0 B14R2.2 CC(=Cc1c[nH]c2c1cccn2)C 271570a_100102525489_100011934613 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.2 CC(=Cc1c[nH]c2c1ccnc2)C 271570a_100102525489_100010232032 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.2 CC(=Cc1c[nH]c2c1cncc2)C 271570a_100102525489_100011934843 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.2 CC(=Cc1c[nH]c2c1nccc2)C 271570a_100102525489_100009817151 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.2 CC(=Cc1coc2c1cccc2)C 271570a_100102525489_100009812202 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.2 CC(=Cc1csc2c1cccc2)C 271570a_100102525489_100009813928 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.2 CC(=Cc1n[nH]c2c1cccc2)C 271570a_100102525489_100000050141 [0,0,0,0,0,0|3,0,1]=4 7 B14R2.2 CC(=O)CC1CCc2c1cccc2 1458a_100000756587_200000210301 [0,0,0,0,0,0|2,0,2]=4 8 B14R2.2 CC(=O)CN1CCc2c1cccc2 1458a_100000742689_200000210301 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.2 CC(=O)C[n+]1csc2c1cccc2 1458a_100009813389_200000210301 [0,0,0,0,0,0|3,0,0]=3 10 B14R2.2 CC(=O)Cc1c[nH]c2c1cccc2 1458a_100000183835_200000210301 [0,0,0,0,0,0|1,0,0]=1 11 B14R2.2 CC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_200000210301 [0,0,0,0,0,0|2,0,0]=2 12 B14R2.2 CC(=O)Cc1cnc2n1cccc2 1458a_100000070654_200000210301 [0,0,0,0,0,0|2,0,1]=3 13 B14R2.2 CC(=O)Cc1coc2c1cccc2 1458a_100000217546_200000210301 [0,0,0,0,0,0|2,0,0]=2 14 B14R2.2 CC(=O)Cc1csc2c1cccc2 1458a_100000070787_200000742921 [0,0,0,0,0,0|2,0,0]=2 15 B14R2.2 CC(=O)Cc1csc2c1cccc2 1458a_100000741031_200000210301 [0,0,0,0,0,0|2,0,0]=2 16 B14R2.2 CC(=O)Cc1n[nH]c2c1cccc2 1458a_100000044345_200000210301 [0,0,0,0,0,0|2,0,0]=2 17 B14R2.2 CC(=O)Cc1nnc2n1cccc2 1458a_100000070787_100000037651 [0,0,0,0,0,0|3,0,1]=4 18 B14R2.2 CC(=O)Cc1noc2c1cccc2 1458a_100000070787_100009813815 [0,0,0,0,0,0|3,0,0]=3 19 B14R2.2 CC(=O)Cc1noc2c1cccc2 1458a_100000205995_200000210301 [0,0,0,0,0,0|3,0,0]=3 20 B14R2.2 CC(=O)Cn1ccc2c1cccc2 1458a_100000743657_200000210301 [0,0,0,0,0,0|3,0,0]=3 21 B14R2.2 CC(=O)Cn1cnc2c1cccc2 1458a_100025771165_200000210301 [0,0,0,0,0,0|2,0,1]=3 22 B14R2.2 CC(=O)Cn1ncc2c1cccc2 1458a_100011614043_200000210301 [0,0,0,0,0,0|4,0,0]=4 23 B14R2.2 CC(=O)Cn1nnc2c1cccc2 1458a_100000070787_100000033166 [0,0,0,0,0,0|3,0,1]=4 24 B14R2.2 CC(=O)Cn1nnc2c1cccc2 1458a_100025796206_200000210301 [0,0,0,0,0,0|3,0,1]=4 25 B14R2.2 CN(C)Cc1c[nH]c2c1ccnc2 270004a_100102631434_100000087688 [0,0,0,0,0,0|4,0,0]=4 26 B14R2.2 CN(C)Cc1coc2c1cccc2 270004a_100102631434_100000688544 [0,0,0,0,0,0|4,0,0]=4 27 B14R2.2 CN(C)Cc1csc2c1cccc2 2230a_100102631434_200000742921 [0,0,0,0,0,0|4,0,0]=4 28 B14R2.2 CN(C)Cc1csc2c1cccc2 269982a_100102631434_200000742921 [0,0,0,0,0,0|4,0,0]=4 29 B14R2.2 CN(C)Cc1csc2c1cccc2 270004a_100102631434_100000239721 [0,0,0,0,0,0|4,0,0]=4 30 B14R2.2 CN(C)Cc1n[nH]c2c1cccc2 270004a_100102631434_100000059708 [0,0,0,0,0,0|4,0,0]=4 31 B14R2.2 [13CH3]C(=O)CC1CCc2c1cccc2 1458a_100000756587_200025704644 [0,0,0,0,0,0|2,0,2]=4 32 B14R2.2 [13CH3]C(=O)CN1CCc2c1cccc2 1458a_100000742689_200025704644 [0,0,0,0,0,0|3,0,1]=4 33 B14R2.2 [13CH3]C(=O)C[n+]1csc2c1cccc2 1458a_100009813389_200025704644 [0,0,0,0,0,0|3,0,0]=3 34 B14R2.2 [13CH3]C(=O)Cc1c[nH]c2c1cccc2 1458a_100000183835_200025704644 [0,0,0,0,0,0|1,0,0]=1 35 B14R2.2 [13CH3]C(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_200025704644 [0,0,0,0,0,0|2,0,0]=2 36 B14R2.2 [13CH3]C(=O)Cc1cnc2n1cccc2 1458a_100000070654_200025704644 [0,0,0,0,0,0|2,0,1]=3 37 B14R2.2 [13CH3]C(=O)Cc1coc2c1cccc2 1458a_100000217546_200025704644 [0,0,0,0,0,0|2,0,0]=2 38 B14R2.2 [13CH3]C(=O)Cc1csc2c1cccc2 1458a_100000741031_200025704644 [0,0,0,0,0,0|2,0,0]=2 39 B14R2.2 [13CH3]C(=O)Cc1n[nH]c2c1cccc2 1458a_100000044345_200025704644 [0,0,0,0,0,0|2,0,0]=2 40 B14R2.2 [13CH3]C(=O)Cc1noc2c1cccc2 1458a_100000205995_200025704644 [0,0,0,0,0,0|3,0,0]=3 41 B14R2.2 [13CH3]C(=O)Cn1ccc2c1cccc2 1458a_100000743657_200025704644 [0,0,0,0,0,0|3,0,0]=3 42 B14R2.2 [13CH3]C(=O)Cn1cnc2c1cccc2 1458a_100025771165_200025704644 [0,0,0,0,0,0|2,0,1]=3 43 B14R2.2 [13CH3]C(=O)Cn1ncc2c1cccc2 1458a_100011614043_200025704644 [0,0,0,0,0,0|4,0,0]=4 44 B14R2.2 [13CH3]C(=O)Cn1nnc2c1cccc2 1458a_100025796206_200025704644 [0,0,0,0,0,0|3,0,1]=4 45 B13R2.1 CC=Cc1c[nH]c2c1cccn2 271570a_100016259895_100011934613 [1,0,0,0,0,0|2,0,1]=4 46 B13R2.1 CC=Cc1c[nH]c2c1ccnc2 271570a_100016259895_100010232032 [1,0,0,0,0,0|2,0,1]=4 47 B13R2.1 CC=Cc1c[nH]c2c1cncc2 271570a_100016259895_100011934843 [1,0,0,0,0,0|2,0,1]=4 48 B13R2.1 CC=Cc1c[nH]c2c1nccc2 271570a_100016259895_100009817151 [1,0,0,0,0,0|2,0,1]=4 49 B13R2.1 CC=Cc1coc2c1cccc2 271570a_100016259895_100009812202 [1,0,0,0,0,0|2,0,1]=4 50 B13R2.1 CC=Cc1csc2c1cccc2 271570a_100016259895_100009813928 [1,0,0,0,0,0|2,0,1]=4 51 B13R2.1 CC=Cc1n[nH]c2c1cccc2 271570a_100016259895_100000050141 [1,0,0,0,0,0|2,0,1]=4 52 B13R2.1 CNCc1c[nH]c2c1ccnc2 270004a_106832991635_100000087688 [1,0,0,0,0,0|3,0,0]=4 53 B13R2.1 CNCc1coc2c1cccc2 207a_100102657272_100000688544 [1,0,0,0,0,0|3,0,0]=4 54 B13R2.1 CNCc1coc2c1cccc2 270004a_106832991635_100000688544 [1,0,0,0,0,0|3,0,0]=4 55 B13R2.1 CNCc1csc2c1cccc2 