,0,0,1,0|2,0,0]=4 990 B15R2.48035 OC1CN(C1)Cc2c(cccc2Cl)Cl 269982a_100000749847_100000211241 [0,1,0,0,1,0|2,0,0]=4 991 B15R2.48035 OC1CN(C1)Cc2c(cccc2Cl)Cl 26a_100000749847_100000211709 [0,1,0,0,1,0|2,0,0]=4 992 B15R2.4201 Cc1cc(c(c(c1)Cl)c2ncc[nH]2)Cl 271570a_100010233845_100025796157 [0,1,0,0,1,0|0,0,2]=4 993 B15R2.4201 Clc1cc(c(c(c1)Cl)C2=CCCC2)Cl 271570a_100000089523_200011216440 [0,1,0,0,1,0|2,0,0]=4 994 B15R2.4201 Clc1cc(c(c(c1)Cl)c2ncc[nH]2)Cl 271570a_100016988920_200011216440 [0,1,0,0,1,0|0,0,2]=4 995 B15R2.4201 Clc1cc(cc(c1C2=CCCC2)Cl)Br 271570a_100000089523_200011263224 [0,1,0,0,1,0|2,0,0]=4 996 B15R2.4201 Clc1cc(cc(c1c2ncc[nH]2)Cl)Br 271570a_100016988920_200011263224 [0,1,0,0,1,0|0,0,2]=4 997 B15R2.4201 Fc1cc(c(c(c1)Cl)C2=CCCC2)Cl 271570a_100000089523_100010175091 [0,1,0,0,1,0|2,0,0]=4 998 B15R2.4201 Fc1cc(c(c(c1)Cl)c2ncc[nH]2)Cl 271570a_100000722820_100025796157 [0,1,0,0,1,0|0,0,2]=4 999 B15R2.4201 Fc1cc(c(c(c1)Cl)c2ncc[nH]2)Cl 271570a_100016988920_100010175091 [0,1,0,0,1,0|0,0,2]=4 1000 B15R2.15647 Cc1ccc(c(c1Cl)c2ncc[nH]2)Cl 271570a_200010208260_100025796157 [0,1,0,0,1,0|0,0,2]=4 1001 B15R2.15647 Clc1ccc(c(c1Cl)C2=CCCC2)Cl 271570a_100000089523_200010170825 [0,1,0,0,1,0|2,0,0]=4 1002 B15R2.15647 Clc1ccc(c(c1Cl)c2ncc[nH]2)Cl 271570a_100016988920_200010170825 [0,1,0,0,1,0|0,0,2]=4 1003 B17R2.38423 Cn1ccnc1CNc2c(cccc2Cl)Cl 34a_100000210028_100000700302 [0,1,0,0,0,1|0,0,2]=4 1004 B17R2.38423 Cn1ccnc1COc2c(cccc2Cl)Cl 34a_100000211709_100000700302 [0,1,0,0,0,1|0,0,2]=4 1005 B17R2.38423 Cn1ccnc1COc2c(cccc2Cl)Cl 7a_100000211709_100000700302 [0,1,0,0,0,1|0,0,2]=4 1006 B17R2.38423 Cn1ccnc1CSc2c(cccc2Cl)Cl 62a_100000034237_100000700302 [0,1,0,0,0,1|0,0,2]=4 1007 B17R2.38423 Cn1ccnc1CSc2c(cccc2Cl)Cl 62a_100000700302_100000034237 [0,1,0,0,0,1|0,0,2]=4 1008 B17R2.38423 Cn1ccnc1SCc2c(cccc2Cl)Cl 62a_100000187851_100000707724 [0,1,0,0,0,1|0,0,2]=4 1009 B17R2.38423 Cn1ccnc1SCc2c(cccc2Cl)Cl 62a_100000707724_100000187851 [0,1,0,0,0,1|0,0,2]=4 1010 B17R2.38423 Cn1ncnc1NCc2c(cccc2Cl)Cl 27a_100000174884_100000732653 [0,1,0,0,0,1|1,0,1]=4 1011 B17R2.38423 Cn1ncnc1SCc2c(cccc2Cl)Cl 62a_100000187851_100000732653 [0,1,0,0,0,1|1,0,1]=4 1012 B17R2.38423 Cn1ncnc1SCc2c(cccc2Cl)Cl 62a_100000732653_100000187851 [0,1,0,0,0,1|1,0,1]=4 1013 B17R2.41794 O=C(Cc1c(cccc1Cl)Cl)C2=CCCC2 1458a_100000038896_100000187851 [0,1,0,0,0,1|2,0,0]=4 1014 B17R2.41886 CN(CC1=NCCN1)c2c(cccc2Cl)Cl 269982a_100000691019_100000737910 [0,1,0,0,0,1|0,0,0]=2 1015 B17R2.41886 CN(CC1=NCCN1)c2c(cccc2Cl)Cl 34a_100000691019_100000737910 [0,1,0,0,0,1|0,0,0]=2 1016 B17R2.41886 CN(CC1=NCCN1)c2c(cccc2F)F 269982a_100000743377_100000737910 [0,1,0,0,0,1|0,2,0]=4 1017 B17R2.41886 CN(CC1=NCCN1)c2c(cccc2F)F 34a_100000743377_100000737910 [0,1,0,0,0,1|0,2,0]=4 1018 B17R2.41886 CN(CC1=NCCN1)c2c(cccc2F)F 38a_100000743377_100000737910 [0,1,0,0,0,1|0,2,0]=4 1019 B17R2.41886 CN(Cc1ncc[nH]1)c2c(cccc2Cl)Cl 269982a_100000691019_100016991755 [0,1,0,0,0,1|0,0,2]=4 1020 B17R2.41886 CN(Cc1ncc[nH]1)c2c(cccc2Cl)Cl 34a_100000691019_100016991755 [0,1,0,0,0,1|0,0,2]=4 1021 B17R2.41886 CN(Cc1nnn[nH]1)c2c(cccc2Cl)Cl 269982a_100000691019_100000765167 [0,1,0,0,0,1|2,0,0]=4 1022 B17R2.41886 CN(Cc1nnn[nH]1)c2c(cccc2Cl)Cl 34a_100000691019_100000765167 [0,1,0,0,0,1|2,0,0]=4 1023 B17R2.41886 Cc1cccc(c1N(C)CC2=NCCN2)C 269982a_100011645471_100000737910 [0,1,0,0,0,1|2,0,0]=4 1024 B17R2.41886 Cc1cccc(c1N(C)CC2=NCCN2)C 34a_100011645471_100000737910 [0,1,0,0,0,1|2,0,0]=4 1025 B17R2.41886 O=C(Cc1nnn[nH]1)c2c(cccc2Cl)Cl 1458a_100000210656_100000765167 [0,1,0,0,0,1|2,0,0]=4 1026 B17R2.71328 CCc1cccc(c1NCC2=NCCN2)C 34a_100000210048_100000737910 [0,1,0,0,0,1|2,0,0]=4 1027 B17R2.71328 CCc1cccc(c1NCC2=NCCN2)C 7a_100000210048_100000737910 [0,1,0,0,0,1|2,0,0]=4 1028 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)Br 34a_200010001580_100000737910 [0,1,0,0,0,1|1,1,0]=4 1029 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)Br 7a_200010001580_100000737910 [0,1,0,0,0,1|1,1,0]=4 1030 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)C 34a_100000034007_100000737910 [0,1,0,0,0,1|2,0,0]=4 1031 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)C 7a_100000034007_100000737910 [0,1,0,0,0,1|2,0,0]=4 1032 B17R2.71328 CCc1cccc(c1SCC2=NCCN2)C 62a_100000036235_100000737910 [0,1,0,0,0,1|2,0,0]=4 1033 B17R2.71328 CCc1cccc(c1SCC2=NCCN2)C 62a_100000737910_100000036235 [0,1,0,0,0,1|2,0,0]=4 1034 B17R2.71328 COc1cccc(c1NCC2=NCCN2)Br 34a_100000708083_100000737910 [0,1,0,0,0,1|1,1,0]=4 1035 B17R2.71328 COc1cccc(c1NCC2=NCCN2)C 34a_100000758225_100000737910 [0,1,0,0,0,1|2,0,0]=4 1036 B17R2.71328 COc1cccc(c1NCC2=NCCN2)Cl 34a_100011309317_100000737910 [0,1,0,0,0,1|1,0,0]=3 1037 B17R2.71328 COc1cccc(c1NCC2=NCCN2)F 34a_100000686744_100000737910 [0,1,0,0,0,1|1,1,0]=4 1038 B17R2.71328 COc1cccc(c1NCC2=NCCN2)O 34a_100012022766_100000737910 [0,1,0,0,0,1|2,0,0]=4 1039 B17R2.71328 COc1cccc(c1OCC2=NCCN2)Br 34a_100000686866_100000737910 [0,1,0,0,0,1|1,1,0]=4 1040 B17R2.71328 COc1cccc(c1OCC2=NCCN2)C 34a_100011219253_100000737910 [0,1,0,0,0,1|2,0,0]=4 1041 B17R2.71328 COc1cccc(c1OCC2=NCCN2)C 7a_100011219253_100000737910 [0,1,0,0,0,1|2,0,0]=4 1042 B17R2.71328 COc1cccc(c1OCC2=NCCN2)Cl 34a_100009851661_100000737910 [0,1,0,0,0,1|1,0,0]=3 1043 B17R2.71328 COc1cccc(c1OCC2=NCCN2)Cl 7a_100009851661_100000737910 [0,1,0,0,0,1|1,0,0]=3 1044 B17R2.71328 COc1cccc(c1OCC2=NCCN2)F 34a_100000036725_100000737910 [0,1,0,0,0,1|1,1,0]=4 1045 B17R2.71328 COc1cccc(c1OCC2=NCCN2)F 7a_100000036725_100000737910 [0,1,0,0,0,1|1,1,0]=4 1046 B17R2.71328 COc1cccc(c1OCC2=NCCN2)N 34a_100000123586_100000737910 [0,1,0,0,0,1|2,0,0]=4 1047 B17R2.71328 COc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100010131421 [0,1,0,0,0,1|1,1,0]=4 1048 B17R2.71328 COc1cccc(c1SCC2=NCCN2)Br 62a_100010131421_100000737910 [0,1,0,0,0,1|1,1,0]=4 1049 B17R2.71328 COc1cccc(c1SCC2=NCCN2)C 62a_100000737910_100010191535 [0,1,0,0,0,1|2,0,0]=4 1050 B17R2.71328 COc1cccc(c1SCC2=NCCN2)C 62a_100010191535_100000737910 [0,1,0,0,0,1|2,0,0]=4 1051 B17R2.71328 COc1cccc(c1SCC2=NCCN2)F 62a_100000703912_100000737910 [0,1,0,0,0,1|1,1,0]=4 1052 B17R2.71328 COc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100000703912 [0,1,0,0,0,1|1,1,0]=4 1053 B17R2.71328 COc1cccc(c1SCC2=NCCN2)N 62a_100000703447_100000737910 [0,1,0,0,0,1|2,0,0]=4 1054 B17R2.71328 COc1cccc(c1SCC2=NCCN2)N 62a_100000737910_100000703447 [0,1,0,0,0,1|2,0,0]=4 1055 B17R2.71328 COc1cccc(c1SCC2=NCCN2)O 62a_100000737910_100010202623 [0,1,0,0,0,1|2,0,0]=4 1056 B17R2.71328 COc1ccnc(c1SCC2=NCCN2)Cl 62a_100000737910_100010154655 [0,1,0,0,0,1|2,0,0]=4 1057 B17R2.71328 COc1ccnc(c1SCC2=NCCN2)Cl 62a_100010154655_100000737910 [0,1,0,0,0,1|2,0,0]=4 1058 B17R2.71328 Cc1cccc(c1NCC2=NCCN2)CO 34a_100011215590_100000737910 [0,1,0,0,0,1|2,0,0]=4 1059 B17R2.71328 Cc1cccc(c1OCC2=NCCN2)C#N 34a_100011659161_100000737910 [0,1,0,0,0,1|2,0,0]=4 1060 B17R2.71328 Cc1cccc(c1OCC2=NCCN2)C#N 7a_100011659161_100000737910 [0,1,0,0,0,1|2,0,0]=4 1061 B17R2.71328 Cc1cccc(c1OCC2=NCCN2)CN 34a_100020639391_100000737910 [0,1,0,0,0,1|2,0,0]=4 1062 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)C#N 62a_100000737910_100011934862 [0,1,0,0,0,1|2,0,0]=4 1063 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)C=O 62a_100000737910_100012186367 [0,1,0,0,0,1|2,0,0]=4 1064 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)C=O 62a_100012186367_100000737910 [0,1,0,0,0,1|2,0,0]=4 1065 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)CO 62a_100000737910_100011659289 [0,1,0,0,0,1|2,0,0]=4 1066 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)CO 62a_100011659289_100000737910 [0,1,0,0,0,1|2,0,0]=4 1067 B17R2.71328 N#Cc1cccc(c1NCC2=NCCN2)F 34a_100011219409_100000737910 [0,1,0,0,0,1|1,1,0]=4 1068 B17R2.71328 N#Cc1cccc(c1OCC2=NCCN2)Br 34a_100009817103_100000737910 [0,1,0,0,0,1|1,1,0]=4 1069 B17R2.71328 N#Cc1cccc(c1OCC2=NCCN2)Cl 34a_100009866432_100000737910 [0,1,0,0,0,1|1,0,0]=3 1070 B17R2.71328 N#Cc1cccc(c1OCC2=NCCN2)Cl 7a_100009866432_100000737910 [0,1,0,0,0,1|1,0,0]=3 1071 B17R2.71328 N#Cc1cccc(c1OCC2=NCCN2)F 34a_100000117915_100000737910 [0,1,0,0,0,1|1,1,0]=4 1072 B17R2.71328 N#Cc1cccc(c1OCC2=NCCN2)F 7a_100000117915_100000737910 [0,1,0,0,0,1|1,1,0]=4 1073 B17R2.71328 N#Cc1cccc(c1SCC2=NCCN2)Br 62a_100000703783_100000737910 [0,1,0,0,0,1|1,1,0]=4 1074 B17R2.71328 N#Cc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100000703783 [0,1,0,0,0,1|1,1,0]=4 1075 B17R2.71328 N#Cc1cccc(c1SCC2=NCCN2)Cl 62a_100000737910_100010134094 [0,1,0,0,0,1|1,0,0]=3 1076 B17R2.71328 N#Cc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100011219237 [0,1,0,0,0,1|1,1,0]=4 1077 B17R2.71328 N#Cc1cccc(c1SCC2=NCCN2)N 62a_100000737910_100009877206 [0,1,0,0,0,1|2,0,0]=4 1078 B17R2.71328 N#Cc1cccc(c1SCC2=NCCN2)O 62a_100000737910_100009818990 [0,1,0,0,0,1|2,0,0]=4 1079 B17R2.71328 N#Cc1ccnc(c1SCC2=NCCN2)Cl 62a_100000737910_100010202632 [0,1,0,0,0,1|2,0,0]=4 1080 B17R2.71328 NCc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100020638964 [0,1,0,0,0,1|1,1,0]=4 1081 B17R2.71328 NCc1cccc(c1SCC2=NCCN2)F 62a_100020638964_100000737910 [0,1,0,0,0,1|1,1,0]=4 1082 B17R2.71328 O=Cc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100011934749 [0,1,0,0,0,1|1,1,0]=4 1083 B17R2.71328 O=Cc1cccc(c1SCC2=NCCN2)F 62a_100011934749_100000737910 [0,1,0,0,0,1|1,1,0]=4 1084 B17R2.71328 O=Cc1cccc(c1SCC2=NCCN2)O 62a_100000737910_100009816417 [0,1,0,0,0,1|2,0,0]=4 1085 B17R2.71328 O=Cc1cccc(c1SCC2=NCCN2)O 62a_100009816417_100000737910 [0,1,0,0,0,1|2,0,0]=4 1086 B17R2.71328 OCc1cccc(c1NCC2=NCCN2)Cl 34a_100012182729_100000737910 [0,1,0,0,0,1|1,0,0]=3 1087 B17R2.71328 OCc1cccc(c1NCC2=NCCN2)F 34a_100000692437_100000737910 [0,1,0,0,0,1|1,1,0]=4 1088 B17R2.71328 OCc1cccc(c1OCC2=NCCN2)F 34a_100011997349_100000737910 [0,1,0,0,0,1|1,1,0]=4 1089 B17R2.71328 OCc1cccc(c1OCC2=NCCN2)F 7a_100011997349_100000737910 [0,1,0,0,0,1|1,1,0]=4 1090 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100010146604 [0,1,0,0,0,1|1,1,0]=4 1091 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)Br 62a_100010146604_100000737910 [0,1,0,0,0,1|1,1,0]=4 1092 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100012351117 [0,1,0,0,0,1|1,1,0]=4 1093 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)F 62a_100012351117_100000737910 [0,1,0,0,0,1|1,1,0]=4 1094 B17R2.83661 Brc1cc(c(c(c1)Br)OCC2=NCCN2)Br 34a_100000210219_100000737910 [0,1,0,0,0,1|0,2,0]=4 1095 B17R2.83661 Brc1cc(c(c(c1)Br)OCC2=NCCN2)Br 7a_100000210219_100000737910 [0,1,0,0,0,1|0,2,0]=4 1096 B17R2.83661 Brc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_100000737910_100011263223 [0,1,0,0,0,1|0,2,0]=4 1097 B17R2.83661 Brc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_100011263223_100000737910 [0,1,0,0,0,1|0,2,0]=4 1098 B17R2.83661 Brc1cc(c(c(c1)I)OCC2=NCCN2)I 7a_100009997433_100000737910 [0,1,0,0,0,1|0,2,0]=4 1099 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)Br 34a_100000184052_100000737910 [0,1,0,0,0,1|0,2,0]=4 1100 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)C 34a_100000688863_100000737910 [0,1,0,0,0,1|1,1,0]=4 1101 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)Cl 34a_100012339639_100000737910 [0,1,0,0,0,1|0,1,0]=3 1102 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)F 34a_100012353694_100000737910 [0,1,0,0,0,1|0,2,0]=4 1103 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)Br 34a_100000203795_100000737910 [0,1,0,0,0,1|0,2,0]=4 1104 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)Br 7a_100000203795_100000737910 [0,1,0,0,0,1|0,2,0]=4 1105 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)C 34a_100011934984_100000737910 [0,1,0,0,0,1|1,1,0]=4 1106 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)C 7a_100011934984_100000737910 [0,1,0,0,0,1|1,1,0]=4 1107 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)F 34a_200010713133_100000737910 [0,1,0,0,0,1|0,2,0]=4 1108 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)F 7a_200010713133_100000737910 [0,1,0,0,0,1|0,2,0]=4 1109 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_100000737910_200011219743 [0,1,0,0,0,1|0,2,0]=4 1110 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_200011219743_100000737910 [0,1,0,0,0,1|0,2,0]=4 1111 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)C 62a_100000737910_200012353697 [0,1,0,0,0,1|1,1,0]=4 1112 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)C 62a_200012353697_100000737910 [0,1,0,0,0,1|1,1,0]=4 1113 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)F 62a_100000737910_100010208195 [0,1,0,0,0,1|0,2,0]=4 1114 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)F 62a_100010208195_100000737910 [0,1,0,0,0,1|0,2,0]=4 1115 B17R2.83661 Cc1cc(c(c(c1)C)NCC2=NCCN2)C 34a_100000210045_100000737910 [0,1,0,0,0,1|2,0,0]=4 1116 B17R2.83661 Cc1cc(c(c(c1)C)NCC2=NCCN2)C 7a_100000210045_100000737910 [0,1,0,0,0,1|2,0,0]=4 1117 B17R2.83661 Cc1cc(c(c(c1)C)OCC2=NCCN2)C 34a_100000212074_100000737910 [0,1,0,0,0,1|2,0,0]=4 1118 B17R2.83661 Cc1cc(c(c(c1)C)OCC2=NCCN2)C 7a_100000212074_100000737910 [0,1,0,0,0,1|2,0,0]=4 1119 B17R2.83661 Cc1cc(c(c(c1)C)SCC2=NCCN2)C 62a_100000737910_100011204320 [0,1,0,0,0,1|2,0,0]=4 1120 B17R2.83661 Cc1cc(c(c(c1)C)SCC2=NCCN2)C 62a_100011204320_100000737910 [0,1,0,0,0,1|2,0,0]=4 1121 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)C 34a_100000211461_100000737910 [0,1,0,0,0,1|1,0,0]=3 1122 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)C 7a_100000211461_100000737910 [0,1,0,0,0,1|1,0,0]=3 1123 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)Cl 34a_100011996032_100000737910 [0,1,0,0,0,1|0,0,0]=2 1124 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)O 34a_100015906060_100000737910 [0,1,0,0,0,1|1,0,0]=3 1125 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2ncc[nH]2)Cl 34a_100011996032_100016991755 [0,1,0,0,0,1|0,0,2]=4 1126 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2nnn[nH]2)Cl 34a_100011996032_100000765167 [0,1,0,0,0,1|2,0,0]=4 1127 B17R2.83661 Cc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100000034925_100000737910 [0,1,0,0,0,1|0,0,0]=2 1128 B17R2.83661 Cc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100000034925_100000737910 [0,1,0,0,0,1|0,0,0]=2 1129 B17R2.83661 Cc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 34a_100000034925_100016991755 [0,1,0,0,0,1|0,0,2]=4 1130 B17R2.83661 Cc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 7a_100000034925_100000753453 [0,1,0,0,0,1|0,0,2]=4 1131 B17R2.83661 Cc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 34a_100000034925_100000765167 [0,1,0,0,0,1|2,0,0]=4 1132 B17R2.83661 Cc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 7a_100000034925_100000765167 [0,1,0,0,0,1|2,0,0]=4 1133 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100000737910_100015306127 [0,1,0,0,0,1|0,2,0]=4 1134 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100015306127_100000737910 [0,1,0,0,0,1|0,2,0]=4 1135 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)N 62a_100000737910_100021129147 [0,1,0,0,0,1|1,1,0]=4 1136 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)N 62a_100021129147_100000737910 [0,1,0,0,0,1|1,1,0]=4 1137 B17R2.83661 Cc1cc(c(c(c1)I)OCC2=NCCN2)F 34a_200135191068_100000737910 [0,1,0,0,0,1|0,2,0]=4 1138 B17R2.83661 Cc1cc(c(c(c1)I)OCC2=NCCN2)F 7a_200135191068_100000737910 [0,1,0,0,0,1|0,2,0]=4 1139 B17R2.83661 Cc1cc(c(c(c1)N)OCC2=NCCN2)C 34a_100011216242_100000737910 [0,1,0,0,0,1|2,0,0]=4 1140 B17R2.83661 Cc1cc(c(c(c1)N)OCC2=NCCN2)C 7a_100011216242_100000737910 [0,1,0,0,0,1|2,0,0]=4 1141 B17R2.83661 Cc1cc(c(c(c1)O)SCC2=NCCN2)C 62a_100000737910_100010342985 [0,1,0,0,0,1|2,0,0]=4 1142 B17R2.83661 Cc1cc(c(c(c1)O)SCC2=NCCN2)C 62a_100010342985_100000737910 [0,1,0,0,0,1|2,0,0]=4 1143 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Br 34a_100012047207_100000737910 [0,1,0,0,0,1|1,1,0]=4 1144 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Br 7a_100012047207_100000737910 [0,1,0,0,0,1|1,1,0]=4 1145 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Cl 34a_100012353696_100000737910 [0,1,0,0,0,1|1,1,0]=4 1146 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Cl 7a_100012353696_100000737910 [0,1,0,0,0,1|1,1,0]=4 1147 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)F 34a_100011216670_100000737910 [0,1,0,0,0,1|1,1,0]=4 1148 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)F 7a_100011216670_100000737910 [0,1,0,0,0,1|1,1,0]=4 1149 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Br 34a_100000737279_100000737910 [0,1,0,0,0,1|2,0,0]=4 1150 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Br 7a_100000737279_100000737910 [0,1,0,0,0,1|2,0,0]=4 1151 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Cl 34a_100000692879_100000737910 [0,1,0,0,0,1|2,0,0]=4 1152 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Cl 7a_100000692879_100000737910 [0,1,0,0,0,1|2,0,0]=4 1153 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)F 34a_100011290887_100000737910 [0,1,0,0,0,1|2,0,0]=4 1154 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)F 7a_100011290887_100000737910 [0,1,0,0,0,1|2,0,0]=4 1155 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)I 7a_100011356821_100000737910 [0,1,0,0,0,1|2,0,0]=4 1156 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)O 34a_100011934200_100000737910 [0,1,0,0,0,1|2,0,0]=4 1157 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Br 34a_100000741131_100000737910 [0,1,0,0,0,1|1,0,0]=3 1158 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Br 7a_100000741131_100000737910 [0,1,0,0,0,1|1,0,0]=3 1159 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Cl 34a_100011215104_100000737910 [0,1,0,0,0,1|1,0,0]=3 1160 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Cl 7a_100011215104_100000737910 [0,1,0,0,0,1|1,0,0]=3 1161 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)F 34a_100000725997_100000737910 [0,1,0,0,0,1|1,0,0]=3 1162 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)F 7a_100000725997_100000737910 [0,1,0,0,0,1|1,0,0]=3 1163 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Br 34a_100000709789_100000737910 [0,1,0,0,0,1|1,1,0]=4 1164 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Br 7a_100000709789_100000737910 [0,1,0,0,0,1|1,1,0]=4 1165 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Cl 34a_100012017672_100000737910 [0,1,0,0,0,1|1,1,0]=4 1166 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Cl 7a_100012017672_100000737910 [0,1,0,0,0,1|1,1,0]=4 1167 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)I)Br 7a_200000690823_100000737910 [0,1,0,0,0,1|1,1,0]=4 1168 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)I)Cl 7a_100012344046_100000737910 [0,1,0,0,0,1|1,1,0]=4 1169 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)O)Br 34a_100010371313_100000737910 [0,1,0,0,0,1|2,0,0]=4 1170 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)O)Br 7a_100010371313_100000737910 [0,1,0,0,0,1|2,0,0]=4 1171 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)Br 34a_100000186369_100000737910 [0,1,0,0,0,1|1,1,0]=4 1172 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)Br 7a_100000186369_100000737910 [0,1,0,0,0,1|1,1,0]=4 1173 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)Cl 34a_100012337756_100000737910 [0,1,0,0,0,1|1,1,0]=4 1174 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)Cl 7a_100012337756_100000737910 [0,1,0,0,0,1|1,1,0]=4 1175 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)I 34a_100010982682_100000737910 [0,1,0,0,0,1|1,1,0]=4 1176 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)I 7a_100010982682_100000737910 [0,1,0,0,0,1|1,1,0]=4 1177 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)N 34a_100010064301_100000737910 [0,1,0,0,0,1|1,1,0]=4 1178 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Br)N 7a_100010064301_100000737910 [0,1,0,0,0,1|1,1,0]=4 1179 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)Br 34a_100000187306_100000737910 [0,1,0,0,0,1|2,0,0]=4 1180 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)Br 7a_100000187306_100000737910 [0,1,0,0,0,1|2,0,0]=4 1181 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)Cl 34a_100000211519_100000737910 [0,1,0,0,0,1|2,0,0]=4 1182 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)Cl 7a_100000211519_100000737910 [0,1,0,0,0,1|2,0,0]=4 1183 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)F 34a_100000081862_100000737910 [0,1,0,0,0,1|2,0,0]=4 1184 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)F 7a_100000081862_100000737910 [0,1,0,0,0,1|2,0,0]=4 1185 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)I 34a_100011216129_100000737910 [0,1,0,0,0,1|2,0,0]=4 1186 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)I 7a_100011216129_100000737910 [0,1,0,0,0,1|2,0,0]=4 1187 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)N 34a_100000703291_100000737910 [0,1,0,0,0,1|2,0,0]=4 1188 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)C)N 7a_100000703291_100000737910 [0,1,0,0,0,1|2,0,0]=4 