207a_100102657272_100000239721 [1,0,0,0,0,0|3,0,0]=4 56 B13R2.1 CNCc1csc2c1cccc2 2230a_106832991635_200000742921 [1,0,0,0,0,0|3,0,0]=4 57 B13R2.1 CNCc1csc2c1cccc2 270004a_106832991635_100000239721 [1,0,0,0,0,0|3,0,0]=4 58 B13R2.1 CNCc1csc2c1cccc2 34a_100000744611_200000210301 [1,0,0,0,0,0|3,0,0]=4 59 B13R2.1 CNCc1csc2c1cccc2 34a_100102657272_200000742921 [1,0,0,0,0,0|3,0,0]=4 60 B13R2.1 CNCc1n[nH]c2c1cccc2 207a_100102657272_100000059708 [1,0,0,0,0,0|3,0,0]=4 61 B13R2.1 CNCc1n[nH]c2c1cccc2 270004a_106832991635_100000059708 [1,0,0,0,0,0|3,0,0]=4 62 B13R2.1 COCc1csc2c1cccc2 34a_100011219454_200000210301 [1,0,0,0,0,0|3,0,0]=4 63 B13R2.1 COCc1csc2c1cccc2 34a_100138415774_200000742921 [1,0,0,0,0,0|3,0,0]=4 64 B13R2.1 CSCc1csc2c1cccc2 62a_200000210301_200000742921 [1,0,0,0,0,0|3,0,0]=4 65 B13R2.1 CSCc1csc2c1cccc2 62a_200000742921_200000210301 [1,0,0,0,0,0|3,0,0]=4 66 B13R2.1 [13CH3]NCc1csc2c1cccc2 34a_100000744611_200025704644 [1,0,0,0,0,0|3,0,0]=4 67 B13R2.1 [13CH3]OCc1csc2c1cccc2 34a_100011219454_200025704644 [1,0,0,0,0,0|3,0,0]=4 68 B13R2.1 [13CH3]SCc1csc2c1cccc2 62a_200000742921_200025704644 [1,0,0,0,0,0|3,0,0]=4 69 B13R2.1 [13CH3]SCc1csc2c1cccc2 62a_200025704644_200000742921 [1,0,0,0,0,0|3,0,0]=4 70 B15R2.4 C#CC(=O)Cc1csc2c1cccc2 1458a_100000211873_200000742921 [0,1,0,0,0,0|2,0,0]=3 71 B15R2.4 C#CC(=O)Cc1noc2c1cccc2 1458a_100000211873_100009813815 [0,1,0,0,0,0|3,0,0]=4 72 B15R2.4 C=CC(=O)Cc1csc2c1cccc2 1458a_100000185746_200000742921 [0,1,0,0,0,0|2,0,0]=3 73 B15R2.4 C=CC(=O)Cc1noc2c1cccc2 1458a_100000185746_100009813815 [0,1,0,0,0,0|3,0,0]=4 74 B15R2.4 CCC(=O)C[n+]1csc2c1cccc2 1458a_100009813389_100000210202 [0,1,0,0,0,0|3,0,0]=4 75 B15R2.4 CCC(=O)Cc1c[nH]c2c1cccc2 1458a_100000183835_100000210202 [0,1,0,0,0,0|1,0,0]=2 76 B15R2.4 CCC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000210202 [0,1,0,0,0,0|2,0,0]=3 77 B15R2.4 CCC(=O)Cc1cnc2n1cccc2 1458a_100000070654_100000210202 [0,1,0,0,0,0|2,0,1]=4 78 B15R2.4 CCC(=O)Cc1coc2c1cccc2 1458a_100000217546_100000210202 [0,1,0,0,0,0|2,0,0]=3 79 B15R2.4 CCC(=O)Cc1csc2c1cccc2 1458a_100000210414_200000742921 [0,1,0,0,0,0|2,0,0]=3 80 B15R2.4 CCC(=O)Cc1csc2c1cccc2 1458a_100000741031_100000210202 [0,1,0,0,0,0|2,0,0]=3 81 B15R2.4 CCC(=O)Cc1n[nH]c2c1cccc2 1458a_100000044345_100000210202 [0,1,0,0,0,0|2,0,0]=3 82 B15R2.4 CCC(=O)Cc1noc2c1cccc2 1458a_100000205995_100000210202 [0,1,0,0,0,0|3,0,0]=4 83 B15R2.4 CCC(=O)Cc1noc2c1cccc2 1458a_100000210414_100009813815 [0,1,0,0,0,0|3,0,0]=4 84 B15R2.4 CCC(=O)Cn1ccc2c1cccc2 1458a_100000743657_100000210202 [0,1,0,0,0,0|3,0,0]=4 85 B15R2.4 CCC(=O)Cn1cnc2c1cccc2 1458a_100025771165_100000210202 [0,1,0,0,0,0|2,0,1]=4 86 B15R2.4 CNC(=O)CC1CCc2c1cccc2 11a_106832991635_100000756587 [0,1,0,0,0,0|1,0,2]=4 87 B15R2.4 CNC(=O)CC1CCc2c1cccc2 1626a_100102657272_100000756587 [0,1,0,0,0,0|1,0,2]=4 88 B15R2.4 CNC(=O)CC1CCc2c1cccc2 240690a_100102657272_100000756587 [0,1,0,0,0,0|1,0,2]=4 89 B15R2.4 CNC(=O)CC1CCc2c1cccc2 527a_100102657272_100000756587 [0,1,0,0,0,0|1,0,2]=4 90 B15R2.4 CNC(=O)CN1CCc2c1cccc2 527a_100102657272_100000742689 [0,1,0,0,0,0|2,0,1]=4 91 B15R2.4 CNC(=O)C[n+]1csc2c1cccc2 11a_106832991635_100009813389 [0,1,0,0,0,0|2,0,0]=3 92 B15R2.4 CNC(=O)C[n+]1csc2c1cccc2 240690a_100102657272_100009813389 [0,1,0,0,0,0|2,0,0]=3 93 B15R2.4 CNC(=O)C[n+]1csc2c1cccc2 527a_100102657272_100009813389 [0,1,0,0,0,0|2,0,0]=3 94 B15R2.4 CNC(=O)Cc1c[nH]c2c1cccc2 11a_106832991635_100000183835 [0,1,0,0,0,0|0,0,0]=1 95 B15R2.4 CNC(=O)Cc1c[nH]c2c1cccc2 240690a_100102657272_100000183835 [0,1,0,0,0,0|0,0,0]=1 96 B15R2.4 CNC(=O)Cc1c[nH]c2c1cccc2 527a_100102657272_100000183835 [0,1,0,0,0,0|0,0,0]=1 97 B15R2.4 CNC(=O)Cc1c[nH]c2c1cccn2 11a_106832991635_100000687015 [0,1,0,0,0,0|1,0,0]=2 98 B15R2.4 CNC(=O)Cc1c[nH]c2c1cccn2 240690a_100102657272_100000687015 [0,1,0,0,0,0|1,0,0]=2 99 B15R2.4 CNC(=O)Cc1c[nH]c2c1cccn2 527a_100102657272_100000687015 [0,1,0,0,0,0|1,0,0]=2 100 B15R2.4 CNC(=O)Cc1cnc2n1cccc2 11a_106832991635_100000070654 [0,1,0,0,0,0|1,0,1]=3 101 B15R2.4 CNC(=O)Cc1cnc2n1cccc2 240690a_100102657272_100000070654 [0,1,0,0,0,0|1,0,1]=3 102 B15R2.4 CNC(=O)Cc1coc2c1cccc2 11a_106832991635_100000217546 [0,1,0,0,0,0|1,0,0]=2 103 B15R2.4 CNC(=O)Cc1coc2c1cccc2 1626a_100102657272_100000217546 [0,1,0,0,0,0|1,0,0]=2 104 B15R2.4 CNC(=O)Cc1coc2c1cccc2 240690a_100102657272_100000217546 [0,1,0,0,0,0|1,0,0]=2 105 B15R2.4 CNC(=O)Cc1coc2c1cccc2 527a_100102657272_100000217546 [0,1,0,0,0,0|1,0,0]=2 106 B15R2.4 CNC(=O)Cc1csc2c1cccc2 11a_106832991635_100000741031 [0,1,0,0,0,0|1,0,0]=2 107 B15R2.4 CNC(=O)Cc1csc2c1cccc2 1626a_100102657272_100000741031 [0,1,0,0,0,0|1,0,0]=2 108 B15R2.4 CNC(=O)Cc1csc2c1cccc2 240690a_100102657272_100000741031 [0,1,0,0,0,0|1,0,0]=2 109 B15R2.4 CNC(=O)Cc1csc2c1cccc2 527a_100102657272_100000741031 [0,1,0,0,0,0|1,0,0]=2 110 B15R2.4 CNC(=O)Cc1n[nH]c2c1cccc2 240690a_100102657272_100000044345 [0,1,0,0,0,0|1,0,0]=2 111 B15R2.4 CNC(=O)Cc1n[nH]c2c1cccc2 527a_100102657272_100000044345 [0,1,0,0,0,0|1,0,0]=2 112 B15R2.4 CNC(=O)Cc1noc2c1cccc2 11a_106832991635_100000205995 [0,1,0,0,0,0|2,0,0]=3 113 B15R2.4 CNC(=O)Cc1noc2c1cccc2 1626a_100102657272_100000205995 [0,1,0,0,0,0|2,0,0]=3 