1189 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100000211485_100000737910 [0,1,0,0,0,1|1,0,0]=3 1190 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100000211485_100000737910 [0,1,0,0,0,1|1,0,0]=3 1191 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Cl 34a_100011218458_100000737910 [0,1,0,0,0,1|1,0,0]=3 1192 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Cl 7a_100011218458_100000737910 [0,1,0,0,0,1|1,0,0]=3 1193 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)I 34a_200015900153_100000737910 [0,1,0,0,0,1|1,0,0]=3 1194 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)I 7a_200015900153_100000737910 [0,1,0,0,0,1|1,0,0]=3 1195 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)I)Cl 34a_100012343667_100000737910 [0,1,0,0,0,1|1,1,0]=4 1196 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)I)Cl 7a_100012343667_100000737910 [0,1,0,0,0,1|1,1,0]=4 1197 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)N)Br 34a_100011825904_100000737910 [0,1,0,0,0,1|2,0,0]=4 1198 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)N)Br 7a_100011825904_100000737910 [0,1,0,0,0,1|2,0,0]=4 1199 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)N)F 34a_100000130126_100000737910 [0,1,0,0,0,1|2,0,0]=4 1200 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)N)F 7a_100000130126_100000737910 [0,1,0,0,0,1|2,0,0]=4 1201 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Br)Br 62a_100000737910_200010208242 [0,1,0,0,0,1|1,1,0]=4 1202 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Br)Br 62a_200010208242_100000737910 [0,1,0,0,0,1|1,1,0]=4 1203 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Br)F 62a_100000737910_100010208209 [0,1,0,0,0,1|1,1,0]=4 1204 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Br)F 62a_100010208209_100000737910 [0,1,0,0,0,1|1,1,0]=4 1205 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)Br 62a_100000737910_100009814048 [0,1,0,0,0,1|2,0,0]=4 1206 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)Br 62a_100009814048_100000737910 [0,1,0,0,0,1|2,0,0]=4 1207 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)Cl 62a_100000737910_100010244930 [0,1,0,0,0,1|2,0,0]=4 1208 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)Cl 62a_100010244930_100000737910 [0,1,0,0,0,1|2,0,0]=4 1209 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)F 62a_100000737910_100012356666 [0,1,0,0,0,1|2,0,0]=4 1210 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)F 62a_100012356666_100000737910 [0,1,0,0,0,1|2,0,0]=4 1211 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)N 62a_100000215964_100000737910 [0,1,0,0,0,1|2,0,0]=4 1212 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)N 62a_100000737910_100000215964 [0,1,0,0,0,1|2,0,0]=4 1213 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)O 62a_100000243743_100000737910 [0,1,0,0,0,1|2,0,0]=4 1214 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)C)O 62a_100000737910_100000243743 [0,1,0,0,0,1|2,0,0]=4 1215 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)Cl 62a_100000737910_200000035511 [0,1,0,0,0,1|1,0,0]=3 1216 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)Cl 62a_200000035511_100000737910 [0,1,0,0,0,1|1,0,0]=3 1217 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)F 62a_100000737910_100010079234 [0,1,0,0,0,1|1,0,0]=3 1218 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)F 62a_100010079234_100000737910 [0,1,0,0,0,1|1,0,0]=3 1219 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)F)F 62a_100000737910_100015332101 [0,1,0,0,0,1|1,1,0]=4 1220 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)F)F 62a_100015332101_100000737910 [0,1,0,0,0,1|1,1,0]=4 1221 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)F)N 62a_100000737910_100010115923 [0,1,0,0,0,1|1,1,0]=4 1222 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)F)N 62a_100010115923_100000737910 [0,1,0,0,0,1|1,1,0]=4 1223 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)N)Cl 62a_100000698757_100000737910 [0,1,0,0,0,1|2,0,0]=4 1224 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)N)Cl 62a_100000737910_100000698757 [0,1,0,0,0,1|2,0,0]=4 1225 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)O)Cl 62a_100000737910_100010254216 [0,1,0,0,0,1|2,0,0]=4 1226 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)O)Cl 62a_100010254216_100000737910 [0,1,0,0,0,1|2,0,0]=4 1227 B17R2.83661 Cc1nc(c(c(n1)Cl)SCC2=NCCN2)Cl 62a_100000737910_100012456929 [0,1,0,0,0,1|2,0,0]=4 1228 B17R2.83661 Cc1nc(c(c(n1)Cl)SCC2=NCCN2)Cl 62a_100012456929_100000737910 [0,1,0,0,0,1|2,0,0]=4 1229 B17R2.83661 Clc1cc(c(c(c1)Br)NCC2=NCCN2)Br 34a_100000724118_100000737910 [0,1,0,0,0,1|0,2,0]=4 1230 B17R2.83661 Clc1cc(c(c(c1)Br)NCC2=NCCN2)Cl 34a_100011218119_100000737910 [0,1,0,0,0,1|0,1,0]=3 1231 B17R2.83661 Clc1cc(c(c(c1)Br)OCC2=NCCN2)Br 34a_100012337757_100000737910 [0,1,0,0,0,1|0,2,0]=4 1232 B17R2.83661 Clc1cc(c(c(c1)Br)OCC2=NCCN2)Br 7a_100012337757_100000737910 [0,1,0,0,0,1|0,2,0]=4 1233 B17R2.83661 Clc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 34a_200000243811_100000737910 [0,1,0,0,0,1|0,1,0]=3 1234 B17R2.83661 Clc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 7a_200000243811_100000737910 [0,1,0,0,0,1|0,1,0]=3 1235 B17R2.83661 Clc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_100000737910_200009992027 [0,1,0,0,0,1|0,1,0]=3 1236 B17R2.83661 Clc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_200009992027_100000737910 [0,1,0,0,0,1|0,1,0]=3 1237 B17R2.83661 Clc1cc(c(c(c1)Cl)CSc2ncc[nH]2)Cl 62a_100012339996_100025796157 [0,1,0,0,0,1|0,0,2]=4 1238 B17R2.83661 Clc1cc(c(c(c1)Cl)CSc2ncc[nH]2)Cl 62a_100025796157_100012339996 [0,1,0,0,0,1|0,0,2]=4 1239 B17R2.83661 Clc1cc(c(c(c1)Cl)NCC2=NCCN2)Cl 34a_100000210601_100000737910 [0,1,0,0,0,1|0,0,0]=2 1240 B17R2.83661 Clc1cc(c(c(c1)Cl)NCc2ncc[nH]2)Cl 34a_100000210601_100016991755 [0,1,0,0,0,1|0,0,2]=4 1241 B17R2.83661 Clc1cc(c(c(c1)Cl)NCc2nnn[nH]2)Cl 34a_100000210601_100000765167 [0,1,0,0,0,1|2,0,0]=4 1242 B17R2.83661 Clc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100000210218_100000737910 [0,1,0,0,0,1|0,0,0]=2 1243 B17R2.83661 Clc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100000210218_100000737910 [0,1,0,0,0,1|0,0,0]=2 1244 B17R2.83661 Clc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 34a_100000210218_100016991755 [0,1,0,0,0,1|0,0,2]=4 1245 B17R2.83661 Clc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 7a_100000210218_100000753453 [0,1,0,0,0,1|0,0,2]=4 1246 B17R2.83661 Clc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 34a_100000210218_100000765167 [0,1,0,0,0,1|2,0,0]=4 1247 B17R2.83661 Clc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 7a_100000210218_100000765167 [0,1,0,0,0,1|2,0,0]=4 1248 B17R2.83661 Clc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_100000737910_200011216440 [0,1,0,0,0,1|0,0,0]=2 1249 B17R2.83661 Clc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_200011216440_100000737910 [0,1,0,0,0,1|0,0,0]=2 1250 B17R2.83661 Clc1cc(c(c(c1)Cl)SCc2ncc[nH]2)Cl 62a_100016991755_200011216440 [0,1,0,0,0,1|0,0,2]=4 1251 B17R2.83661 Clc1cc(c(c(c1)Cl)SCc2ncc[nH]2)Cl 62a_200011216440_100016991755 [0,1,0,0,0,1|0,0,2]=4 1252 B17R2.83661 Clc1cc(c(c(c1)Cl)SCc2nnn[nH]2)Cl 62a_100000765167_200011216440 [0,1,0,0,0,1|2,0,0]=4 1253 B17R2.83661 Clc1cc(c(c(c1)Cl)SCc2nnn[nH]2)Cl 62a_200011216440_100000765167 [0,1,0,0,0,1|2,0,0]=4 1254 B17R2.83661 Clc1cc(c(c(c1)I)OCC2=NCCN2)Cl 34a_200012339341_100000737910 [0,1,0,0,0,1|0,1,0]=3 1255 B17R2.83661 Clc1cc(c(c(c1)I)OCC2=NCCN2)Cl 7a_200012339341_100000737910 [0,1,0,0,0,1|0,1,0]=3 1256 B17R2.83661 Clc1cc(c(c(c1)I)OCC2=NCCN2)I 7a_100000730656_100000737910 [0,1,0,0,0,1|0,2,0]=4 1257 B17R2.83661 Clc1cc(cc(c1NCC2=NCCN2)Br)Br 34a_100011216035_100000737910 [0,1,0,0,0,1|0,1,0]=3 1258 B17R2.83661 Clc1cc(cc(c1NCC2=NCCN2)Cl)Br 34a_100000211608_100000737910 [0,1,0,0,0,1|0,0,0]=2 1259 B17R2.83661 Clc1cc(cc(c1NCc2ncc[nH]2)Cl)Br 34a_100000211608_100016991755 [0,1,0,0,0,1|0,0,2]=4 1260 B17R2.83661 Clc1cc(cc(c1NCc2nnn[nH]2)Cl)Br 34a_100000211608_100000765167 [0,1,0,0,0,1|2,0,0]=4 1261 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Br)Br 34a_100012337755_100000737910 [0,1,0,0,0,1|0,1,0]=3 1262 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Br)Br 7a_100012337755_100000737910 [0,1,0,0,0,1|0,1,0]=3 1263 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100000753780_100000737910 [0,1,0,0,0,1|0,0,0]=2 1264 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100000753780_100000737910 [0,1,0,0,0,1|0,0,0]=2 1265 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Cl)I 7a_100012339652_100000737910 [0,1,0,0,0,1|0,0,0]=2 1266 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)I)I 7a_100009997439_100000737910 [0,1,0,0,0,1|0,1,0]=3 1267 B17R2.83661 Clc1cc(cc(c1OCc2ncc[nH]2)Cl)Br 34a_100000753780_100016991755 [0,1,0,0,0,1|0,0,2]=4 1268 B17R2.83661 Clc1cc(cc(c1OCc2ncc[nH]2)Cl)Br 7a_100000753780_100000753453 [0,1,0,0,0,1|0,0,2]=4 1269 B17R2.83661 Clc1cc(cc(c1OCc2ncc[nH]2)Cl)I 7a_100012339652_100000753453 [0,1,0,0,0,1|0,0,2]=4 1270 B17R2.83661 Clc1cc(cc(c1OCc2nnn[nH]2)Cl)Br 34a_100000753780_100000765167 [0,1,0,0,0,1|2,0,0]=4 1271 B17R2.83661 Clc1cc(cc(c1OCc2nnn[nH]2)Cl)Br 7a_100000753780_100000765167 [0,1,0,0,0,1|2,0,0]=4 1272 B17R2.83661 Clc1cc(cc(c1OCc2nnn[nH]2)Cl)I 7a_100012339652_100000765167 [0,1,0,0,0,1|2,0,0]=4 1273 B17R2.83661 Clc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_100000737910_200011263224 [0,1,0,0,0,1|0,0,0]=2 1274 B17R2.83661 Clc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_200011263224_100000737910 [0,1,0,0,0,1|0,0,0]=2 1275 B17R2.83661 Clc1cc(cc(c1SCc2ncc[nH]2)Cl)Br 62a_100016991755_200011263224 [0,1,0,0,0,1|0,0,2]=4 1276 B17R2.83661 Clc1cc(cc(c1SCc2ncc[nH]2)Cl)Br 62a_200011263224_100016991755 [0,1,0,0,0,1|0,0,2]=4 1277 B17R2.83661 Clc1cc(cc(c1SCc2nnn[nH]2)Cl)Br 62a_100000765167_200011263224 [0,1,0,0,0,1|2,0,0]=4 1278 B17R2.83661 Clc1cc(cc(c1SCc2nnn[nH]2)Cl)Br 62a_200011263224_100000765167 [0,1,0,0,0,1|2,0,0]=4 1279 B17R2.83661 Fc1cc(c(c(c1)Br)NCC2=NCCN2)Br 34a_100000211720_100000737910 [0,1,0,0,0,1|0,2,0]=4 1280 B17R2.83661 Fc1cc(c(c(c1)Br)NCC2=NCCN2)Cl 34a_100000694656_100000737910 [0,1,0,0,0,1|0,1,0]=3 1281 B17R2.83661 Fc1cc(c(c(c1)Br)NCC2=NCCN2)F 34a_100000211602_100000737910 [0,1,0,0,0,1|0,2,0]=4 1282 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)Br 34a_100011215434_100000737910 [0,1,0,0,0,1|0,2,0]=4 1283 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)Br 