114 B15R2.4 CNC(=O)Cc1noc2c1cccc2 240690a_100102657272_100000205995 [0,1,0,0,0,0|2,0,0]=3 115 B15R2.4 CNC(=O)Cn1ccc2c1cccc2 11a_106832991635_100000743657 [0,1,0,0,0,0|2,0,0]=3 116 B15R2.4 CNC(=O)Cn1ccc2c1cccc2 1626a_100102657272_100000743657 [0,1,0,0,0,0|2,0,0]=3 117 B15R2.4 CNC(=O)Cn1ccc2c1cccc2 240690a_100102657272_100000743657 [0,1,0,0,0,0|2,0,0]=3 118 B15R2.4 CNC(=O)Cn1ccc2c1cccc2 527a_100102657272_100000743657 [0,1,0,0,0,0|2,0,0]=3 119 B15R2.4 CNC(=O)Cn1cnc2c1cccc2 240690a_100102657272_100025771165 [0,1,0,0,0,0|1,0,1]=3 120 B15R2.4 CNC(=O)Cn1ncc2c1cccc2 11a_106832991635_100011614043 [0,1,0,0,0,0|3,0,0]=4 121 B15R2.4 CNC(=O)Cn1ncc2c1cccc2 1626a_100102657272_100011614043 [0,1,0,0,0,0|3,0,0]=4 122 B15R2.4 CNC(=O)Cn1ncc2c1cccc2 240690a_100102657272_100011614043 [0,1,0,0,0,0|3,0,0]=4 123 B15R2.4 CNC(=O)Cn1ncc2c1cccc2 527a_100102657272_100011614043 [0,1,0,0,0,0|3,0,0]=4 124 B15R2.4 CNC(=O)Cn1nnc2c1cccc2 11a_106832991635_100025796206 [0,1,0,0,0,0|2,0,1]=4 125 B15R2.4 CNC(=O)Cn1nnc2c1cccc2 1626a_100102657272_100025796206 [0,1,0,0,0,0|2,0,1]=4 126 B15R2.4 CNC(=O)Cn1nnc2c1cccc2 240690a_100102657272_100025796206 [0,1,0,0,0,0|2,0,1]=4 127 B15R2.4 CNC(=O)Cn1nnc2c1cccc2 527a_100102657272_100025796206 [0,1,0,0,0,0|2,0,1]=4 128 B15R2.4 CNC(C)Cc1c[nH]c2c1cccc2 270004a_106832991635_100000030300 [0,1,0,0,0,0|1,0,1]=3 129 B15R2.4 O=C(CF)C[n+]1csc2c1cccc2 1458a_100009813389_100015361967 [0,1,0,0,0,0|3,0,0]=4 130 B15R2.4 O=C(CF)Cc1c[nH]c2c1cccc2 1458a_100000183835_100015361967 [0,1,0,0,0,0|1,0,0]=2 131 B15R2.4 O=C(CF)Cc1c[nH]c2c1cccn2 1458a_100000687015_100015361967 [0,1,0,0,0,0|2,0,0]=3 132 B15R2.4 O=C(CF)Cc1cnc2n1cccc2 1458a_100000070654_100015361967 [0,1,0,0,0,0|2,0,1]=4 133 B15R2.4 O=C(CF)Cc1coc2c1cccc2 1458a_100000217546_100015361967 [0,1,0,0,0,0|2,0,0]=3 134 B15R2.4 O=C(CF)Cc1csc2c1cccc2 1458a_100000741031_100015361967 [0,1,0,0,0,0|2,0,0]=3 135 B15R2.4 O=C(CF)Cc1n[nH]c2c1cccc2 1458a_100000044345_100015361967 [0,1,0,0,0,0|2,0,0]=3 136 B15R2.4 O=C(CF)Cc1noc2c1cccc2 1458a_100000205995_100015361967 [0,1,0,0,0,0|3,0,0]=4 137 B15R2.4 O=C(CF)Cn1ccc2c1cccc2 1458a_100000743657_100015361967 [0,1,0,0,0,0|3,0,0]=4 138 B15R2.4 O=C(CF)Cn1cnc2c1cccc2 1458a_100025771165_100015361967 [0,1,0,0,0,0|2,0,1]=4 139 B15R2.4 O=C(CO)Cc1csc2c1cccc2 1458a_100000210174_200000742921 [0,1,0,0,0,0|2,0,0]=3 140 B15R2.4 O=C(CO)Cc1noc2c1cccc2 1458a_100000210174_100009813815 [0,1,0,0,0,0|3,0,0]=4 141 B15R2.377 CC(=O)Cc1c[nH]c2c1ccc(c2)Br 1458a_100000689255_200000210301 [0,1,0,0,0,0|1,0,0]=2 142 B15R2.377 CC(=O)Cc1c[nH]c2c1ccc(c2)Cl 1458a_100000747776_200000210301 [0,1,0,0,0,0|1,0,0]=2 143 B15R2.377 CC(=O)Cc1c[nH]c2c1ccc(c2)F 1458a_100102524959_200000210301 [0,1,0,0,0,0|1,0,0]=2 144 B15R2.377 CC(=O)Cc1coc2c1ccc(c2)O 1458a_100000010777_200000210301 [0,1,0,0,0,0|2,0,0]=3 145 B15R2.377 CC(=O)Cc1noc2c1ccc(c2)Br 1458a_100010987740_200000210301 [0,1,0,0,0,0|3,0,0]=4 146 B15R2.377 CC(=O)Oc1c[nH]c2c1ccc(c2)O 271570a_203496583355_200009817283 [0,1,0,0,0,0|2,0,0]=3 147 B15R2.377 [13CH3]C(=O)Cc1c[nH]c2c1ccc(c2)Br 1458a_100000689255_200025704644 [0,1,0,0,0,0|1,0,0]=2 148 B15R2.377 [13CH3]C(=O)Cc1c[nH]c2c1ccc(c2)Cl 1458a_100000747776_200025704644 [0,1,0,0,0,0|1,0,0]=2 149 B15R2.377 [13CH3]C(=O)Cc1c[nH]c2c1ccc(c2)F 1458a_100102524959_200025704644 [0,1,0,0,0,0|1,0,0]=2 150 B15R2.377 [13CH3]C(=O)Cc1coc2c1ccc(c2)O 1458a_100000010777_200025704644 [0,1,0,0,0,0|2,0,0]=3 151 B15R2.377 [13CH3]C(=O)Cc1noc2c1ccc(c2)Br 1458a_100010987740_200025704644 [0,1,0,0,0,0|3,0,0]=4 152 B15R2.993 CC(=O)Cc1c([nH]c2c1cccc2)C 1458a_100000737320_200000210301 [0,1,0,0,0,0|1,0,0]=2 153 B15R2.993 CC(=O)Cn1c(=O)oc2c1cccc2 1458a_100000184755_200000210301 [0,1,0,0,0,0|3,0,0]=4 154 B15R2.993 CC(=O)Cn1c(=O)sc2c1cccc2 1458a_100000019295_200000210301 [0,1,0,0,0,0|3,0,0]=4 155 B15R2.993 CC(=O)Cn1c(=S)sc2c1cccc2 1458a_100000070787_200000011012 [0,1,0,0,0,0|3,0,0]=4 156 B15R2.993 CC(=O)Cn1c(cc2c1cccc2)C 1458a_100000209841_200000210301 [0,1,0,0,0,0|3,0,0]=4 157 B15R2.993 CC(=O)Cn1c(nc2c1cccc2)C 1458a_100000766443_200000210301 [0,1,0,0,0,0|2,0,1]=4 158 B15R2.993 CC(=O)NC1C(=O)Nc2c1cccc2 240690a_200000746459_100015343762 [0,1,0,0,0,0|2,0,1]=4 159 B15R2.993 Cc1[nH]c2ccccc2c1CC(=O)[13CH3] 1458a_100000737320_200025704644 [0,1,0,0,0,0|1,0,0]=2 160 B15R2.993 Cc1cc2ccccc2n1CC(=O)[13CH3] 1458a_100000209841_200025704644 [0,1,0,0,0,0|3,0,0]=4 161 B15R2.993 Cc1nc2ccccc2n1CC(=O)[13CH3] 1458a_100000766443_200025704644 [0,1,0,0,0,0|2,0,1]=4 162 B15R2.993 [13CH3]C(=O)Cn1c(=O)oc2c1cccc2 1458a_100000184755_200025704644 [0,1,0,0,0,0|3,0,0]=4 163 B15R2.993 [13CH3]C(=O)Cn1c(=O)sc2c1cccc2 1458a_100000019295_200025704644 [0,1,0,0,0,0|3,0,0]=4 164 B15R2.9410 CC(=O)Cc1c[nH]c2c1cc(cc2)Br 1458a_100000742623_200000210301 [0,1,0,0,0,0|1,0,0]=2 165 B15R2.9410 CC(=O)Cc1c[nH]c2c1cc(cc2)C 1458a_100102525273_200000210301 [0,1,0,0,0,0|1,0,0]=2 166 B15R2.9410 CC(=O)Cc1c[nH]c2c1cc(cc2)Cl 1458a_100000758855_200000210301 [0,1,0,0,0,0|1,0,0]=2 167 B15R2.9410 CC(=O)Cc1c[nH]c2c1cc(cc2)F 1458a_100102525430_200000210301 [0,1,0,0,0,0|1,0,0]=2 168 B15R2.9410 CC(=O)Cc1c[nH]c2c1cc(cc2)O 1458a_100000031536_200000210301 [0,1,0,0,0,0|1,0,0]=2 