7a_100011215434_100000737910 [0,1,0,0,0,1|0,2,0]=4 1284 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 34a_100011830411_100000737910 [0,1,0,0,0,1|0,1,0]=3 1285 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 7a_100011830411_100000737910 [0,1,0,0,0,1|0,1,0]=3 1286 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)F 34a_100000688693_100000737910 [0,1,0,0,0,1|0,2,0]=4 1287 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)F 7a_100000688693_100000737910 [0,1,0,0,0,1|0,2,0]=4 1288 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_100000737910_100009813983 [0,1,0,0,0,1|0,2,0]=4 1289 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_100009813983_100000737910 [0,1,0,0,0,1|0,2,0]=4 1290 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_100000737910_100012356682 [0,1,0,0,0,1|0,1,0]=3 1291 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_100012356682_100000737910 [0,1,0,0,0,1|0,1,0]=3 1292 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)F 62a_100000720994_100000737910 [0,1,0,0,0,1|0,2,0]=4 1293 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)F 62a_100000737910_100000720994 [0,1,0,0,0,1|0,2,0]=4 1294 B17R2.83661 Fc1cc(c(c(c1)Cl)NCC2=NCCN2)Cl 34a_100000688861_100000737910 [0,1,0,0,0,1|0,0,0]=2 1295 B17R2.83661 Fc1cc(c(c(c1)Cl)NCC2=NCCN2)F 34a_100000688773_100000737910 [0,1,0,0,0,1|0,1,0]=3 1296 B17R2.83661 Fc1cc(c(c(c1)Cl)NCc2ncc[nH]2)Cl 34a_100000688861_100016991755 [0,1,0,0,0,1|0,0,2]=4 1297 B17R2.83661 Fc1cc(c(c(c1)Cl)NCc2nnn[nH]2)Cl 34a_100000688861_100000765167 [0,1,0,0,0,1|2,0,0]=4 1298 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100011217724_100000737910 [0,1,0,0,0,1|0,0,0]=2 1299 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100011217724_100000737910 [0,1,0,0,0,1|0,0,0]=2 1300 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)F 34a_100011935252_100000737910 [0,1,0,0,0,1|0,1,0]=3 1301 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)F 7a_100011935252_100000737910 [0,1,0,0,0,1|0,1,0]=3 1302 B17R2.83661 Fc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 34a_100011217724_100016991755 [0,1,0,0,0,1|0,0,2]=4 1303 B17R2.83661 Fc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 7a_100011217724_100000753453 [0,1,0,0,0,1|0,0,2]=4 1304 B17R2.83661 Fc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 34a_100011217724_100000765167 [0,1,0,0,0,1|2,0,0]=4 1305 B17R2.83661 Fc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 7a_100011217724_100000765167 [0,1,0,0,0,1|2,0,0]=4 1306 B17R2.83661 Fc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_100000737910_100010175091 [0,1,0,0,0,1|0,0,0]=2 1307 B17R2.83661 Fc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_100010175091_100000737910 [0,1,0,0,0,1|0,0,0]=2 1308 B17R2.83661 Fc1cc(c(c(c1)Cl)SCc2ncc[nH]2)Cl 62a_100010175091_100016991755 [0,1,0,0,0,1|0,0,2]=4 1309 B17R2.83661 Fc1cc(c(c(c1)Cl)SCc2ncc[nH]2)Cl 62a_100016991755_100010175091 [0,1,0,0,0,1|0,0,2]=4 1310 B17R2.83661 Fc1cc(c(c(c1)Cl)SCc2nnn[nH]2)Cl 62a_100000765167_100010175091 [0,1,0,0,0,1|2,0,0]=4 1311 B17R2.83661 Fc1cc(c(c(c1)Cl)SCc2nnn[nH]2)Cl 62a_100010175091_100000765167 [0,1,0,0,0,1|2,0,0]=4 1312 B17R2.83661 Fc1cc(c(c(c1)F)NCC2=NCCN2)F 34a_100000760425_100000737910 [0,1,0,0,0,1|0,2,0]=4 1313 B17R2.83661 Fc1cc(c(c(c1)F)OCC2=NCCN2)F 34a_100011218396_100000737910 [0,1,0,0,0,1|0,2,0]=4 1314 B17R2.83661 Fc1cc(c(c(c1)F)OCC2=NCCN2)F 7a_100011218396_100000737910 [0,1,0,0,0,1|0,2,0]=4 1315 B17R2.83661 Fc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100000243675_100000737910 [0,1,0,0,0,1|0,2,0]=4 1316 B17R2.83661 Fc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100000737910_100000243675 [0,1,0,0,0,1|0,2,0]=4 1317 B17R2.83661 Fc1cc(c(c(c1)I)NCC2=NCCN2)F 34a_100102885649_100000737910 [0,1,0,0,0,1|0,2,0]=4 1318 B17R2.83661 Fc1cc(c(c(c1)I)OCC2=NCCN2)Br 34a_200013085147_100000737910 [0,1,0,0,0,1|0,2,0]=4 1319 B17R2.83661 Fc1cc(c(c(c1)I)OCC2=NCCN2)Br 7a_200013085147_100000737910 [0,1,0,0,0,1|0,2,0]=4 1320 B17R2.83661 Fc1cc(c(c(c1)I)OCC2=NCCN2)F 34a_200013204775_100000737910 [0,1,0,0,0,1|0,2,0]=4 1321 B17R2.83661 Fc1cc(c(c(c1)I)OCC2=NCCN2)F 7a_200013204775_100000737910 [0,1,0,0,0,1|0,2,0]=4 1322 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Br)Br 34a_100011215609_100000737910 [0,1,0,0,0,1|0,2,0]=4 1323 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Br)Cl 34a_100011217455_100000737910 [0,1,0,0,0,1|0,2,0]=4 1324 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Br 34a_100000725741_100000737910 [0,1,0,0,0,1|0,1,0]=3 1325 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Br 7a_100000725741_100000737910 [0,1,0,0,0,1|0,1,0]=3 1326 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Cl 34a_100000688862_100000737910 [0,1,0,0,0,1|0,1,0]=3 1327 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Cl 7a_100000688862_100000737910 [0,1,0,0,0,1|0,1,0]=3 1328 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Br 34a_100000758902_100000737910 [0,1,0,0,0,1|0,2,0]=4 1329 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Br 7a_100000758902_100000737910 [0,1,0,0,0,1|0,2,0]=4 1330 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Cl 34a_100000695146_100000737910 [0,1,0,0,0,1|0,2,0]=4 1331 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Cl 7a_100000695146_100000737910 [0,1,0,0,0,1|0,2,0]=4 1332 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)I 34a_100012353610_100000737910 [0,1,0,0,0,1|0,2,0]=4 1333 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Br)Br 34a_100011216695_100000737910 [0,1,0,0,0,1|0,2,0]=4 1334 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Br)Br 7a_100011216695_100000737910 [0,1,0,0,0,1|0,2,0]=4 1335 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Br)Cl 34a_100011830412_100000737910 [0,1,0,0,0,1|0,2,0]=4 1336 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Br)Cl 7a_100011830412_100000737910 [0,1,0,0,0,1|0,2,0]=4 1337 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100011216646_100000737910 [0,1,0,0,0,1|0,1,0]=3 1338 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100011216646_100000737910 [0,1,0,0,0,1|0,1,0]=3 1339 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)F)Br 34a_100011216917_100000737910 [0,1,0,0,0,1|0,2,0]=4 1340 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)F)Br 7a_100011216917_100000737910 [0,1,0,0,0,1|0,2,0]=4 1341 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)F)Cl 34a_100011830429_100000737910 [0,1,0,0,0,1|0,2,0]=4 1342 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)F)Cl 7a_100011830429_100000737910 [0,1,0,0,0,1|0,2,0]=4 1343 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)F)I 34a_200011830255_100000737910 [0,1,0,0,0,1|0,2,0]=4 1344 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)F)I 7a_200011830255_100000737910 [0,1,0,0,0,1|0,2,0]=4 1345 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)I)Br 34a_100013354677_100000737910 [0,1,0,0,0,1|0,2,0]=4 1346 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)I)Br 7a_100013354677_100000737910 [0,1,0,0,0,1|0,2,0]=4 1347 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Br)Br 62a_100000708766_100000737910 [0,1,0,0,0,1|0,2,0]=4 1348 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Br)Br 62a_100000737910_100000708766 [0,1,0,0,0,1|0,2,0]=4 1349 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Br)Cl 62a_100000737910_100009993495 [0,1,0,0,0,1|0,2,0]=4 1350 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Br)Cl 62a_100009993495_100000737910 [0,1,0,0,0,1|0,2,0]=4 1351 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_100000737910_100010212234 [0,1,0,0,0,1|0,1,0]=3 1352 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_100010212234_100000737910 [0,1,0,0,0,1|0,1,0]=3 1353 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)F)Br 62a_100000737910_100009813614 [0,1,0,0,0,1|0,2,0]=4 1354 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)F)Br 62a_100009813614_100000737910 [0,1,0,0,0,1|0,2,0]=4 1355 B17R2.83661 Ic1cc(c(c(c1)I)OCC2=NCCN2)I 7a_100000210296_100000737910 [0,1,0,0,0,1|0,2,0]=4 1356 B17R2.83661 Nc1cc(c(c(c1)Br)OCC2=NCCN2)Br 34a_200000186426_100000737910 [0,1,0,0,0,1|0,2,0]=4 1357 B17R2.83661 Nc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100000695418_100000737910 [0,1,0,0,0,1|0,0,0]=2 1358 B17R2.83661 Nc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100000695418_100000737910 [0,1,0,0,0,1|0,0,0]=2 1359 B17R2.83661 Nc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 34a_100000695418_100016991755 [0,1,0,0,0,1|0,0,2]=4 1360 B17R2.83661 Nc1cc(c(c(c1)Cl)OCc2ncc[nH]2)Cl 7a_100000695418_100000753453 [0,1,0,0,0,1|0,0,2]=4 1361 B17R2.83661 Nc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 34a_100000695418_100000765167 [0,1,0,0,0,1|2,0,0]=4 1362 B17R2.83661 Nc1cc(c(c(c1)Cl)OCc2nnn[nH]2)Cl 7a_100000695418_100000765167 [0,1,0,0,0,1|2,0,0]=4 1363 B17R2.83661 Nc1cc(c(c(c1)Cl)SCC2=NCCN2)F 62a_100000737910_100014833993 [0,1,0,0,0,1|0,1,0]=3 1364 B17R2.83661 Nc1cc(c(c(c1)Cl)SCC2=NCCN2)F 62a_100014833993_100000737910 [0,1,0,0,0,1|0,1,0]=3 1365 B17R2.83661 Nc1cc(c(c(c1)F)OCC2=NCCN2)F 34a_100016987357_100000737910 [0,1,0,0,0,1|0,2,0]=4 1366 B17R2.83661 Nc1cc(c(c(c1)F)OCC2=NCCN2)F 7a_100016987357_100000737910 [0,1,0,0,0,1|0,2,0]=4 1367 B17R2.83661 Nc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100000057532_100000737910 [0,1,0,0,0,1|0,2,0]=4 1368 B17R2.83661 Nc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100000737910_100000057532 [0,1,0,0,0,1|0,2,0]=4 1369 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Br)Br 34a_100010781877_100000737910 [0,1,0,0,0,1|1,1,0]=4 1370 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Br)Br 7a_100010781877_100000737910 [0,1,0,0,0,1|1,1,0]=4 1371 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Br)Cl 34a_106741647128_100000737910 [0,1,0,0,0,1|1,1,0]=4 1372 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Br)Cl 7a_106741647128_100000737910 [0,1,0,0,0,1|1,1,0]=4 1373 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Br)F 34a_200011217456_100000737910 [0,1,0,0,0,1|1,1,0]=4 1374 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Br)F 7a_200011217456_100000737910 [0,1,0,0,0,1|1,1,0]=4 1375 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100000694353_100000737910 [0,1,0,0,0,1|1,0,0]=3 1376 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100000694353_100000737910 [0,1,0,0,0,1|1,0,0]=3 1377 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Cl 