169 B15R2.9410 CC(=O)Cc1coc2c1cc(cc2)C 1458a_100000188615_200000210301 [0,1,0,0,0,0|2,0,0]=3 170 B15R2.9410 CC(=O)Cc1csc2c1cc(cc2)C 1458a_100000242747_200000210301 [0,1,0,0,0,0|2,0,0]=3 171 B15R2.9410 CC(=O)Cc1csc2c1cc(cc2)Cl 1458a_100000070787_100009814428 [0,1,0,0,0,0|2,0,0]=3 172 B15R2.9410 CC(=O)Cc1csc2c1cc(cc2)Cl 1458a_100000692288_200000210301 [0,1,0,0,0,0|2,0,0]=3 173 B15R2.9410 CC(=O)Cc1csc2c1cc(cc2)F 1458a_100000070787_100010109839 [0,1,0,0,0,0|2,0,0]=3 174 B15R2.9410 CC(=O)Cc1n[nH]c2c1cc(cc2)Cl 1458a_100010209749_200000210301 [0,1,0,0,0,0|2,0,0]=3 175 B15R2.9410 CC(=O)Cc1n[nH]c2c1cc(cc2)F 1458a_200102525442_200000210301 [0,1,0,0,0,0|2,0,0]=3 176 B15R2.9410 CC(=O)Cn1ccc2c1cc(cc2)Br 1458a_200000721800_200000210301 [0,1,0,0,0,0|3,0,0]=4 177 B15R2.9410 CC(=O)Cn1ccc2c1cc(cc2)Cl 1458a_100000744275_200000210301 [0,1,0,0,0,0|3,0,0]=4 178 B15R2.9410 CC(=O)Cn1ccc2c1cc(cc2)F 1458a_100000721773_200000210301 [0,1,0,0,0,0|3,0,0]=4 179 B15R2.9410 CC(=O)Oc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100000755435 [0,1,0,0,0,0|2,0,0]=3 180 B15R2.9410 CN(C)Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100000728258 [0,1,0,0,0,0|3,0,0]=4 181 B15R2.9410 Cc1ccc2[nH]cc(c2c1)CC(=O)[13CH3] 1458a_100102525273_200025704644 [0,1,0,0,0,0|1,0,0]=2 182 B15R2.9410 Cc1ccc2occ(c2c1)CC(=O)[13CH3] 1458a_100000188615_200025704644 [0,1,0,0,0,0|2,0,0]=3 183 B15R2.9410 Cc1ccc2scc(c2c1)CC(=O)[13CH3] 1458a_100000242747_200025704644 [0,1,0,0,0,0|2,0,0]=3 184 B15R2.9410 NC(=O)Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009990690 [0,1,0,0,0,0|0,0,0]=1 185 B15R2.9410 [13CH3]C(=O)Cc1c[nH]c2c1cc(cc2)Br 1458a_100000742623_200025704644 [0,1,0,0,0,0|1,0,0]=2 186 B15R2.9410 [13CH3]C(=O)Cc1c[nH]c2c1cc(cc2)Cl 1458a_100000758855_200025704644 [0,1,0,0,0,0|1,0,0]=2 187 B15R2.9410 [13CH3]C(=O)Cc1c[nH]c2c1cc(cc2)F 1458a_100102525430_200025704644 [0,1,0,0,0,0|1,0,0]=2 188 B15R2.9410 [13CH3]C(=O)Cc1c[nH]c2c1cc(cc2)O 1458a_100000031536_200025704644 [0,1,0,0,0,0|1,0,0]=2 189 B15R2.9410 [13CH3]C(=O)Cc1csc2c1cc(cc2)Cl 1458a_100000692288_200025704644 [0,1,0,0,0,0|2,0,0]=3 190 B15R2.9410 [13CH3]C(=O)Cc1n[nH]c2c1cc(cc2)Cl 1458a_100010209749_200025704644 [0,1,0,0,0,0|2,0,0]=3 191 B15R2.9410 [13CH3]C(=O)Cc1n[nH]c2c1cc(cc2)F 1458a_200102525442_200025704644 [0,1,0,0,0,0|2,0,0]=3 192 B15R2.9410 [13CH3]C(=O)Cn1ccc2c1cc(cc2)Br 1458a_200000721800_200025704644 [0,1,0,0,0,0|3,0,0]=4 193 B15R2.9410 [13CH3]C(=O)Cn1ccc2c1cc(cc2)Cl 1458a_100000744275_200025704644 [0,1,0,0,0,0|3,0,0]=4 194 B15R2.9410 [13CH3]C(=O)Cn1ccc2c1cc(cc2)F 1458a_100000721773_200025704644 [0,1,0,0,0,0|3,0,0]=4 195 B15R2.13587 CC(=O)Cc1c[nH]c2c1cccc2Br 1458a_100010219219_200000210301 [0,1,0,0,0,0|1,0,0]=2 196 B15R2.13587 CC(=O)Cc1c[nH]c2c1cccc2C 1458a_200000049093_200000210301 [0,1,0,0,0,0|1,0,0]=2 197 B15R2.13587 CC(=O)Cc1c[nH]c2c1cccc2Cl 1458a_100012356222_200000210301 [0,1,0,0,0,0|1,0,0]=2 198 B15R2.13587 CC(=O)Cc1cnc2n1cccc2C 1458a_100102706221_200000210301 [0,1,0,0,0,0|2,0,1]=4 199 B15R2.13587 CC(=O)Cn1ccc2c1cccc2Cl 1458a_200000721796_200000210301 [0,1,0,0,0,0|3,0,0]=4 200 B15R2.13587 CC(=O)Cn1ccc2c1cccc2F 1458a_100012177210_200000210301 [0,1,0,0,0,0|3,0,0]=4 201 B15R2.13587 CN(C)Cc1c[nH]c2c1cccc2Br 270004a_100102631434_100009814786 [0,1,0,0,0,0|3,0,0]=4 202 B15R2.13587 CN(C)Cc1c[nH]c2c1cccc2Cl 270004a_100102631434_100011361501 [0,1,0,0,0,0|3,0,0]=4 203 B15R2.13587 Cc1cccc2c1[nH]cc2CC(=O)[13CH3] 1458a_200000049093_200025704644 [0,1,0,0,0,0|1,0,0]=2 204 B15R2.13587 Cc1cccc2c1[nH]cc2CN(C)C 270004a_100102631434_100000040139 [0,1,0,0,0,0|3,0,0]=4 205 B15R2.13587 Cc1cccn2c1ncc2CC(=O)[13CH3] 1458a_100102706221_200025704644 [0,1,0,0,0,0|2,0,1]=4 206 B15R2.13587 [13CH3]C(=O)Cc1c[nH]c2c1cccc2Br 1458a_100010219219_200025704644 [0,1,0,0,0,0|1,0,0]=2 207 B15R2.13587 [13CH3]C(=O)Cc1c[nH]c2c1cccc2Cl 1458a_100012356222_200025704644 [0,1,0,0,0,0|1,0,0]=2 208 B15R2.13587 [13CH3]C(=O)Cn1ccc2c1cccc2Cl 1458a_200000721796_200025704644 [0,1,0,0,0,0|3,0,0]=4 209 B15R2.13587 [13CH3]C(=O)Cn1ccc2c1cccc2F 1458a_100012177210_200025704644 [0,1,0,0,0,0|3,0,0]=4 210 B15R2.13624 CC(=O)Cc1c[nH]c2c1c(ccc2)Br 1458a_100000692793_200000210301 [0,1,0,0,0,0|1,0,0]=2 211 B15R2.13624 CC(=O)Cc1c[nH]c2c1c(ccc2)C 1458a_100102558282_200000210301 [0,1,0,0,0,0|1,0,0]=2 212 B15R2.13624 CC(=O)Cc1c[nH]c2c1c(ccc2)Cl 1458a_100012339537_200000210301 [0,1,0,0,0,0|1,0,0]=2 213 B15R2.13624 CC(=O)Cc1c[nH]c2c1c(ccc2)F 1458a_100011997205_200000210301 [0,1,0,0,0,0|1,0,0]=2 214 B15R2.13624 Cc1cccc2c1c(c[nH]2)CC(=O)[13CH3] 1458a_100102558282_200025704644 [0,1,0,0,0,0|1,0,0]=2 215 B15R2.13624 [13CH3]C(=O)Cc1c[nH]c2c1c(ccc2)Br 1458a_100000692793_200025704644 [0,1,0,0,0,0|1,0,0]=2 216 B15R2.13624 [13CH3]C(=O)Cc1c[nH]c2c1c(ccc2)Cl 1458a_100012339537_200025704644 [0,1,0,0,0,0|1,0,0]=2 217 B15R2.13624 [13CH3]C(=O)Cc1c[nH]c2c1c(ccc2)F 1458a_100011997205_200025704644 [0,1,0,0,0,0|1,0,0]=2 218 B15R2.53147 CC(=O)Cc1cn(c2c1cccc2)C 1458a_100011218532_200000210301 [0,1,0,0,0,0|1,0,0]=2 219 B15R2.53147 Cn1cc(c2c1cccc2)CC(=O)[13CH3] 1458a_100011218532_200025704644 [0,1,0,0,0,0|1,0,0]=2 220 B13R1.90 C#Cc1ccccc1NCC(=O)N 34a_100011470550_100000187820 [0,0,1,0,0,0|2,0,1]=4 221 B13R1.90 C#Cc1ccccc1OCC(=O)N 34a_200011470546_100000187820 [0,0,1,0,0,0|2,0,1]=4 222 B13R1.90 C#Cc1ccccc1OCC(=O)N 7a_200011470546_100000187820 [0,0,1,0,0,0|2,0,1]=4 223 B13R1.90 C=Cc1ccccc1CCC(=O)N 271570a_100011290941_100009814947 [0,0,1,0,0,0|1,0,1]=3 224 B13R1.90 C=Cc1ccccc1NCC(=O)N 34a_100012022501_100000187820 [0,0,1,0,0,0|2,0,0]=3 225 B13R1.90 C=Cc1ccccc1NCC(=O)[O-] 34a_100012022501_100020667443 [0,0,1,0,0,0|3,0,0]=4 226 B13R1.90 C=Cc1ccccc1OCC(=O)N 271570a_100011290941_200000148491 [0,0,1,0,0,0|2,0,0]=3 227 B13R1.90 C=Cc1ccccc1SCC(=O)N 62a_100000747473_100011218376 [0,0,1,0,0,0|2,0,0]=3 228 B13R1.90 C=Cc1ccccc1SCC(=O)N 62a_100011218376_100000747473 [0,0,1,0,0,0|2,0,0]=3 229 B13R1.90 C=Cc1ccccc1SCC(=O)[O-] 62a_100011218376_100020667443 [0,0,1,0,0,0|3,0,0]=4 230 B13R1.90 C=Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100011218376 [0,0,1,0,0,0|3,0,0]=4 231 B13R1.90 CCc1ccccc1NCC(=O)N 2230a_100000212081_100000747473 [0,0,1,0,0,0|2,0,1]=4 232 B13R1.90 CCc1ccccc1NCC(=O)N 34a_100000212081_100000187820 [0,0,1,0,0,0|2,0,1]=4 233 B13R1.90 CCc1ccccc1NCC(=O)N 7a_100000212081_100000187820 [0,0,1,0,0,0|2,0,1]=4 234 B13R1.90 CCc1ccccc1OCC(=O)N 34a_100000210936_100000187820 [0,0,1,0,0,0|2,0,1]=4 235 B13R1.90 CCc1ccccc1OCC(=O)N 7a_100000210936_100000187820 [0,0,1,0,0,0|2,0,1]=4 236 B13R1.90 CCc1ccccc1SCC(=O)N 62a_100000747473_100011215823 [0,0,1,0,0,0|2,0,1]=4 237 B13R1.90 CCc1ccccc1SCC(=O)N 62a_100011215823_100000747473 [0,0,1,0,0,0|2,0,1]=4 238 B13R1.90 CNc1ccccc1OCC(=O)N 34a_100000033821_100000187820 [0,0,1,0,0,0|1,0,1]=3 239 B13R1.90 CNc1ccccc1OCC(=O)[O-] 34a_100000033821_100020667443 [0,0,1,0,0,0|2,0,1]=4 240 B13R1.90 CNc1ccccc1SCC(=O)N 62a_100000747473_100020606079 [0,0,1,0,0,0|1,0,1]=3 241 B13R1.90 CNc1ccccc1SCC(=O)N 62a_100020606079_100000747473 [0,0,1,0,0,0|1,0,1]=3 242 B13R1.90 CNc1ccccc1SCC(=O)N 7a_100000187061_200000210301 [0,0,1,0,0,0|1,0,1]=3 243 B13R1.90 CNc1ccccc1SCC(=O)[O-] 62a_100020606079_100020667443 [0,0,1,0,0,0|2,0,1]=4 244 B13R1.90 CNc1ccccc1SCC(=O)[O-] 62a_100020667443_100020606079 [0,0,1,0,0,0|2,0,1]=4 245 B13R1.90 CNc1cccnc1SCC(=O)N 62a_100000747473_200011806188 [0,0,1,0,0,0|2,0,1]=4 246 B13R1.90 CNc1ccncc1SCC(=O)N 62a_100000747473_100010069531 [0,0,1,0,0,0|2,0,1]=4 247 B13R1.90 CNc1ccncc1SCC(=O)N 62a_100010069531_100000747473 [0,0,1,0,0,0|2,0,1]=4 248 B13R1.90 CNc1ncccc1SCC(=O)N 62a_100000700899_100000747473 [0,0,1,0,0,0|2,0,1]=4 249 B13R1.90 CNc1ncccc1SCC(=O)N 62a_100000747473_100000700899 [0,0,1,0,0,0|2,0,1]=4 250 B13R1.90 COc1ccccc1CCC(=O)N 34a_100011200845_200000210301 [0,0,1,0,0,0|1,0,2]=4 251 B13R1.90 COc1ccccc1CCC(=O)N 7a_100011200845_200000210301 [0,0,1,0,0,0|1,0,2]=4 252 B13R1.90 COc1ccccc1NCC(=O)N 34a_100000210025_100000187820 [0,0,1,0,0,0|2,0,1]=4 253 B13R1.90 COc1ccccc1OCC(=O)N 34a_100000210385_100000187820 [0,0,1,0,0,0|2,0,1]=4 254 B13R1.90 COc1ccccc1OCC(=O)N 7a_100000162348_200000210301 [0,0,1,0,0,0|2,0,1]=4 255 B13R1.90 COc1ccccc1SCC(=O)N 62a_100000210334_100000747473 [0,0,1,0,0,0|2,0,1]=4 256 B13R1.90 COc1ccccc1SCC(=O)N 62a_100000747473_100000210334 [0,0,1,0,0,0|2,0,1]=4 257 B13R1.90 CSc1ccccc1CCC(=O)N 62a_100009814947_200000210301 [0,0,1,0,0,0|1,0,2]=4 258 B13R1.90 CSc1ccccc1CCC(=O)N 62a_200000210301_100009814947 [0,0,1,0,0,0|1,0,2]=4 259 B13R1.90 CSc1ccccc1NCC(=O)N 34a_100000211160_100000187820 [0,0,1,0,0,0|2,0,1]=4 260 B13R1.90 CSc1ccccc1OCC(=O)N 34a_100011216402_100000187820 [0,0,1,0,0,0|2,0,1]=4 261 B13R1.90 CSc1ccccc1OCC(=O)N 62a_200000148491_200000210301 [0,0,1,0,0,0|2,0,1]=4 262 B13R1.90 CSc1ccccc1SCC(=O)N 62a_100000747473_100011217816 [0,0,1,0,0,0|2,0,1]=4 263 B13R1.90 CSc1ccccc1SCC(=O)N 62a_100011217816_100000747473 [0,0,1,0,0,0|2,0,1]=4 264 B13R1.90 N#Cc1ccccc1NCC(=O)N 34a_100000211148_100000187820 [0,0,1,0,0,0|3,0,0]=4 265 B13R1.90 N#Cc1ccccc1OCC(=O)N 34a_100000211048_100000187820 [0,0,1,0,0,0|3,0,0]=4 266 B13R1.90 N#Cc1ccccc1OCC(=O)N 7a_100000211048_100000187820 [0,0,1,0,0,0|3,0,0]=4 267 B13R1.90 N#Cc1ccccc1SCC(=O)N 62a_100000747473_100000188569 [0,0,1,0,0,0|3,0,0]=4 268 B13R1.90 NC(=O)CNc1ccccc1CO 34a_100000212039_100000187820 [0,0,1,0,0,0|3,0,0]=4 269 B13R1.90 NC(=O)COc1ccccc1CO 34a_100011216872_100000187820 [0,0,1,0,0,0|3,0,0]=4 270 B13R1.90 NC(=O)CSc1ccccc1C=O 62a_100000210073_100000747473 [0,0,1,0,0,0|3,0,0]=4 271 B13R1.90 NC(=O)CSc1ccccc1C=O 62a_100000747473_100000210073 [0,0,1,0,0,0|3,0,0]=4 272 B13R1.90 NC(=O)CSc1ccccc1CO 62a_100000187465_100000747473 [0,0,1,0,0,0|3,0,0]=4 273 B13R1.90 NC(=O)CSc1ccccc1CO 62a_100000747473_100000187465 [0,0,1,0,0,0|3,0,0]=4 274 B13R1.90 NCc1ccccc1OCC(=O)N 34a_100000185550_100000187820 [0,0,1,0,0,0|3,0,0]=4 275 B13R1.90 NCc1ccccc1SCC(=O)N 62a_100000689332_100000747473 [0,0,1,0,0,0|3,0,0]=4 276 B13R1.90 NCc1ccccc1SCC(=O)N 62a_100000747473_100000689332 [0,0,1,0,0,0|3,0,0]=4 277 B13R1.90 NNc1ccccc1SCC(=O)N 62a_100000241748_100000747473 [0,0,1,0,0,0|2,0,0]=3 278 B13R1.90 NNc1ccccc1SCC(=O)N 62a_100000747473_100000241748 [0,0,1,0,0,0|2,0,0]=3 279 B13R1.90 NNc1ccccc1SCC(=O)[O-] 62a_100000241748_100020667443 [0,0,1,0,0,0|3,0,0]=4 280 B13R1.90 NNc1ccccc1SCC(=O)[O-] 62a_100020667443_100000241748 [0,0,1,0,0,0|3,0,0]=4 281 B13R1.90 NNc1ccncc1SCC(=O)N 62a_100000747473_100013404636 [0,0,1,0,0,0|3,0,0]=4 282 B13R1.90 NNc1ccncc1SCC(=O)N 62a_100013404636_100000747473 [0,0,1,0,0,0|3,0,0]=4 283 B13R1.90 NNc1ncccc1SCC(=O)N 62a_100000747473_100011464834 [0,0,1,0,0,0|3,0,0]=4 284 B13R1.90 NNc1ncccc1SCC(=O)N 62a_100011464834_100000747473 [0,0,1,0,0,0|3,0,0]=4 285 B13R1.90 [13CH3]Nc1ccccc1SCC(=O)N 7a_100000187061_200025704644 [0,0,1,0,0,0|1,0,1]=3 286 B13R1.90 [13CH3]Oc1ccccc1CCC(=O)N 34a_100011200845_200025704644 [0,0,1,0,0,0|1,0,2]=4 287 B13R1.90 [13CH3]Oc1ccccc1CCC(=O)N 7a_100011200845_200025704644 [0,0,1,0,0,0|1,0,2]=4 288 B13R1.90 [13CH3]Oc1ccccc1OCC(=O)N 7a_100000162348_200025704644 [0,0,1,0,0,0|2,0,1]=4 289 B13R1.90 [13CH3]Sc1ccccc1CCC(=O)N 62a_100009814947_200025704644 [0,0,1,0,0,0|1,0,2]=4 290 B13R1.90 [13CH3]Sc1ccccc1CCC(=O)N 62a_200025704644_100009814947 [0,0,1,0,0,0|1,0,2]=4 291 B13R1.90 [13CH3]Sc1ccccc1OCC(=O)N 62a_200000148491_200025704644 [0,0,1,0,0,0|2,0,1]=4 292 B13R1.201 CC(=O)CC(=O)c1ccccc1Br 1458a_100000070787_100000199116 [0,0,1,0,0,0|3,0,0]=4 293 B13R1.201 CC(=O)CC(=O)c1ccccc1C 1458a_100000070787_100000741374 [0,0,1,0,0,0|3,0,0]=4 294 B13R1.201 CC(=O)CC(=O)c1ccccc1Cl 1458a_100000070787_100000211432 [0,0,1,0,0,0|3,0,0]=4 295 B13R1.201 CC(=O)CC(=O)c1ccccc1F 1458a_100000070787_100000204681 [0,0,1,0,0,0|3,0,0]=4 296 B13R1.201 CC(=O)CC(=O)c1ccccc1O 1458a_100000070787_100000188908 [0,0,1,0,0,0|3,0,0]=4 297 B13R1.201 CC(=O)CC(=O)c1ccccc1O 271570a_203496583355_200011243946 [0,0,1,0,0,0|3,0,0]=4 298 B13R1.201 CN(CC(=O)N)c1ccccc1Br 2230a_100020606079_100000747473 [0,0,1,0,0,0|2,0,1]=4 299 B13R1.201 CN(CC(=O)N)c1ccccc1Br 269982a_100020606079_100000187820 [0,0,1,0,0,0|2,0,1]=4 300 B13R1.201 CN(CC(=O)N)c1ccccc1Br 34a_100020606079_100000187820 [0,0,1,0,0,0|2,0,1]=4 301 B13R1.201 CN(CC(=O)N)c1ccccc1Cl 2230a_100000219374_100000747473 [0,0,1,0,0,0|2,0,1]=4 302 B13R1.201 CN(CC(=O)N)c1ccccc1Cl 269982a_100000219374_100000187820 [0,0,1,0,0,0|2,0,1]=4 303 B13R1.201 CN(CC(=O)N)c1ccccc1Cl 34a_100000219374_100000187820 [0,0,1,0,0,0|2,0,1]=4 304 B13R1.201 CN(CC(=O)N)c1ccccc1F 2230a_100000220357_100000747473 [0,0,1,0,0,0|2,0,1]=4 305 B13R1.201 CN(CC(=O)N)c1ccccc1F 269982a_100000220357_100000187820 [0,0,1,0,0,0|2,0,1]=4 306 B13R1.201 CN(CC(=O)N)c1ccccc1F 34a_100000220357_100000187820 [0,0,1,0,0,0|2,0,1]=4 307 B13R1.201 CN(CC(=O)N)c1ccccc1F 38a_100000220357_100000747473 [0,0,1,0,0,0|2,0,1]=4 308 B13R1.201 CN(CC(=O)N)c1ccccc1O 269982a_100000033821_100000187820 [0,0,1,0,0,0|2,0,1]=4 309 B13R1.201 Cc1ccccc1C(=O)CC(=O)N 1458a_100000212026_100000187820 [0,0,1,0,0,0|2,0,0]=3 310 B13R1.201 Cc1ccccc1C(=O)CC(=O)[O-] 1458a_100000212026_100020667443 [0,0,1,0,0,0|3,0,0]=4 311 B13R1.201 Cc1ccccc1N(C)CC(=O)N 2230a_100000219699_100000747473 [0,0,1,0,0,0|2,0,1]=4 312 B13R1.201 Cc1ccccc1N(C)CC(=O)N 269982a_100000219699_100000187820 [0,0,1,0,0,0|2,0,1]=4 313 B13R1.201 Cc1ccccc1N(C)CC(=O)N 34a_100000219699_100000187820 [0,0,1,0,0,0|2,0,1]=4 314 B13R1.201 NC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000187820 [0,0,1,0,0,0|2,0,0]=3 315 B13R1.201 NC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000187820 [0,0,1,0,0,0|2,0,0]=3 316 B13R1.201 NC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000187820 [0,0,1,0,0,0|2,0,0]=3 317 B13R1.201 NC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000187820 [0,0,1,0,0,0|2,0,0]=3 318 B13R1.201 NC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000187820 [0,0,1,0,0,0|2,0,0]=3 319 B13R1.201 NC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000187820 [0,0,1,0,0,0|2,0,0]=3 320 B13R1.201 O=C([O-])CC(=O)c1ccccc1Br 1458a_100000188424_100020667443 [0,0,1,0,0,0|3,0,0]=4 321 B13R1.201 O=C([O-])CC(=O)c1ccccc1Cl 1458a_100000185844_100020667443 [0,0,1,0,0,0|3,0,0]=4 322 B13R1.201 O=C([O-])CC(=O)c1ccccc1F 1458a_100000188656_100020667443 [0,0,1,0,0,0|3,0,0]=4 323 B13R1.201 O=C([O-])CC(=O)c1ccccc1I 1458a_100000187884_100020667443 [0,0,1,0,0,0|3,0,0]=4 324 B13R1.201 O=C([O-])CC(=O)c1ccccc1O 1458a_100015234032_100020667443 [0,0,1,0,0,0|3,0,0]=4 325 B13R1.201 O=C([O-])CC(=O)c1ccccc1[O-] 1458a_100009911694_100020667443 [0,0,1,0,0,0|3,0,0]=4 326 B13R1.337 CC(=O)C=C/C=C/c1ccccc1 1458a_100016289705_200000210301 [0,0,1,0,0,0|2,0,1]=4 327 B13R1.337 CC(=O)CCCNc1ccccc1 34a_100000106764_100000685027 [0,0,1,0,0,0|1,0,2]=4 328 B13R1.337 NC(=O)CCCNc1ccccc1 34a_100000106764_100102525003 [0,0,1,0,0,0|0,0,2]=3 329 B13R1.337 NC(=O)CCCOc1ccccc1 34a_100000210340_100102525003 [0,0,1,0,0,0|1,0,2]=4 330 B13R1.337 NC(=O)CCCOc1ccccc1 7a_100000210340_100102525003 [0,0,1,0,0,0|1,0,2]=4 331 B13R1.337 NC(=O)CCCSc1ccccc1 62a_100000719477_100102525003 [0,0,1,0,0,0|1,0,2]=4 332 B13R1.337 NC(=O)CCCSc1ccccc1 62a_100102525003_100000041952 [0,0,1,0,0,0|1,0,2]=4 333 B13R1.337 NC(=O)CCNCc1ccccc1 207a_100000740010_100015611070 [0,0,1,0,0,0|2,0,1]=4 334 B13R1.337 NC(=O)CCNCc1ccccc1 2230a_100015324214_100000744528 [0,0,1,0,0,0|2,0,1]=4 335 B13R1.337 NC(=O)CCNCc1ccccc1 34a_100015324214_100000731001 [0,0,1,0,0,0|2,0,1]=4 336 B13R1.337 NC(=O)CCOCc1ccccc1 34a_100000210790_100000731001 [0,0,1,0,0,0|2,0,1]=4 337 B13R1.337 