34a_100000695819_100000737910 [0,1,0,0,0,1|1,0,0]=3 1378 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Cl 7a_100000695819_100000737910 [0,1,0,0,0,1|1,0,0]=3 1379 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)F)Br 34a_100011217383_100000737910 [0,1,0,0,0,1|1,1,0]=4 1380 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)F)Br 7a_100011217383_100000737910 [0,1,0,0,0,1|1,1,0]=4 1381 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)F)F 34a_100015205836_100000737910 [0,1,0,0,0,1|1,1,0]=4 1382 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)F)F 7a_100015205836_100000737910 [0,1,0,0,0,1|1,1,0]=4 1383 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)I)Br 7a_100016071998_100000737910 [0,1,0,0,0,1|1,1,0]=4 1384 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)Br)Cl 62a_100000737910_100011155807 [0,1,0,0,0,1|1,1,0]=4 1385 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)Br)Cl 62a_100011155807_100000737910 [0,1,0,0,0,1|1,1,0]=4 1386 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)Br)F 62a_100000737910_200010740111 [0,1,0,0,0,1|1,1,0]=4 1387 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)Br)F 62a_200010740111_100000737910 [0,1,0,0,0,1|1,1,0]=4 1388 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)F)Cl 62a_100000737910_200021297760 [0,1,0,0,0,1|1,1,0]=4 1389 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)F)Cl 62a_200021297760_100000737910 [0,1,0,0,0,1|1,1,0]=4 1390 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)F)F 62a_100000716482_100000737910 [0,1,0,0,0,1|1,1,0]=4 1391 B17R2.83661 Nc1cc(cc(c1SCC2=NCCN2)F)F 62a_100000737910_100000716482 [0,1,0,0,0,1|1,1,0]=4 1392 B17R2.83661 Nc1cc(nc(c1SCC2=NCCN2)Cl)Cl 62a_100000737910_100021004378 [0,1,0,0,0,1|2,0,0]=4 1393 B17R2.83661 Nc1cc(nc(c1SCC2=NCCN2)Cl)Cl 62a_100021004378_100000737910 [0,1,0,0,0,1|2,0,0]=4 1394 B17R2.83661 Oc1cc(c(c(c1)F)NCC2=NCCN2)F 34a_100000036573_100000737910 [0,1,0,0,0,1|0,2,0]=4 1395 B17R2.83661 Oc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100000737910_100009816007 [0,1,0,0,0,1|0,2,0]=4 1396 B17R2.83661 Oc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100009816007_100000737910 [0,1,0,0,0,1|0,2,0]=4 1397 B17R2.83661 Oc1cc(c(c(c1)O)SCC2=NCCN2)O 62a_100000737910_200010341185 [0,1,0,0,0,1|2,0,0]=4 1398 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)Br 34a_100015475841_100000737910 [0,1,0,0,0,1|1,1,0]=4 1399 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)Cl 34a_100010883250_100000737910 [0,1,0,0,0,1|1,1,0]=4 1400 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)Cl 7a_100010883250_100000737910 [0,1,0,0,0,1|1,1,0]=4 1401 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)F 34a_100011217947_100000737910 [0,1,0,0,0,1|1,1,0]=4 1402 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)F 7a_100011217947_100000737910 [0,1,0,0,0,1|1,1,0]=4 1403 B17R2.83661 Oc1cc(cc(c1SCC2=NCCN2)F)F 62a_100000737910_100009815984 [0,1,0,0,0,1|1,1,0]=4 1404 B17R2.83661 Oc1cc(cc(c1SCC2=NCCN2)F)F 62a_100009815984_100000737910 [0,1,0,0,0,1|1,1,0]=4 1405 B17R2.146246 Cc1c[nH]c(n1)SCc2c(cccc2Cl)Cl 62a_100000187851_100161115468 [0,1,0,0,0,1|0,0,2]=4 1406 B17R2.146246 Cc1c[nH]c(n1)SCc2c(cccc2Cl)Cl 62a_100161115468_100000187851 [0,1,0,0,0,1|0,0,2]=4 1407 B17R2.146246 O=c1[nH]nc([nH]1)COc2c(cccc2Cl)Cl 7a_100000211709_100000754189 [0,1,0,0,0,1|1,0,1]=4 1408 B17R2.146246 O=c1[nH]nc([nH]1)CSc2c(cccc2Cl)Cl 62a_100000034237_100000754189 [0,1,0,0,0,1|1,0,1]=4 1409 B17R2.276976 Cc1c(ccc(c1NCC2=NCCN2)Br)F 34a_100011009917_100000737910 [0,1,0,0,0,1|1,1,0]=4 1410 B17R2.276976 Cc1c(ccc(c1NCC2=NCCN2)Cl)Cl 34a_100009961198_100000737910 [0,1,0,0,0,1|1,0,0]=3 1411 B17R2.276976 Cc1c(ccc(c1NCC2=NCCN2)F)Br 34a_100010588651_100000737910 [0,1,0,0,0,1|1,1,0]=4 1412 B17R2.276976 Cc1c(ccc(c1NCC2=NCCN2)O)Br 34a_100013039247_100000737910 [0,1,0,0,0,1|2,0,0]=4 1413 B17R2.276976 Cc1c(ccc(c1OCC2=NCCN2)Br)Cl 34a_200010391122_100000737910 [0,1,0,0,0,1|1,1,0]=4 1414 B17R2.276976 Cc1c(ccc(c1OCC2=NCCN2)Br)Cl 7a_200010391122_100000737910 [0,1,0,0,0,1|1,1,0]=4 1415 B17R2.276976 Cc1c(ccc(c1OCC2=NCCN2)Br)F 34a_200010391124_100000737910 [0,1,0,0,0,1|1,1,0]=4 1416 B17R2.276976 Cc1c(ccc(c1OCC2=NCCN2)Br)F 7a_200010391124_100000737910 [0,1,0,0,0,1|1,1,0]=4 1417 B17R2.276976 Cc1c(ccc(c1SCC2=NCCN2)F)F 62a_100000737910_100010167959 [0,1,0,0,0,1|1,1,0]=4 1418 B17R2.276976 Cc1c(ccc(c1SCC2=NCCN2)F)F 62a_100010167959_100000737910 [0,1,0,0,0,1|1,1,0]=4 1419 B17R2.276976 Cc1ccc(c(c1Br)OCC2=NCCN2)F 34a_200010223207_100000737910 [0,1,0,0,0,1|0,2,0]=4 1420 B17R2.276976 Cc1ccc(c(c1Br)OCC2=NCCN2)F 7a_200010223207_100000737910 [0,1,0,0,0,1|0,2,0]=4 1421 B17R2.276976 Cc1ccc(c(c1C)NCC2=NCCN2)C 34a_100000117417_100000737910 [0,1,0,0,0,1|2,0,0]=4 1422 B17R2.276976 Cc1ccc(c(c1C)NCC2=NCCN2)C 7a_100000117417_100000737910 [0,1,0,0,0,1|2,0,0]=4 1423 B17R2.276976 Cc1ccc(c(c1C)OCC2=NCCN2)C 34a_100000211305_100000737910 [0,1,0,0,0,1|2,0,0]=4 1424 B17R2.276976 Cc1ccc(c(c1C)OCC2=NCCN2)C 7a_100000211305_100000737910 [0,1,0,0,0,1|2,0,0]=4 1425 B17R2.276976 Cc1ccc(c(c1Cl)CSc2ncc[nH]2)Cl 62a_100025796157_200010220899 [0,1,0,0,0,1|0,0,2]=4 1426 B17R2.276976 Cc1ccc(c(c1Cl)CSc2ncc[nH]2)Cl 62a_200010220899_100025796157 [0,1,0,0,0,1|0,0,2]=4 1427 B17R2.276976 Cc1ccc(c(c1Cl)NCC2=NCCN2)Cl 34a_100000210993_100000737910 [0,1,0,0,0,1|0,0,0]=2 1428 B17R2.276976 Cc1ccc(c(c1Cl)NCC2=NCCN2)F 34a_106744479701_100000737910 [0,1,0,0,0,1|0,1,0]=3 1429 B17R2.276976 Cc1ccc(c(c1Cl)NCc2ncc[nH]2)Cl 34a_100000210993_100016991755 [0,1,0,0,0,1|0,0,2]=4 1430 B17R2.276976 Cc1ccc(c(c1Cl)NCc2nnn[nH]2)Cl 34a_100000210993_100000765167 [0,1,0,0,0,1|2,0,0]=4 1431 B17R2.276976 Cc1ccc(c(c1Cl)OCC2=NCCN2)Cl 34a_200000087117_100000737910 [0,1,0,0,0,1|0,0,0]=2 1432 B17R2.276976 Cc1ccc(c(c1Cl)OCC2=NCCN2)Cl 7a_200000087117_100000737910 [0,1,0,0,0,1|0,0,0]=2 1433 B17R2.276976 Cc1ccc(c(c1Cl)OCC2=NCCN2)F 34a_100000035349_100000737910 [0,1,0,0,0,1|0,1,0]=3 1434 B17R2.276976 Cc1ccc(c(c1Cl)OCC2=NCCN2)F 7a_100000035349_100000737910 [0,1,0,0,0,1|0,1,0]=3 1435 B17R2.276976 Cc1ccc(c(c1Cl)OCc2ncc[nH]2)Cl 34a_200000087117_100016991755 [0,1,0,0,0,1|0,0,2]=4 1436 B17R2.276976 Cc1ccc(c(c1Cl)OCc2ncc[nH]2)Cl 7a_200000087117_100000753453 [0,1,0,0,0,1|0,0,2]=4 1437 B17R2.276976 Cc1ccc(c(c1Cl)OCc2nnn[nH]2)Cl 34a_200000087117_100000765167 [0,1,0,0,0,1|2,0,0]=4 1438 B17R2.276976 Cc1ccc(c(c1Cl)OCc2nnn[nH]2)Cl 7a_200000087117_100000765167 [0,1,0,0,0,1|2,0,0]=4 1439 B17R2.276976 Cc1ccc(c(c1F)NCC2=NCCN2)Cl 34a_100000062009_100000737910 [0,1,0,0,0,1|0,1,0]=3 1440 B17R2.276976 Cc1ccc(c(c1F)NCC2=NCCN2)F 34a_102495364760_100000737910 [0,1,0,0,0,1|0,2,0]=4 1441 B17R2.276976 Cc1ccc(c(c1F)OCC2=NCCN2)Br 34a_100000722096_100000737910 [0,1,0,0,0,1|0,2,0]=4 1442 B17R2.276976 Cc1ccc(c(c1F)OCC2=NCCN2)Br 7a_100000722096_100000737910 [0,1,0,0,0,1|0,2,0]=4 1443 B17R2.276976 Cc1ccc(c(c1F)OCC2=NCCN2)Cl 34a_200000034537_100000737910 [0,1,0,0,0,1|0,1,0]=3 1444 B17R2.276976 Cc1ccc(c(c1F)OCC2=NCCN2)Cl 7a_200000034537_100000737910 [0,1,0,0,0,1|0,1,0]=3 1445 B17R2.276976 Cc1ccc(c(c1F)OCC2=NCCN2)F 34a_100011216644_100000737910 [0,1,0,0,0,1|0,2,0]=4 1446 B17R2.276976 Cc1ccc(c(c1F)OCC2=NCCN2)F 7a_100011216644_100000737910 [0,1,0,0,0,1|0,2,0]=4 1447 B17R2.276976 Cc1ccc(c(c1NCC2=NCCN2)C)Br 34a_200010074581_100000737910 [0,1,0,0,0,1|2,0,0]=4 1448 B17R2.276976 Cc1ccc(c(c1NCC2=NCCN2)C)Cl 34a_200020642106_100000737910 [0,1,0,0,0,1|2,0,0]=4 1449 B17R2.276976 Cc1ccc(c(c1NCC2=NCCN2)C)I 34a_200010115591_100000737910 [0,1,0,0,0,1|2,0,0]=4 1450 B17R2.276976 Cc1ccc(c(c1OCC2=NCCN2)Cl)N 34a_100000036876_100000737910 [0,1,0,0,0,1|1,0,0]=3 1451 B17R2.276976 Cc1ccc(c(c1OCC2=NCCN2)Cl)N 7a_100000036876_100000737910 [0,1,0,0,0,1|1,0,0]=3 1452 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)C)F 62a_100000737910_100011068659 [0,1,0,0,0,1|2,0,0]=4 1453 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)C)F 62a_100011068659_100000737910 [0,1,0,0,0,1|2,0,0]=4 1454 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)C)N 62a_100000737910_106354213274 [0,1,0,0,0,1|2,0,0]=4 1455 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)C)N 62a_106354213274_100000737910 [0,1,0,0,0,1|2,0,0]=4 1456 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)C)O 62a_100000737910_100010659238 [0,1,0,0,0,1|2,0,0]=4 1457 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)C)O 62a_100010659238_100000737910 [0,1,0,0,0,1|2,0,0]=4 1458 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)O)F 62a_100000737910_200010223207 [0,1,0,0,0,1|2,0,0]=4 1459 B17R2.276976 Cc1ccc(c(c1SCC2=NCCN2)O)F 62a_200010223207_100000737910 [0,1,0,0,0,1|2,0,0]=4 1460 B17R2.276976 Clc1ccc(c(c1Cl)NCC2=NCCN2)Cl 34a_103437851083_100000737910 [0,1,0,0,0,1|0,0,0]=2 1461 B17R2.276976 Clc1ccc(c(c1Cl)NCc2ncc[nH]2)Cl 34a_103437851083_100016991755 [0,1,0,0,0,1|0,0,2]=4 1462 B17R2.276976 Clc1ccc(c(c1Cl)NCc2nnn[nH]2)Cl 34a_103437851083_100000765167 [0,1,0,0,0,1|2,0,0]=4 1463 B17R2.276976 Clc1ccc(c(c1Cl)OCC2=NCCN2)Cl 34a_100000042553_100000737910 [0,1,0,0,0,1|0,0,0]=2 1464 B17R2.276976 Clc1ccc(c(c1Cl)OCC2=NCCN2)Cl 7a_100000042553_100000737910 [0,1,0,0,0,1|0,0,0]=2 1465 B17R2.276976 Clc1ccc(c(c1Cl)OCc2ncc[nH]2)Cl 34a_100000042553_100016991755 [0,1,0,0,0,1|0,0,2]=4 1466 B17R2.276976 Clc1ccc(c(c1Cl)OCc2ncc[nH]2)Cl 7a_100000042553_100000753453 [0,1,0,0,0,1|0,0,2]=4 1467 B17R2.276976 Clc1ccc(c(c1Cl)OCc2nnn[nH]2)Cl 34a_100000042553_100000765167 [0,1,0,0,0,1|2,0,0]=4 1468 B17R2.276976 Clc1ccc(c(c1Cl)OCc2nnn[nH]2)Cl 7a_100000042553_100000765167 [0,1,0,0,0,1|2,0,0]=4 1469 B17R2.276976 Clc1ccc(c(c1Cl)SCC2=NCCN2)Cl 62a_100000737910_200010170825 [0,1,0,0,0,1|0,0,0]=2 1470 B17R2.276976 Clc1ccc(c(c1Cl)SCC2=NCCN2)Cl 62a_200010170825_100000737910 [0,1,0,0,0,1|0,0,0]=2 1471 B17R2.276976 Clc1ccc(c(c1Cl)SCc2ncc[nH]2)Cl 62a_100016991755_200010170825 [0,1,0,0,0,1|0,0,2]=4 1472 B17R2.276976 Clc1ccc(c(c1Cl)SCc2ncc[nH]2)Cl 62a_200010170825_100016991755 [0,1,0,0,0,1|0,0,2]=4 1473 B17R2.276976 Clc1ccc(c(c1Cl)SCc2nnn[nH]2)Cl 62a_100000765167_200010170825 [0,1,0,0,0,1|2,0,0]=4 1474 B17R2.276976 Clc1ccc(c(c1Cl)SCc2nnn[nH]2)Cl 62a_200010170825_100000765167 [0,1,0,0,0,1|2,0,0]=4 1475 B17R2.276976 Clc1ccc(c(c1OCC2=NCCN2)Cl)Br 34a_100010089855_100000737910 [0,1,0,0,0,1|0,0,0]=2 1476 B17R2.276976 Clc1ccc(c(c1OCC2=NCCN2)Cl)Br 7a_100010089855_100000737910 [0,1,0,0,0,1|0,0,0]=2 1477 B17R2.276976 Clc1ccc(c(c1OCc2ncc[nH]2)Cl)Br 34a_100010089855_100016991755 [0,1,0,0,0,1|0,0,2]=4 1478 B17R2.276976 Clc1ccc(c(c1OCc2ncc[nH]2)Cl)Br 7a_100010089855_100000753453 [0,1,0,0,0,1|0,0,2]=4 1479 B17R2.276976 Clc1ccc(c(c1OCc2nnn[nH]2)Cl)Br 34a_100010089855_100000765167 [0,1,0,0,0,1|2,0,0]=4 1480 B17R2.276976 Clc1ccc(c(c1OCc2nnn[nH]2)Cl)Br 7a_100010089855_100000765167 [0,1,0,0,0,1|2,0,0]=4 1481 B17R2.276976 Fc1c(ccc(c1NCC2=NCCN2)Br)Cl 34a_100011010633_100000737910 [0,1,0,0,0,1|0,2,0]=4 1482 B17R2.276976 Fc1c(ccc(c1NCC2=NCCN2)Cl)Br 34a_100010995236_100000737910 [0,1,0,0,0,1|0,1,0]=3 1483 B17R2.276976 Fc1c(ccc(c1NCC2=NCCN2)Cl)Cl 34a_200000061452_100000737910 [0,1,0,0,0,1|0,1,0]=3 1484 B17R2.276976 Fc1c(ccc(c1OCC2=NCCN2)Br)Cl 34a_100010081130_100000737910 [0,1,0,0,0,1|0,2,0]=4 1485 B17R2.276976 Fc1c(ccc(c1OCC2=NCCN2)Br)Cl 7a_100010081130_100000737910 [0,1,0,0,0,1|0,2,0]=4 1486 B17R2.276976 Fc1c(ccc(c1OCC2=NCCN2)Br)I 34a_200010782288_100000737910 [0,1,0,0,0,1|0,2,0]=4 1487 B17R2.276976 Fc1c(ccc(c1OCC2=NCCN2)Br)I 7a_200010782288_100000737910 [0,1,0,0,0,1|0,2,0]=4 1488 B17R2.276976 Fc1c(ccc(c1OCC2=NCCN2)Cl)Br 34a_100010240321_100000737910 [0,1,0,0,0,1|0,1,0]=3 1489 B17R2.276976 Fc1c(ccc(c1OCC2=NCCN2)Cl)Br 7a_100010240321_100000737910 [0,1,0,0,0,1|0,1,0]=3 1490 B17R2.276976 Fc1c(ccc(c1SCC2=NCCN2)Br)Cl 62a_100000737910_100011084128 [0,1,0,0,0,1|0,2,0]=4 1491 B17R2.276976 Fc1c(ccc(c1SCC2=NCCN2)Br)Cl 62a_100011084128_100000737910 [0,1,0,0,0,1|0,2,0]=4 1492 B17R2.276976 Fc1c(ccc(c1SCC2=NCCN2)Cl)Br 62a_100000737910_100011092007 [0,1,0,0,0,1|0,1,0]=3 1493 B17R2.276976 Fc1c(ccc(c1SCC2=NCCN2)Cl)Br 62a_100011092007_100000737910 [0,1,0,0,0,1|0,1,0]=3 1494 B17R2.276976 Fc1c(ncc(c1SCC2=NCCN2)Cl)Cl 62a_100000737910_200010275081 [0,1,0,0,0,1|1,1,0]=4 1495 B17R2.276976 Fc1c(ncc(c1SCC2=NCCN2)Cl)Cl 62a_200010275081_100000737910 [0,1,0,0,0,1|1,1,0]=4 1496 B17R2.276976 Fc1ccc(c(c1Br)NCC2=NCCN2)F 34a_100014094178_100000737910 [0,1,0,0,0,1|0,2,0]=4 1497 B17R2.276976 Fc1ccc(c(c1Br)OCC2=NCCN2)F 34a_100010170822_100000737910 [0,1,0,0,0,1|0,2,0]=4 1498 B17R2.276976 Fc1ccc(c(c1Br)OCC2=NCCN2)F 7a_100010170822_100000737910 [0,1,0,0,0,1|0,2,0]=4 1499 B17R2.276976 Fc1ccc(c(c1Br)SCC2=NCCN2)F 62a_100000737910_100010167956 [0,1,0,0,0,1|0,2,0]=4 1500 B17R2.276976 Fc1ccc(c(c1Br)SCC2=NCCN2)F 62a_100010167956_100000737910 [0,1,0,0,0,1|0,2,0]=4 1501 B17R2.276976 Fc1ccc(c(c1Cl)NCC2=NCCN2)F 34a_100000062006_100000737910 [0,1,0,0,0,1|0,1,0]=3 1502 B17R2.276976 Fc1ccc(c(c1Cl)OCC2=NCCN2)Br 34a_100014979575_100000737910 [0,1,0,0,0,1|0,1,0]=3 1503 B17R2.276976 Fc1ccc(c(c1Cl)OCC2=NCCN2)Br 7a_100014979575_100000737910 [0,1,0,0,0,1|0,1,0]=3 1504 B17R2.276976 Fc1ccc(c(c1Cl)OCC2=NCCN2)F 34a_100000038336_100000737910 [0,1,0,0,0,1|0,1,0]=3 1505 B17R2.276976 Fc1ccc(c(c1Cl)OCC2=NCCN2)F 7a_100000038336_100000737910 [0,1,0,0,0,1|0,1,0]=3 1506 B17R2.276976 Fc1ccc(c(c1Cl)SCC2=NCCN2)Br 62a_100000737910_200037249116 [0,1,0,0,0,1|0,1,0]=3 1507 B17R2.276976 Fc1ccc(c(c1Cl)SCC2=NCCN2)Br 62a_200037249116_100000737910 [0,1,0,0,0,1|0,1,0]=3 1508 B17R2.276976 Fc1ccc(c(c1Cl)SCC2=NCCN2)F 62a_100000737910_100010167948 [0,1,0,0,0,1|0,1,0]=3 1509 B17R2.276976 Fc1ccc(c(c1Cl)SCC2=NCCN2)F 62a_100010167948_100000737910 [0,1,0,0,0,1|0,1,0]=3 1510 B17R2.276976 Fc1ccc(c(c1F)NCC2=NCCN2)Br 34a_100010008850_100000737910 [0,1,0,0,0,1|0,2,0]=4 1511 B17R2.276976 Fc1ccc(c(c1F)NCC2=NCCN2)Cl 34a_200010381624_100000737910 [0,1,0,0,0,1|0,1,0]=3 1512 B17R2.276976 Fc1ccc(c(c1F)NCC2=NCCN2)F 34a_100000037384_100000737910 [0,1,0,0,0,1|0,2,0]=4 1513 B17R2.276976 Fc1ccc(c(c1F)NCC2=NCCN2)I 34a_100015763296_100000737910 [0,1,0,0,0,1|0,2,0]=4 1514 B17R2.276976 Fc1ccc(c(c1F)OCC2=NCCN2)Br 34a_100010243909_100000737910 [0,1,0,0,0,1|0,2,0]=4 1515 B17R2.276976 Fc1ccc(c(c1F)OCC2=NCCN2)Br 7a_100010243909_100000737910 [0,1,0,0,0,1|0,2,0]=4 1516 B17R2.276976 Fc1ccc(c(c1F)OCC2=NCCN2)F 34a_100000031686_100000737910 [0,1,0,0,0,1|0,2,0]=4 1517 B17R2.276976 Fc1ccc(c(c1F)OCC2=NCCN2)F 7a_100000031686_100000737910 [0,1,0,0,0,1|0,2,0]=4 1518 B17R2.276976 Fc1ccc(c(c1F)SCC2=NCCN2)F 62a_100000737910_100009814005 [0,1,0,0,0,1|0,2,0]=4 1519 B17R2.276976 Fc1ccc(c(c1F)SCC2=NCCN2)F 62a_100009814005_100000737910 [0,1,0,0,0,1|0,2,0]=4 1520 B17R2.276976 Fc1ccc(c(c1NCC2=NCCN2)Cl)Cl 34a_100000061523_100000737910 [0,1,0,0,0,1|0,1,0]=3 1521 B17R2.276976 Fc1ccc(c(c1NCC2=NCCN2)F)Br 34a_100025793129_100000737910 [0,1,0,0,0,1|0,2,0]=4 1522 B17R2.276976 Fc1ccc(c(c1NCC2=NCCN2)F)Cl 34a_102495364764_100000737910 [0,1,0,0,0,1|0,2,0]=4 1523 B17R2.276976 Fc1ccc(c(c1OCC2=NCCN2)Cl)Cl 34a_100000062035_100000737910 [0,1,0,0,0,1|0,1,0]=3 1524 B17R2.276976 Fc1ccc(c(c1OCC2=NCCN2)Cl)Cl 7a_100000062035_100000737910 [0,1,0,0,0,1|0,1,0]=3 1525 B17R2.276976 Fc1ccc(c(c1OCC2=NCCN2)F)Br 34a_100010167067_100000737910 [0,1,0,0,0,1|0,2,0]=4 1526 B17R2.276976 Fc1ccc(c(c1OCC2=NCCN2)F)Br 7a_100010167067_100000737910 [0,1,0,0,0,1|0,2,0]=4 1527 B17R2.276976 Fc1ccc(c(c1OCC2=NCCN2)F)Cl 34a_100000034634_100000737910 [0,1,0,0,0,1|0,2,0]=4 1528 B17R2.276976 Fc1ccc(c(c1OCC2=NCCN2)F)Cl 7a_100000034634_100000737910 [0,1,0,0,0,1|0,2,0]=4 1529 B17R2.276976 Fc1ccc(c(c1SCC2=NCCN2)Cl)Cl 62a_100000737910_200015697950 [0,1,0,0,0,1|0,1,0]=3 1530 B17R2.276976 Fc1ccc(c(c1SCC2=NCCN2)Cl)Cl 62a_200015697950_100000737910 [0,1,0,0,0,1|0,1,0]=3 1531 B17R2.276976 Fc1ccc(c(c1SCC2=NCCN2)F)Br 62a_100000722365_100000737910 [0,1,0,0,0,1|0,2,0]=4 1532 B17R2.276976 Fc1ccc(c(c1SCC2=NCCN2)F)Br 62a_100000737910_100000722365 [0,1,0,0,0,1|0,2,0]=4 1533 B17R2.276976 Fc1ccc(c(c1SCC2=NCCN2)F)Cl 62a_100000737910_200010167938 [0,1,0,0,0,1|0,2,0]=4 1534 B17R2.276976 Fc1ccc(c(c1SCC2=NCCN2)F)Cl 62a_200010167938_100000737910 [0,1,0,0,0,1|0,2,0]=4 1535 B17R2.276976 Fc1ncc(c(c1Cl)SCC2=NCCN2)Cl 62a_100000737910_100010116697 [0,1,0,0,0,1|1,0,0]=3 1536 B17R2.276976 Fc1ncc(c(c1Cl)SCC2=NCCN2)Cl 62a_100010116697_100000737910 [0,1,0,0,0,1|1,0,0]=3 1537 B17R2.276976 Fc1ncc(c(c1F)SCC2=NCCN2)Cl 62a_100000737910_100010233662 [0,1,0,0,0,1|1,1,0]=4 1538 B17R2.276976 Fc1ncc(c(c1F)SCC2=NCCN2)Cl 62a_100010233662_100000737910 [0,1,0,0,0,1|1,1,0]=4 1539 B17R2.276976 Nc1c(ccc(c1SCC2=NCCN2)F)F 62a_100000737910_100014094178 [0,1,0,0,0,1|1,1,0]=4 1540 B17R2.276976 Nc1c(ccc(c1SCC2=NCCN2)F)F 62a_100014094178_100000737910 [0,1,0,0,0,1|1,1,0]=4 1541 B17R2.276976 Nc1ccc(c(c1F)SCC2=NCCN2)F 62a_100000737910_100010070858 [0,1,0,0,0,1|0,2,0]=4 1542 B17R2.276976 Nc1ccc(c(c1F)SCC2=NCCN2)F 62a_100010070858_100000737910 [0,1,0,0,0,1|0,2,0]=4 1543 B17R2.276976 Nc1ccc(c(c1N)SCC2=NCCN2)F 62a_100010128261_100000737910 [0,1,0,0,0,1|1,1,0]=4 1544 B17R2.276976 Nc1ccc(c(c1O)SCC2=NCCN2)F 62a_100000737910_100010128263 [0,1,0,0,0,1|1,1,0]=4 1545 B17R2.276976 Nc1ccc(c(c1O)SCC2=NCCN2)F 62a_100010128263_100000737910 [0,1,0,0,0,1|1,1,0]=4 1546 B17R2.276976 Nc1ccc(c(c1OCC2=NCCN2)Br)F 34a_100010128263_100000737910 [0,1,0,0,0,1|1,1,0]=4 1547 B17R2.276976 Nc1ccc(c(c1OCC2=NCCN2)Br)F 7a_100010128263_100000737910 [0,1,0,0,0,1|1,1,0]=4 1548 B17R2.276976 Nc1ccc(c(c1OCC2=NCCN2)F)F 34a_100015205010_100000737910 [0,1,0,0,0,1|1,1,0]=4 1549 B17R2.276976 Nc1ccc(c(c1OCC2=NCCN2)F)F 7a_100015205010_100000737910 [0,1,0,0,0,1|1,1,0]=4 1550 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)Br)F 62a_100000737910_100020765651 [0,1,0,0,0,1|1,1,0]=4 1551 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)Br)F 62a_100020765651_100000737910 [0,1,0,0,0,1|1,1,0]=4 1552 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)Cl)Br 62a_100000737910_200010779962 [0,1,0,0,0,1|1,0,0]=3 1553 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)Cl)Br 62a_200010779962_100000737910 [0,1,0,0,0,1|1,0,0]=3 1554 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)Cl)Cl 62a_100000737910_200011093878 [0,1,0,0,0,1|1,0,0]=3 1555 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)Cl)Cl 62a_200011093878_100000737910 [0,1,0,0,0,1|1,0,0]=3 1556 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)F)Cl 62a_100000737910_100010134325 [0,1,0,0,0,1|1,1,0]=4 1557 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)F)Cl 62a_100010134325_100000737910 [0,1,0,0,0,1|1,1,0]=4 1558 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)F)F 62a_100000737910_100010232473 [0,1,0,0,0,1|1,1,0]=4 1559 B17R2.276976 Nc1ccc(c(c1SCC2=NCCN2)F)F 62a_100010232473_100000737910 [0,1,0,0,0,1|1,1,0]=4 1560 B17R2.276976 Oc1c(ccc(c1SCC2=NCCN2)F)F 62a_100000737910_100010170822 [0,1,0,0,0,1|1,1,0]=4 1561 B17R2.276976 Oc1c(ccc(c1SCC2=NCCN2)F)F 62a_100010170822_100000737910 [0,1,0,0,0,1|1,1,0]=4 1562 B17R2.276976 Oc1ccc(c(c1Cl)NCC2=NCCN2)Cl 34a_100016988457_100000737910 [0,1,0,0,0,1|0,0,0]=2 1563 B17R2.276976 Oc1ccc(c(c1Cl)NCC2=NCCN2)Cl 7a_100016988457_100000737910 [0,1,0,0,0,1|0,0,0]=2 1564 B17R2.276976 Oc1ccc(c(c1Cl)NCc2ncc[nH]2)Cl 34a_100016988457_100016991755 [0,1,0,0,0,1|0,0,2]=4 1565 B17R2.276976 Oc1ccc(c(c1Cl)NCc2ncc[nH]2)Cl 7a_100016988457_100000753453 [0,1,0,0,0,1|0,0,2]=4 1566 B17R2.276976 Oc1ccc(c(c1Cl)NCc2nnn[nH]2)Cl 34a_100016988457_100000765167 [0,1,0,0,0,1|2,0,0]=4 1567 B17R2.276976 Oc1ccc(c(c1Cl)NCc2nnn[nH]2)Cl 7a_100016988457_100000765167 [0,1,0,0,0,1|2,0,0]=4 1568 B15R2.1117 Clc1cccc(c1)NCC2=NCCN2 34a_100000185859_100000737910 [0,0,1,1,0,0|2,0,0]=4 1569 B15R2.1117 Clc1cccc(c1)OCC2=NCCN2 34a_100000210295_100000737910 [0,0,1,1,0,0|2,0,0]=4 1570 B15R2.1117 Clc1cccc(c1)OCC2=NCCN2 7a_100000210295_100000737910 [0,0,1,1,0,0|2,0,0]=4 1571 B15R2.1117 Clc1cccc(c1)SCC2=NCCN2 62a_100000699651_100000737910 [0,0,1,1,0,0|2,0,0]=4 1572 B15R2.1117 Clc1cccc(c1)SCC2=NCCN2 62a_100000737910_100000699651 [0,0,1,1,0,0|2,0,0]=4 1573 B15R2.1117 Clc1cccc(n1)SCC2=NCCN2 62a_100000051397_100000737910 [0,0,1,1,0,0|2,0,0]=4 1574 B15R2.1117 Clc1cccc(n1)SCC2=NCCN2 62a_100000737910_100000051397 [0,0,1,1,0,0|2,0,0]=4 1575 B15R2.65094 O=C(Cc1c(cccc1Cl)Cl)C2CC2 1458a_100000210395_100000187851 [0,0,1,1,0,0|2,0,0]=4 1576 B15R2.8633 Clc1cccc(c1CCNC2CC2)Cl 34a_100000212008_100012161200 [0,0,1,1,0,0|1,0,1]=4 1577 B15R2.8633 Clc1cccc(c1CCNC2CC2)Cl 34a_100032004868_100000211595 [0,0,1,1,0,0|1,0,1]=4 1578 B15R2.8669 Clc1cccc(c1CCN2CCC2)Cl 269982a_100000754969_100012161200 [0,0,1,1,0,0|1,0,1]=4 1579 B13R1.4453 CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210303 [0,0,1,0,1,0|2,0,0]=4 1580 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 11a_100015525214_100011253703 [0,0,1,0,1,0|1,1,0]=4 1581 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 240690a_100015525214_100011253703 [0,0,1,0,1,0|1,1,0]=4 1582 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 527a_100015525214_100011253703 [0,0,1,0,1,0|1,1,0]=4 1583 B13R1.4453 CCNC(=O)c1c(cccc1Cl)C 11a_100015525214_100000692601 [0,0,1,0,1,0|2,0,0]=4 1584 B13R1.4453 CCNC(=O)c1c(cccc1Cl)C 240690a_100015525214_100000692601 [0,0,1,0,1,0|2,0,0]=4 1585 B13R1.4453 CCNC(=O)c1c(cccc1Cl)Cl 11a_100015525214_100000210656 [0,0,1,0,1,0|1,0,0]=3 1586 B13R1.4453 CCNC(=O)c1c(cccc1Cl)Cl 240690a_100015525214_100000210656 [0,0,1,0,1,0|1,0,0]=3 1587 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 11a_100015525214_100000210369 [0,0,1,0,1,0|1,1,0]=4 1588 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 240690a_100015525214_100000210369 [0,0,1,0,1,0|1,1,0]=4 1589 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 527a_100015525214_100000210369 [0,0,1,0,1,0|1,1,0]=4 1590 B13R1.4453 CCNC(=O)c1c(cccc1Cl)O 240690a_100015525214_100000745519 [0,0,1,0,1,0|2,0,0]=4 1591 B13R1.4453 CCNC(=O)c1c(cccc1Cl)O 527a_100015525214_100000745519 [0,0,1,0,1,0|2,0,0]=4 1592 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 11a_100015525214_100000702859 [0,0,1,0,1,0|1,1,0]=4 1593 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 240690a_100015525214_100000702859 [0,0,1,0,1,0|1,1,0]=4 1594 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 527a_100015525214_100000702859 [0,0,1,0,1,0|1,1,0]=4 1595 B13R1.4453 CCN[C@H](C)c1c(cccc1Cl)Cl 2230a_100016989663_100000210202 [0,0,1,0,1,0|1,0,1]=4 1596 B13R1.4453 CCN[C@H](C)c1c(cccc1Cl)Cl 34a_100016989663_100000210202 [0,0,1,0,1,0|1,0,1]=4 1597 B13R1.4453 CNNC(=O)c1c(cccc1Cl)Cl 22a_100016993582_100000210656 [0,0,1,0,1,0|2,0,0]=4 1598 B13R2.18 Clc1ccccc1C2=CCCC2 271570a_100000089523_100000764095 [1,0,0,0,1,0|2,0,0]=4 1599 B13R2.18 Clc1ccccc1c2ncc[nH]2 271570a_100011934419_100025796157 [1,0,0,0,1,0|0,0,2]=4 1600 B13R2.18 Clc1ccccc1c2ncc[nH]2 271570a_100016988920_100000764095 [1,0,0,0,1,0|0,0,2]=4 1601 B13R2.5225 Clc1ccccc1CN2CCC2 269982a_100000754969_100000187162 [1,0,0,0,1,0|2,0,0]=4 1602 B13R2.5225 Clc1ccccc1CN2CCC2 26a_100000754969_100000210172 [1,0,0,0,1,0|2,0,0]=4 1603 B13R2.402 Clc1cccc(c1NC2CC2)Cl 34a_100000210028_100000211595 [0,0,0,0,2,0|1,0,1]=4 1604 B13R2.402 Clc1cccc(c1OC2CC2)Cl 34a_100000211709_100000211595 [0,0,0,0,2,0|1,0,1]=4 1605 B13R2.402 Clc1cccc(c1SC2CC2)Cl 62a_100000034237_100000211595 [0,0,0,0,2,0|1,0,1]=4 1606 B15R2.562 Brc1ccccc1NCC2=NCCN2 34a_100000210017_100000737910 [1,0,0,0,0,1|0,1,0]=3 1607 B15R2.562 Brc1ccccc1OCC2=NCCN2 34a_100000181306_100000737910 [1,0,0,0,0,1|0,1,0]=3 1608 B15R2.562 Brc1ccccc1OCC2=NCCN2 7a_100000181306_100000737910 [1,0,0,0,0,1|0,1,0]=3 1609 B15R2.562 Brc1ccccc1SCC2=NCCN2 62a_100000695589_100000737910 [1,0,0,0,0,1|0,1,0]=3 1610 B15R2.562 Brc1ccccc1SCC2=NCCN2 62a_100000737910_100000695589 [1,0,0,0,0,1|0,1,0]=3 1611 B15R2.562 Brc1cccnc1SCC2=NCCN2 62a_100000696092_100000737910 [1,0,0,0,0,1|1,1,0]=4 1612 B15R2.562 Brc1cccnc1SCC2=NCCN2 62a_100000737910_100000696092 [1,0,0,0,0,1|1,1,0]=4 1613 B15R2.562 Brc1ccncc1SCC2=NCCN2 62a_100000737910_100010138639 [1,0,0,0,0,1|1,1,0]=4 1614 B15R2.562 Brc1ccncc1SCC2=NCCN2 62a_100010138639_100000737910 [1,0,0,0,0,1|1,1,0]=4 1615 B15R2.562 Brc1cnccc1OCC2=NCCN2 34a_100011996408_100000737910 [1,0,0,0,0,1|1,1,0]=4 1616 B15R2.562 Brc1cnccc1SCC2=NCCN2 62a_100000726257_100000737910 [1,0,0,0,0,1|1,1,0]=4 1617 B15R2.562 Brc1cnccc1SCC2=NCCN2 62a_100000737910_100000726257 [1,0,0,0,0,1|1,1,0]=4 1618 B15R2.562 Brc1ncccc1OCC2=NCCN2 34a_100000744436_100000737910 [1,0,0,0,0,1|1,1,0]=4 1619 B15R2.562 Brc1ncccc1OCC2=NCCN2 7a_100000744436_100000737910 [1,0,0,0,0,1|1,1,0]=4 1620 B15R2.562 Brc1ncccc1SCC2=NCCN2 62a_100000737910_100010202626 [1,0,0,0,0,1|1,1,0]=4 1621 B15R2.562 Brc1ncccc1SCC2=NCCN2 62a_100010202626_100000737910 [1,0,0,0,0,1|1,1,0]=4 1622 B15R2.562 C[n+]1ccccc1SCC2=NCCN2 62a_100000737910_100000212160 [1,0,0,0,0,1|2,0,0]=4 1623 B15R2.562 Cc1ccccc1NCC2=NCCN2 34a_100015192222_100000737910 [1,0,0,0,0,1|1,0,0]=3 1624 B15R2.562 Cc1ccccc1OCC2=NCCN2 34a_100000210338_100000737910 [1,0,0,0,0,1|1,0,0]=3 1625 B15R2.562 Cc1ccccc1OCC2=NCCN2 7a_100000210338_100000737910 [1,0,0,0,0,1|1,0,0]=3 1626 B15R2.562 Cc1ccccc1SCC2=NCCN2 62a_100000210755_100000737910 [1,0,0,0,0,1|1,0,0]=3 1627 B15R2.562 Cc1ccccc1SCC2=NCCN2 62a_100000737910_100000210755 [1,0,0,0,0,1|1,0,0]=3 1628 B15R2.562 Cc1cccnc1SCC2=NCCN2 62a_100000737910_100000751373 [1,0,0,0,0,1|2,0,0]=4 1629 B15R2.562 Cc1cccnc1SCC2=NCCN2 62a_100000751373_100000737910 [1,0,0,0,0,1|2,0,0]=4 1630 B15R2.562 Cc1ccncc1OCC2=NCCN2 34a_100011997053_100000737910 [1,0,0,0,0,1|2,0,0]=4 1631 B15R2.562 Cc1ccncc1OCC2=NCCN2 7a_100011997053_100000737910 [1,0,0,0,0,1|2,0,0]=4 1632 B15R2.562 Cc1ccncc1SCC2=NCCN2 62a_100000737910_100000761580 [1,0,0,0,0,1|2,0,0]=4 1633 B15R2.562 Cc1ccncc1SCC2=NCCN2 62a_100000761580_100000737910 [1,0,0,0,0,1|2,0,0]=4 1634 B15R2.562 Cc1cnccc1OCC2=NCCN2 34a_100000694293_100000737910 [1,0,0,0,0,1|2,0,0]=4 1635 B15R2.562 Cc1cnccc1SCC2=NCCN2 62a_100000737910_100000765111 [1,0,0,0,0,1|2,0,0]=4 1636 B15R2.562 Cc1cnccc1SCC2=NCCN2 62a_100000765111_100000737910 [1,0,0,0,0,1|2,0,0]=4 1637 B15R2.562 Cc1ncccc1OCC2=NCCN2 34a_100000745507_100000737910 [1,0,0,0,0,1|2,0,0]=4 1638 B15R2.562 Cc1ncccc1OCC2=NCCN2 7a_100000745507_100000737910 [1,0,0,0,0,1|2,0,0]=4 1639 B15R2.562 Cc1ncccc1SCC2=NCCN2 62a_100000737910_100000751574 [1,0,0,0,0,1|2,0,0]=4 1640 B15R2.562 Cc1ncccc1SCC2=NCCN2 62a_100000751574_100000737910 [1,0,0,0,0,1|2,0,0]=4 1641 B15R2.562 Clc1ccccc1CSc2ncc[nH]2 62a_100000187162_100025796157 [1,0,0,0,0,1|0,0,2]=4 1642 B15R2.562 Clc1ccccc1CSc2ncc[nH]2 62a_100025796157_100000187162 [1,0,0,0,0,1|0,0,2]=4 1643 B15R2.562 Clc1ccccc1NCC2=NCCN2 34a_100000185783_100000737910 [1,0,0,0,0,1|0,0,0]=2 1644 B15R2.562 Clc1ccccc1NCc2ncc[nH]2 207a_100000185783_100000743867 [1,0,0,0,0,1|0,0,2]=4 1645 B15R2.562 Clc1ccccc1NCc2ncc[nH]2 34a_100000185783_100016991755 [1,0,0,0,0,1|0,0,2]=4 1646 B15R2.562 Clc1ccccc1NCc2nnn[nH]2 34a_100000185783_100000765167 [1,0,0,0,0,1|2,0,0]=4 1647 B15R2.562 Clc1ccccc1OCC2=NCCN2 34a_100000210172_100000737910 [1,0,0,0,0,1|0,0,0]=2 1648 B15R2.562 Clc1ccccc1OCC2=NCCN2 7a_100000210172_100000737910 [1,0,0,0,0,1|0,0,0]=2 1649 B15R2.562 Clc1ccccc1OCc2ncc[nH]2 34a_100000210172_100016991755 [1,0,0,0,0,1|0,0,2]=4 1650 B15R2.562 Clc1ccccc1OCc2ncc[nH]2 7a_100000210172_100000753453 [1,0,0,0,0,1|0,0,2]=4 1651 B15R2.562 Clc1ccccc1OCc2nnn[nH]2 34a_100000210172_100000765167 [1,0,0,0,0,1|2,0,0]=4 1652 B15R2.562 Clc1ccccc1OCc2nnn[nH]2 7a_100000210172_100000765167 [1,0,0,0,0,1|2,0,0]=4 1653 B15R2.562 Clc1ccccc1SCC2=NCCN2 62a_100000737910_100000764095 [1,0,0,0,0,1|0,0,0]=2 1654 B15R2.562 Clc1ccccc1SCC2=NCCN2 62a_100000764095_100000737910 [1,0,0,0,0,1|0,0,0]=2 1655 B15R2.562 Clc1ccccc1SCc2ncc[nH]2 62a_100000764095_100016991755 [1,0,0,0,0,1|0,0,2]=4 1656 B15R2.562 Clc1ccccc1SCc2ncc[nH]2 62a_100016991755_100000764095 [1,0,0,0,0,1|0,0,2]=4 1657 B15R2.562 Clc1ccccc1SCc2nnn[nH]2 62a_100000764095_100000765167 [1,0,0,0,0,1|2,0,0]=4 1658 B15R2.562 Clc1ccccc1SCc2nnn[nH]2 62a_100000765167_100000764095 [1,0,0,0,0,1|2,0,0]=4 1659 B15R2.562 Clc1cccnc1OCC2=NCCN2 34a_100011290957_100000737910 [1,0,0,0,0,1|1,0,0]=3 1660 B15R2.562 Clc1cccnc1SCC2=NCCN2 62a_100000737910_100011356963 [1,0,0,0,0,1|1,0,0]=3 1661 B15R2.562 Clc1cccnc1SCC2=NCCN2 62a_100011356963_100000737910 [1,0,0,0,0,1|1,0,0]=3 1662 B15R2.562 Clc1ccncc1OCC2=NCCN2 34a_100011996695_100000737910 [1,0,0,0,0,1|1,0,0]=3 1663 B15R2.562 Clc1ccncc1SCC2=NCCN2 62a_100000737910_100009995489 [1,0,0,0,0,1|1,0,0]=3 1664 B15R2.562 Clc1ccncc1SCC2=NCCN2 62a_100009995489_100000737910 [1,0,0,0,0,1|1,0,0]=3 1665 B15R2.562 Clc1cnccc1OCC2=NCCN2 34a_100011997054_100000737910 [1,0,0,0,0,1|1,0,0]=3 1666 B15R2.562 Clc1cnccc1SCC2=NCCN2 62a_100000708259_100000737910 [1,0,0,0,0,1|1,0,0]=3 1667 B15R2.562 Clc1cnccc1SCC2=NCCN2 62a_100000737910_100000708259 [1,0,0,0,0,1|1,0,0]=3 1668 B15R2.562 Clc1ncccc1OCC2=NCCN2 34a_100000757616_100000737910 [1,0,0,0,0,1|1,0,0]=3 1669 B15R2.562 Clc1ncccc1OCC2=NCCN2 7a_100000757616_100000737910 [1,0,0,0,0,1|1,0,0]=3 1670 B15R2.562 Clc1ncccc1SCC2=NCCN2 62a_100000036424_100000737910 [1,0,0,0,0,1|1,0,0]=3 1671 B15R2.562 Clc1ncccc1SCC2=NCCN2 62a_100000737910_100000036424 [1,0,0,0,0,1|1,0,0]=3 1672 B15R2.562 Clc1nccnc1SCC2=NCCN2 62a_100000737910_100010886584 [1,0,0,0,0,1|2,0,0]=4 1673 B15R2.562 Clc1nccnc1SCC2=NCCN2 62a_100010886584_100000737910 [1,0,0,0,0,1|2,0,0]=4 1674 B15R2.562 Clc1ncncc1SCC2=NCCN2 62a_100000737910_100000758962 [1,0,0,0,0,1|2,0,0]=4 1675 B15R2.562 Clc1ncncc1SCC2=NCCN2 62a_100000758962_100000737910 [1,0,0,0,0,1|2,0,0]=4 1676 B15R2.562 Fc1ccccc1NCC2=NCCN2 34a_100000210422_100000737910 [1,0,0,0,0,1|0,1,0]=3 1677 B15R2.562 Fc1ccccc1OCC2=NCCN2 34a_100000210171_100000737910 [1,0,0,0,0,1|0,1,0]=3 1678 B15R2.562 Fc1ccccc1OCC2=NCCN2 7a_100000210171_100000737910 [1,0,0,0,0,1|0,1,0]=3 1679 B15R2.562 Fc1ccccc1SCC2=NCCN2 62a_100000737910_100011215700 [1,0,0,0,0,1|0,1,0]=3 1680 B15R2.562 Fc1ccccc1SCC2=NCCN2 62a_100011215700_100000737910 [1,0,0,0,0,1|0,1,0]=3 1681 B15R2.562 Fc1cccnc1OCC2=NCCN2 34a_100011219419_100000737910 [1,0,0,0,0,1|1,1,0]=4 1682 B15R2.562 Fc1cccnc1SCC2=NCCN2 62a_100000685392_100000737910 [1,0,0,0,0,1|1,1,0]=4 1683 B15R2.562 Fc1cccnc1SCC2=NCCN2 62a_100000737910_100000685392 [1,0,0,0,0,1|1,1,0]=4 1684 B15R2.562 Fc1ccncc1SCC2=NCCN2 62a_100000737910_100009820683 [1,0,0,0,0,1|1,1,0]=4 1685 B15R2.562 Fc1ccncc1SCC2=NCCN2 62a_100009820683_100000737910 [1,0,0,0,0,1|1,1,0]=4 1686 B15R2.562 Fc1cnccc1OCC2=NCCN2 34a_200000081243_100000737910 [1,0,0,0,0,1|1,1,0]=4 1687 B15R2.562 Fc1cnccc1SCC2=NCCN2 62a_100000047030_100000737910 [1,0,0,0,0,1|1,1,0]=4 1688 B15R2.562 Fc1cnccc1SCC2=NCCN2 62a_100000737910_100000047030 [1,0,0,0,0,1|1,1,0]=4 1689 B15R2.562 Fc1ncccc1OCC2=NCCN2 34a_100000061740_100000737910 [1,0,0,0,0,1|1,1,0]=4 1690 B15R2.562 Fc1ncccc1OCC2=NCCN2 7a_100000061740_100000737910 [1,0,0,0,0,1|1,1,0]=4 1691 B15R2.562 Fc1ncccc1SCC2=NCCN2 62a_100000737910_100009816115 [1,0,0,0,0,1|1,1,0]=4 1692 B15R2.562 Fc1ncccc1SCC2=NCCN2 62a_100009816115_100000737910 [1,0,0,0,0,1|1,1,0]=4 1693 B15R2.562 Ic1ccccc1NCC2=NCCN2 34a_100000210053_100000737910 [1,0,0,0,0,1|0,1,0]=3 1694 B15R2.562 Ic1ccccc1OCC2=NCCN2 34a_100000739446_100000737910 [1,0,0,0,0,1|0,1,0]=3 1695 B15R2.562 Ic1ccccc1OCC2=NCCN2 7a_100000739446_100000737910 [1,0,0,0,0,1|0,1,0]=3 1696 B15R2.562 Ic1ccncc1OCC2=NCCN2 34a_100000050107_100000737910 [1,0,0,0,0,1|1,1,0]=4 1697 B15R2.562 Ic1ncccc1OCC2=NCCN2 34a_100000034122_100000737910 [1,0,0,0,0,1|1,1,0]=4 1698 B15R2.562 Ic1ncccc1OCC2=NCCN2 7a_100000034122_100000737910 [1,0,0,0,0,1|1,1,0]=4 1699 B15R2.562 Nc1ccccc1OCC2=NCCN2 34a_100000185747_100000737910 [1,0,0,0,0,1|1,0,0]=3 1700 B15R2.562 Nc1ccccc1OCC2=NCCN2 7a_100000185747_100000737910 [1,0,0,0,0,1|1,0,0]=3 1701 B15R2.562 Nc1ccccc1SCC2=NCCN2 62a_100000210017_100000737910 [1,0,0,0,0,1|1,0,0]=3 1702 B15R2.562 Nc1ccccc1SCC2=NCCN2 62a_100000737910_100000210017 [1,0,0,0,0,1|1,0,0]=3 1703 B15R2.562 Nc1cccnc1OCC2=NCCN2 34a_100000746358_100000737910 [1,0,0,0,0,1|2,0,0]=4 1704 B15R2.562 Nc1cccnc1SCC2=NCCN2 62a_100000688686_100000737910 [1,0,0,0,0,1|2,0,0]=4 1705 B15R2.562 Nc1cccnc1SCC2=NCCN2 62a_100000737910_100000688686 [1,0,0,0,0,1|2,0,0]=4 1706 B15R2.562 Nc1ccncc1OCC2=NCCN2 34a_100000753702_100000737910 [1,0,0,0,0,1|2,0,0]=4 1707 B15R2.562 Nc1ccncc1SCC2=NCCN2 62a_100000047001_100000737910 [1,0,0,0,0,1|2,0,0]=4 1708 B15R2.562 Nc1ccncc1SCC2=NCCN2 62a_100000737910_100000047001 [1,0,0,0,0,1|2,0,0]=4 1709 B15R2.562 Nc1cnccc1SCC2=NCCN2 62a_100000737910_100000756074 [1,0,0,0,0,1|2,0,0]=4 1710 B15R2.562 Nc1cnccc1SCC2=NCCN2 62a_100000756074_100000737910 [1,0,0,0,0,1|2,0,0]=4 1711 B15R2.562 Nc1ncccc1OCC2=NCCN2 34a_100000211975_100000737910 [1,0,0,0,0,1|2,0,0]=4 1712 B15R2.562 Nc1ncccc1OCC2=NCCN2 7a_100000211975_100000737910 [1,0,0,0,0,1|2,0,0]=4 1713 B15R2.562 Nc1ncccc1SCC2=NCCN2 62a_100000045569_100000737910 [1,0,0,0,0,1|2,0,0]=4 1714 B15R2.562 Nc1ncccc1SCC2=NCCN2 62a_100000737910_100000045569 [1,0,0,0,0,1|2,0,0]=4 1715 B15R2.562 O=c1cc[nH]cc1SCC2=NCCN2 62a_100000737910_100009998708 [1,0,0,0,0,1|2,0,0]=4 1716 B15R2.562 O=c1cc[nH]cc1SCC2=NCCN2 62a_100009998708_100000737910 [1,0,0,0,0,1|2,0,0]=4 1717 B15R2.562 O=c1ccocc1OCC2=NCCN2 34a_100000060831_100000737910 [1,0,0,0,0,1|2,0,0]=4 1718 B15R2.562 O=c1occcc1OCC2=NCCN2 34a_100000077404_100000737910 [1,0,0,0,0,1|2,0,0]=4 1719 B15R2.562 O=c1occcc1OCC2=NCCN2 7a_100000077404_100000737910 [1,0,0,0,0,1|2,0,0]=4 1720 B15R2.562 Oc1ccccc1NCC2=NCCN2 34a_100000185747_100000737910 [1,0,0,0,0,1|1,0,0]=3 1721 B15R2.562 Oc1ccccc1SCC2=NCCN2 62a_100000737910_100000739446 [1,0,0,0,0,1|1,0,0]=3 1722 B15R2.562 Oc1ccccc1SCC2=NCCN2 62a_100000739446_100000737910 [1,0,0,0,0,1|1,0,0]=3 1723 B15R2.562 Oc1cccnc1SCC2=NCCN2 62a_100000034122_100000737910 [1,0,0,0,0,1|2,0,0]=4 1724 B15R2.562 Oc1cccnc1SCC2=NCCN2 62a_100000737910_100000034122 [1,0,0,0,0,1|2,0,0]=4 1725 B15R2.562 Oc1cnccc1SCC2=NCCN2 62a_100000737910_100009817591 [1,0,0,0,0,1|2,0,0]=4 1726 B15R2.562 Oc1cnccc1SCC2=NCCN2 62a_100009817591_100000737910 [1,0,0,0,0,1|2,0,0]=4 1727 B15R2.562 Oc1ncccc1SCC2=NCCN2 62a_100000737910_100000760158 [1,0,0,0,0,1|2,0,0]=4 1728 B15R2.562 Oc1ncccc1SCC2=NCCN2 62a_100000760158_100000737910 [1,0,0,0,0,1|2,0,0]=4 1729 B15R2.562 S=c1cc[nH]cc1SCC2=NCCN2 62a_100000737910_200012280681 [1,0,0,0,0,1|2,0,0]=4 1730 B15R2.562 S=c1cc[nH]cc1SCC2=NCCN2 62a_200012280681_100000737910 [1,0,0,0,0,1|2,0,0]=4 1731 B15R2.562 [O-][n+]1ccccc1OCC2=NCCN2 7a_100000211761_100000737910 [1,0,0,0,0,1|2,0,0]=4 1732 B15R2.562 [O-][n+]1ccccc1SCC2=NCCN2 62a_100000737910_200000042595 [1,0,0,0,0,1|2,0,0]=4 1733 B17R2.41802 Brc1cccc(c1COCC2=NCCN2)Br 34a_100010172814_100000737910 [0,0,0,0,0,2|0,2,0]=4 1734 B17R2.41802 Brc1cccc(c1COCC2=NCCN2)Br 7a_100010172814_100000737910 [0,0,0,0,0,2|0,2,0]=4 1735 B17R2.41802 Brc1cccc(c1CSCC2=NCCN2)I 62a_100000737910_100010146611 [0,0,0,0,0,2|0,2,0]=4 1736 B17R2.41802 Brc1cccc(c1CSCC2=NCCN2)I 62a_100010146611_100000737910 [0,0,0,0,0,2|0,2,0]=4 1737 B17R2.41802 Cc1cccc(c1CNCC2=NCCN2)C 34a_100000689800_100000737910 [0,0,0,0,0,2|2,0,0]=4 1738 B17R2.41802 Cc1cccc(c1CNCC2=NCCN2)F 34a_100000762012_100000737910 [0,0,0,0,0,2|1,1,0]=4 1739 B17R2.41802 Cc1cccc(c1COCC2=NCCN2)C 34a_100011933981_100000737910 [0,0,0,0,0,2|2,0,0]=4 1740 B17R2.41802 Cc1cccc(c1COCC2=NCCN2)C 7a_100011933981_100000737910 [0,0,0,0,0,2|2,0,0]=4 1741 B17R2.41802 Cc1cccc(c1COCC2=NCCN2)Cl 34a_100000082531_100000737910 [0,0,0,0,0,2|1,0,0]=3 1742 B17R2.41802 Cc1cccc(c1COCC2=NCCN2)Cl 7a_100000082531_100000737910 [0,0,0,0,0,2|1,0,0]=3 1743 B17R2.41802 Cc1cccc(c1COCC2=NCCN2)F 34a_100000057874_100000737910 [0,0,0,0,0,2|1,1,0]=4 1744 B17R2.41802 Cc1cccc(c1COCC2=NCCN2)F 7a_100000057874_100000737910 [0,0,0,0,0,2|1,1,0]=4 1745 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)Br 62a_100000737910_100010146847 [0,0,0,0,0,2|1,1,0]=4 1746 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)Br 62a_100010146847_100000737910 [0,0,0,0,0,2|1,1,0]=4 1747 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)C 62a_100000737910_100000758300 [0,0,0,0,0,2|2,0,0]=4 1748 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)C 62a_100000758300_100000737910 [0,0,0,0,0,2|2,0,0]=4 1749 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)F 62a_100000737910_100009814554 [0,0,0,0,0,2|1,1,0]=4 1750 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)F 62a_100009814554_100000737910 [0,0,0,0,0,2|1,1,0]=4 1751 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)I 62a_100000737910_100010150146 [0,0,0,0,0,2|1,1,0]=4 1752 B17R2.41802 Cc1cccc(c1CSCC2=NCCN2)I 62a_100010150146_100000737910 [0,0,0,0,0,2|1,1,0]=4 1753 B17R2.41802 Clc1cccc(c1CCSc2ncc[nH]2)Cl 62a_100012161200_100025796157 [0,0,0,0,0,2|0,0,2]=4 1754 B17R2.41802 Clc1cccc(c1CCSc2ncc[nH]2)Cl 62a_100025796157_100012161200 [0,0,0,0,0,2|0,0,2]=4 1755 B17R2.41802 Clc1cccc(c1CNCC2=NCCN2)Cl 34a_100000174884_100000737910 [0,0,0,0,0,2|0,0,0]=2 1756 B17R2.41802 Clc1cccc(c1CNCc2ncc[nH]2)Cl 207a_100000174884_100000743867 [0,0,0,0,0,2|0,0,2]=4 1757 B17R2.41802 Clc1cccc(c1CNCc2ncc[nH]2)Cl 207a_100000754540_100000189306 [0,0,0,0,0,2|0,0,2]=4 1758 B17R2.41802 Clc1cccc(c1CNCc2ncc[nH]2)Cl 2230a_100000174884_100016991755 [0,0,0,0,0,2|0,0,2]=4 1759 B17R2.41802 Clc1cccc(c1CNCc2ncc[nH]2)Cl 270004a_100000754540_100000189306 [0,0,0,0,0,2|0,0,2]=4 1760 B17R2.41802 Clc1cccc(c1CNCc2ncc[nH]2)Cl 34a_100000174884_100016991755 [0,0,0,0,0,2|0,0,2]=4 1761 B17R2.41802 Clc1cccc(c1CNCc2nnc[nH]2)Cl 2230a_200015183720_100000187851 [0,0,0,0,0,2|1,0,1]=4 1762 B17R2.41802 Clc1cccc(c1CNCc2nnn[nH]2)Cl 34a_100000174884_100000765167 [0,0,0,0,0,2|2,0,0]=4 1763 B17R2.41802 Clc1cccc(c1COCC2=NCCN2)Cl 34a_100000215722_100000737910 [0,0,0,0,0,2|0,0,0]=2 1764 B17R2.41802 Clc1cccc(c1COCC2=NCCN2)Cl 7a_100000215722_100000737910 [0,0,0,0,0,2|0,0,0]=2 1765 B17R2.41802 Clc1cccc(c1COC[C@H]2CCCN2)Cl 34a_100000745186_100000187851 [0,0,0,0,0,2|1,0,1]=4 1766 B17R2.41802 Clc1cccc(c1COCc2ncc[nH]2)Cl 34a_100000215722_100016991755 [0,0,0,0,0,2|0,0,2]=4 1767 B17R2.41802 Clc1cccc(c1COCc2ncc[nH]2)Cl 7a_100000215722_100000753453 [0,0,0,0,0,2|0,0,2]=4 1768 B17R2.41802 Clc1cccc(c1COCc2nnn[nH]2)Cl 34a_100000215722_100000765167 [0,0,0,0,0,2|2,0,0]=4 1769 B17R2.41802 Clc1cccc(c1COCc2nnn[nH]2)Cl 7a_100000215722_100000765167 [0,0,0,0,0,2|2,0,0]=4 1770 B17R2.41802 Clc1cccc(c1CSCC2=NCCN2)Br 62a_100000737910_100010138402 [0,0,0,0,0,2|0,1,0]=3 1771 B17R2.41802 Clc1cccc(c1CSCC2=NCCN2)Br 62a_100010138402_100000737910 [0,0,0,0,0,2|0,1,0]=3 1772 B17R2.41802 Clc1cccc(c1CSCC2=NCCN2)Cl 62a_100000187851_100000737910 [0,0,0,0,0,2|0,0,0]=2 1773 B17R2.41802 Clc1cccc(c1CSCC2=NCCN2)Cl 62a_100000737910_100000187851 [0,0,0,0,0,2|0,0,0]=2 1774 B17R2.41802 Clc1cccc(c1CSCc2ncc[nH]2)Cl 62a_100000187851_100016991755 [0,0,0,0,0,2|0,0,2]=4 1775 B17R2.41802 Clc1cccc(c1CSCc2ncc[nH]2)Cl 62a_100016991755_100000187851 [0,0,0,0,0,2|0,0,2]=4 1776 B17R2.41802 Clc1cccc(c1CSCc2nnn[nH]2)Cl 62a_100000187851_100000765167 [0,0,0,0,0,2|2,0,0]=4 1777 B17R2.41802 Clc1cccc(c1CSCc2nnn[nH]2)Cl 62a_100000765167_100000187851 [0,0,0,0,0,2|2,0,0]=4 1778 B17R2.41802 Clc1cccc(c1OCCc2nnn[nH]2)Cl 7a_100000211709_100000031946 [0,0,0,0,0,2|2,0,0]=4 1779 B17R2.41802 Clc1cccc(c1SCCc2nnn[nH]2)Cl 62a_100000031946_100000034237 [0,0,0,0,0,2|2,0,0]=4 1780 B17R2.41802 Clc1cccc(c1SCCc2nnn[nH]2)Cl 62a_100000034237_100000031946 [0,0,0,0,0,2|2,0,0]=4 1781 B17R2.41802 Clc1ccnc(c1COCC2=NCCN2)Cl 34a_200009882739_100000737910 [0,0,0,0,0,2|1,0,0]=3 1782 B17R2.41802 Clc1ccnc(c1COCC2=NCCN2)Cl 7a_200009882739_100000737910 [0,0,0,0,0,2|1,0,0]=3 1783 B17R2.41802 Clc1cncc(c1CSCC2=NCCN2)Cl 62a_100000737910_200009872113 [0,0,0,0,0,2|1,0,0]=3 1784 B17R2.41802 Clc1cncc(c1CSCC2=NCCN2)Cl 62a_200009872113_100000737910 [0,0,0,0,0,2|1,0,0]=3 1785 B17R2.41802 Clc1nccc(c1COCC2=NCCN2)I 7a_100000047008_100000737910 [0,0,0,0,0,2|1,1,0]=4 1786 B17R2.41802 Fc1cccc(c1CNCC2=NCCN2)Br 34a_100012349121_100000737910 [0,0,0,0,0,2|0,2,0]=4 1787 B17R2.41802 Fc1cccc(c1CNCC2=NCCN2)Cl 34a_100000174883_100000737910 [0,0,0,0,0,2|0,1,0]=3 1788 B17R2.41802 Fc1cccc(c1CNCC2=NCCN2)F 34a_100000688400_100000737910 [0,0,0,0,0,2|0,2,0]=4 1789 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)Br 34a_100012355691_100000737910 [0,0,0,0,0,2|0,2,0]=4 1790 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)Br 7a_100012355691_100000737910 [0,0,0,0,0,2|0,2,0]=4 1791 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)Cl 34a_100000215723_100000737910 [0,0,0,0,0,2|0,1,0]=3 1792 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)Cl 7a_100000215723_100000737910 [0,0,0,0,0,2|0,1,0]=3 1793 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)F 34a_100000698215_100000737910 [0,0,0,0,0,2|0,2,0]=4 1794 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)F 7a_100000698215_100000737910 [0,0,0,0,0,2|0,2,0]=4 1795 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)I 34a_100010214973_100000737910 [0,0,0,0,0,2|0,2,0]=4 1796 B17R2.41802 Fc1cccc(c1COCC2=NCCN2)I 7a_100010214973_100000737910 [0,0,0,0,0,2|0,2,0]=4 1797 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)Br 62a_100000737910_100012145669 [0,0,0,0,0,2|0,2,0]=4 1798 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)Br 62a_100012145669_100000737910 [0,0,0,0,0,2|0,2,0]=4 1799 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)Cl 62a_100000187852_100000737910 [0,0,0,0,0,2|0,1,0]=3 1800 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)Cl 62a_100000737910_100000187852 [0,0,0,0,0,2|0,1,0]=3 1801 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)F 62a_100000709179_100000737910 [0,0,0,0,0,2|0,2,0]=4 1802 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)F 62a_100000737910_100000698325 [0,0,0,0,0,2|0,2,0]=4 1803 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)I 62a_100000737910_100010149602 [0,0,0,0,0,2|0,2,0]=4 1804 B17R2.41802 Fc1cccc(c1CSCC2=NCCN2)I 62a_100010149602_100000737910 [0,0,0,0,0,2|0,2,0]=4 1805 B17R2.41802 Nc1cccc(c1COCC2=NCCN2)Br 34a_100000747656_100000737910 [0,0,0,0,0,2|1,1,0]=4 1806 B17R2.41802 Nc1cccc(c1COCC2=NCCN2)Cl 34a_100011916388_100000737910 [0,0,0,0,0,2|1,0,0]=3 1807 B17R2.41802 Nc1cccc(c1COCC2=NCCN2)F 34a_100011846719_100000737910 [0,0,0,0,0,2|1,1,0]=4