NC(=O)CCOCc1ccccc1 34a_100000757172_100015291786 [0,0,1,0,0,0|2,0,1]=4 338 B13R1.337 NC(=O)CCOCc1ccccc1 7a_100000210790_100000744528 [0,0,1,0,0,0|2,0,1]=4 339 B13R1.337 NC(=O)CCOCc1ccccc1 7a_100000757172_100000211182 [0,0,1,0,0,0|2,0,1]=4 340 B13R1.337 NC(=O)CCSCc1ccccc1 62a_100000211182_100000744528 [0,0,1,0,0,0|2,0,1]=4 341 B13R1.337 NC(=O)CCSCc1ccccc1 62a_100000744528_100015291786 [0,0,1,0,0,0|2,0,1]=4 342 B13R1.337 NC(=O)CNCCc1ccccc1 2230a_100000106460_100000747473 [0,0,1,0,0,0|2,0,1]=4 343 B13R1.337 NC(=O)CNCCc1ccccc1 2230a_100000711301_100000765856 [0,0,1,0,0,0|2,0,1]=4 344 B13R1.337 NC(=O)CNCCc1ccccc1 34a_100000106460_100000187820 [0,0,1,0,0,0|2,0,1]=4 345 B13R1.337 NC(=O)CNCSc1ccccc1 2230a_100000711301_100011218342 [0,0,1,0,0,0|2,0,1]=4 346 B13R1.337 NC(=O)COCCc1ccccc1 34a_100000210268_100000187820 [0,0,1,0,0,0|2,0,1]=4 347 B13R1.337 NC(=O)COCCc1ccccc1 7a_100000210268_100000187820 [0,0,1,0,0,0|2,0,1]=4 348 B13R1.337 NC(=O)CSCCc1ccccc1 62a_100000747473_100011218657 [0,0,1,0,0,0|2,0,1]=4 349 B13R1.337 NC(=O)CSCCc1ccccc1 62a_100000765856_100000747473 [0,0,1,0,0,0|2,0,1]=4 350 B13R1.337 NC(=O)CSCSc1ccccc1 62a_100000747473_100011218342 [0,0,1,0,0,0|2,0,1]=4 351 B13R1.337 NC(=O)CSCSc1ccccc1 62a_100011218342_100000747473 [0,0,1,0,0,0|2,0,1]=4 352 B13R1.337 NC(=O)OCCNc1ccccc1 34a_100000106764_200011214921 [0,0,1,0,0,0|1,0,2]=4 353 B13R1.337 [13CH3]C(=O)C=C/C=C/c1ccccc1 1458a_100016289705_200025704644 [0,0,1,0,0,0|2,0,1]=4 354 B13R1.713 CCN(CC(=O)N)c1ccccc1 2230a_100000210013_100000747473 [0,0,1,0,0,0|2,0,1]=4 355 B13R1.713 CCN(CC(=O)N)c1ccccc1 2230a_100000212578_100000210202 [0,0,1,0,0,0|2,0,1]=4 356 B13R1.713 CCN(CC(=O)N)c1ccccc1 269982a_100000210013_100000187820 [0,0,1,0,0,0|2,0,1]=4 357 B13R1.713 CCN(CC(=O)N)c1ccccc1 269982a_100000212578_100000204670 [0,0,1,0,0,0|2,0,1]=4 358 B13R1.713 CCN(CC(=O)N)c1ccccc1 34a_100000210013_100000187820 [0,0,1,0,0,0|2,0,1]=4 359 B13R1.713 NC(=O)CN(CF)c1ccccc1 269982a_100000212578_100015361967 [0,0,1,0,0,0|2,0,1]=4 360 B13R2.72 C=C(C)c1c[nH]c2c1cccn2 271570a_100000694244_100011934613 [0,0,0,0,1,0|3,0,0]=4 361 B13R2.72 C=C(C)c1c[nH]c2c1ccnc2 271570a_100000694244_100010232032 [0,0,0,0,1,0|3,0,0]=4 362 B13R2.72 C=C(C)c1c[nH]c2c1cncc2 271570a_100000694244_100011934843 [0,0,0,0,1,0|3,0,0]=4 363 B13R2.72 C=C(C)c1c[nH]c2c1nccc2 271570a_100000694244_100009817151 [0,0,0,0,1,0|3,0,0]=4 364 B13R2.72 C=C(C)c1coc2c1cccc2 271570a_100000694244_100009812202 [0,0,0,0,1,0|3,0,0]=4 365 B13R2.72 C=C(C)c1csc2c1cccc2 271570a_100000694244_100009813928 [0,0,0,0,1,0|3,0,0]=4 366 B13R2.72 C=C(C)c1n[nH]c2c1cccc2 271570a_100000694244_100000050141 [0,0,0,0,1,0|3,0,0]=4 367 B13R2.72 CC(=O)C1=CCc2c1cccc2 1458a_100000037392_200000210301 [0,0,0,0,1,0|2,0,0]=3 368 B13R2.72 CC(=O)C1C=Cc2c1cccc2 1458a_200009832160_200000210301 [0,0,0,0,1,0|2,0,1]=4 369 B13R2.72 [13CH3]C(=O)C1=CCc2c1cccc2 1458a_100000037392_200025704644 [0,0,0,0,1,0|2,0,0]=3 370 B13R2.72 [13CH3]C(=O)C1C=Cc2c1cccc2 1458a_200009832160_200025704644 [0,0,0,0,1,0|2,0,1]=4 371 B15R2.6 C=C(C)COc1csc2c1cccc2 34a_100000077758_100000748629 [0,0,0,0,0,1|3,0,0]=4 372 B15R2.6 C=C(C)COc1csc2c1cccc2 7a_100000077758_100000748629 [0,0,0,0,0,1|3,0,0]=4 373 B15R2.6 C=C(C)CSc1c[nH]c2c1cccn2 62a_100000748629_100011934613 [0,0,0,0,0,1|3,0,0]=4 374 B15R2.6 C=C(C)CSc1c[nH]c2c1ccnc2 62a_100000748629_100010232032 [0,0,0,0,0,1|3,0,0]=4 375 B15R2.6 C=C(C)CSc1c[nH]c2c1cncc2 62a_100000748629_100000753697 [0,0,0,0,0,1|3,0,0]=4 376 B15R2.6 C=C(C)CSc1c[nH]c2c1nccc2 62a_100000748629_100009817151 [0,0,0,0,0,1|3,0,0]=4 377 B15R2.6 C=C(C)CSc1coc2c1cccc2 62a_100000748629_100009812202 [0,0,0,0,0,1|3,0,0]=4 378 B15R2.6 C=C(C)CSc1csc2c1cccc2 62a_100000748629_100009813928 [0,0,0,0,0,1|3,0,0]=4 379 B15R2.6 C=C(C)CSc1n[nH]c2c1cccc2 62a_100000748629_100000050141 [0,0,0,0,0,1|3,0,0]=4 380 B15R2.6 C=C(F)COc1csc2c1cccc2 34a_100000077758_100009893438 [0,0,0,0,0,1|3,0,0]=4 381 B15R2.6 C=C(F)COc1csc2c1cccc2 7a_100000077758_100000042424 [0,0,0,0,0,1|3,0,0]=4 382 B15R2.6 C=C(F)CSc1c[nH]c2c1cccn2 62a_100000042424_100011934613 [0,0,0,0,0,1|3,0,0]=4 383 B15R2.6 C=C(F)CSc1c[nH]c2c1ccnc2 62a_100000042424_100010232032 [0,0,0,0,0,1|3,0,0]=4 384 B15R2.6 C=C(F)CSc1c[nH]c2c1cncc2 62a_100000042424_100000753697 [0,0,0,0,0,1|3,0,0]=4 385 B15R2.6 C=C(F)CSc1c[nH]c2c1nccc2 62a_100000042424_100009817151 [0,0,0,0,0,1|3,0,0]=4 386 B15R2.6 C=C(F)CSc1coc2c1cccc2 62a_100000042424_100009812202 [0,0,0,0,0,1|3,0,0]=4 387 B15R2.6 C=C(F)CSc1csc2c1cccc2 62a_100000042424_100009813928 [0,0,0,0,0,1|3,0,0]=4 388 B15R2.6 C=C(F)CSc1n[nH]c2c1cccc2 62a_100000042424_100000050141 [0,0,0,0,0,1|3,0,0]=4 389 B15R2.6 CC(=O)C=Cc1c[nH]c2c1cccc2 1458a_100016263948_200000210301 [0,0,0,0,0,1|1,0,1]=3 390 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000070787_100011218569 [0,0,0,0,0,1|1,0,0]=2 391 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200000210301 [0,0,0,0,0,1|1,0,0]=2 392 B15R2.6 CC(=O)CCc1c[nH]c2c1cccn2 1458a_100000070787_100009895007 [0,0,0,0,0,1|2,0,0]=3 393 B15R2.6 CC(=O)CCc1c[nH]c2c1cccn2 1458a_100102525369_200000210301 [0,0,0,0,0,1|2,0,0]=3 394 B15R2.6 CC(=O)CCn1ccc2c1cccc2 1458a_100000186764_200000210301 [0,0,0,0,0,1|3,0,0]=4 395 B15R2.6 CC(=O)CCn1cnc2c1cccc2 1458a_100000177575_200000210301 [0,0,0,0,0,1|2,0,1]=4 396 B15R2.6 CC(=O)NCc1[nH]nc2c1cccc2 240690a_100011642502_100015343762 [0,0,0,0,0,1|2,0,1]=4 397 B15R2.6 CC(=O)NCc1[nH]nc2c1cccc2 527a_100011642502_100103153847 [0,0,0,0,0,1|2,0,1]=4 398 B15R2.6 CC(=O)NCc1c[nH]c2c1cccc2 240690a_100015202335_100015343762 [0,0,0,0,0,1|1,0,0]=2 399 B15R2.6 CC(=O)NCc1c[nH]c2c1cccc2 527a_100015202335_100103153847 [0,0,0,0,0,1|1,0,0]=2 400 B15R2.6 CC(=O)NCc1cnc2n1cccc2 1626a_100015187830_100015343762 [0,0,0,0,0,1|2,0,1]=4 401 B15R2.6 CC(=O)NCc1cnc2n1cccc2 240690a_100015187830_100015343762 [0,0,0,0,0,1|2,0,1]=4 402 B15R2.6 CC(=O)NCc1cnc2n1cccc2 527a_100015187830_100103153847 [0,0,0,0,0,1|2,0,1]=4 403 B15R2.6 CC(=O)NCc1csc2c1cccc2 11a_100000744611_100015343762 [0,0,0,0,0,1|2,0,0]=3 404 B15R2.6 CC(=O)NCc1csc2c1cccc2 1626a_100000744611_100015343762 [0,0,0,0,0,1|2,0,0]=3 405 B15R2.6 CC(=O)NCc1csc2c1cccc2 240690a_100000744611_100015343762 [0,0,0,0,0,1|2,0,0]=3 406 B15R2.6 CC(=O)NCc1csc2c1cccc2 527a_100000744611_100103153847 [0,0,0,0,0,1|2,0,0]=3 407 B15R2.6 CN(C)CCc1c[nH]c2c1cccc2 2230a_100102631434_100011218569 [0,0,0,0,0,1|3,0,0]=4 408 B15R2.6 CN(C)CCc1c[nH]c2c1cccc2 269982a_100102631434_100011218569 [0,0,0,0,0,1|3,0,0]=4 409 B15R2.6 NC(=O)CNC1CCc2c1cccc2 2230a_100000711301_200000721974 [0,0,0,0,0,1|1,0,2]=4 410 B15R2.6 NC(=O)CNC1COc2c1cccc2 2230a_100000747519_100000747473 [0,0,0,0,0,1|1,0,2]=4 411 B15R2.6 NC(=O)CN[C@H]1CCc2c1cccc2 2230a_100016989578_100000747473 [0,0,0,0,0,1|1,0,2]=4 412 B15R2.6 NC(=O)CN[C@H]1CCc2c1cccc2 34a_100016989578_100000187820 [0,0,0,0,0,1|1,0,2]=4 413 B15R2.6 NC(=O)COC1CCc2c1cccc2 34a_100000212247_100000187820 [0,0,0,0,0,1|1,0,2]=4 414 B15R2.6 NC(=O)COC1CCc2c1cccc2 7a_100000212247_100000187820 [0,0,0,0,0,1|1,0,2]=4 415 B15R2.6 NC(=O)COc1csc2c1cccc2 34a_100000077758_100000187820 [0,0,0,0,0,1|1,0,0]=2 416 B15R2.6 NC(=O)COc1csc2c1cccc2 7a_100000077758_100000187820 [0,0,0,0,0,1|1,0,0]=2 417 B15R2.6 NC(=O)CSC1CCc2c1cccc2 62a_100000747473_200000721974 [0,0,0,0,0,1|1,0,2]=4 418 B15R2.6 NC(=O)CSc1c[nH]c2c1cccn2 62a_100000747473_100011934613 [0,0,0,0,0,1|1,0,0]=2 419 B15R2.6 NC(=O)CSc1c[nH]c2c1ccnc2 62a_100000747473_100010232032 [0,0,0,0,0,1|1,0,0]=2 420 B15R2.6 NC(=O)CSc1c[nH]c2c1cncc2 62a_100000747473_100000753697 [0,0,0,0,0,1|1,0,0]=2 421 B15R2.6 NC(=O)CSc1c[nH]c2c1cncn2 62a_100000747473_100000072862 [0,0,0,0,0,1|2,0,0]=3 422 B15R2.6 NC(=O)CSc1c[nH]c2c1cncn2 62a_100009817560_100000747473 [0,0,0,0,0,1|2,0,0]=3 423 B15R2.6 NC(=O)CSc1c[nH]c2c1nccc2 62a_100000747473_100009817151 [0,0,0,0,0,1|1,0,0]=2 424 B15R2.6 NC(=O)CSc1c[nH]c2c1nccn2 62a_100000747473_100009819587 [0,0,0,0,0,1|2,0,0]=3 425 B15R2.6 NC(=O)CSc1cnc2n1cccc2 62a_100000747473_100011219245 [0,0,0,0,0,1|1,0,1]=3 426 B15R2.6 NC(=O)CSc1cnc2n1cccn2 62a_100000747473_100011934454 [0,0,0,0,0,1|2,0,1]=4 427 B15R2.6 NC(=O)CSc1cnc2n1cccn2 62a_100011934454_100000747473 [0,0,0,0,0,1|2,0,1]=4 428 B15R2.6 NC(=O)CSc1cnc2n1ccnc2 62a_100000747473_100011934586 [0,0,0,0,0,1|2,0,1]=4 429 B15R2.6 NC(=O)CSc1cnc2n1ccnc2 62a_100011934586_100000747473 [0,0,0,0,0,1|2,0,1]=4 430 B15R2.6 NC(=O)CSc1cnc2n1nccc2 62a_100000747473_100009819068 [0,0,0,0,0,1|2,0,1]=4 431 B15R2.6 NC(=O)CSc1cnn2c1cccc2 62a_100000747473_100009817726 [0,0,0,0,0,1|1,0,1]=3 432 B15R2.6 NC(=O)CSc1cnn2c1cncc2 62a_100000747473_100010892148 [0,0,0,0,0,1|2,0,1]=4 433 B15R2.6 NC(=O)CSc1cnn2c1cncc2 62a_100010892148_100000747473 [0,0,0,0,0,1|2,0,1]=4 434 B15R2.6 NC(=O)CSc1cnn2c1nccc2 62a_100000747473_100009819579 [0,0,0,0,0,1|2,0,1]=4 435 B15R2.6 NC(=O)CSc1coc2c1cccc2 62a_100000747473_100009812202 [0,0,0,0,0,1|1,0,0]=2 436 B15R2.6 NC(=O)CSc1coc2c1nccc2 62a_100000747473_100009889148 [0,0,0,0,0,1|2,0,0]=3 437 B15R2.6 NC(=O)CSc1csc2c1cccc2 62a_100000747473_100009813928 [0,0,0,0,0,1|1,0,0]=2 438 B15R2.6 NC(=O)CSc1csc2c1cccn2 62a_100000747473_100009830249 [0,0,0,0,0,1|2,0,0]=3 439 B15R2.6 NC(=O)CSc1csc2c1cccn2 62a_100009830249_100000747473 [0,0,0,0,0,1|2,0,0]=3 440 B15R2.6 NC(=O)CSc1csc2c1ccnc2 62a_100000747473_100009817111 [0,0,0,0,0,1|2,0,0]=3 441 B15R2.6 NC(=O)CSc1csc2c1ccnc2 62a_100009817111_100000747473 [0,0,0,0,0,1|2,0,0]=3 442 B15R2.6 NC(=O)CSc1csc2c1cncc2 62a_100000747473_100010247091 [0,0,0,0,0,1|2,0,0]=3 443 B15R2.6 NC(=O)CSc1csc2c1cncc2 62a_100010247091_100000747473 [0,0,0,0,0,1|2,0,0]=3 444 B15R2.6 NC(=O)CSc1csc2c1nccc2 62a_100000747473_100010247092 [0,0,0,0,0,1|2,0,0]=3 445 B15R2.6 NC(=O)CSc1csc2c1nccn2 62a_100000747473_100010174841 [0,0,0,0,0,1|3,0,0]=4 446 B15R2.6 NC(=O)CSc1n[nH]c2c1cccc2 62a_100000747473_100000050141 [0,0,0,0,0,1|1,0,0]=2 447 B15R2.6 NC(=O)CSc1n[nH]c2c1cccn2 62a_100000747473_100009888962 [0,0,0,0,0,1|2,0,0]=3 448 B15R2.6 NC(=O)CSc1n[nH]c2c1ccnc2 62a_100000747473_100010244369 [0,0,0,0,0,1|2,0,0]=3 449 B15R2.6 NC(=O)CSc1n[nH]c2c1cncc2 62a_100000747473_100009820117 [0,0,0,0,0,1|2,0,0]=3 450 B15R2.6 NC(=O)CSc1n[nH]c2c1cncn2 62a_100000747473_100009875510 [0,0,0,0,0,1|3,0,0]=4 451 B15R2.6 NC(=O)CSc1n[nH]c2c1cncn2 62a_100009875510_100000747473 [0,0,0,0,0,1|3,0,0]=4 452 B15R2.6 NC(=O)CSc1n[nH]c2c1nccc2 62a_100000747473_100009817118 [0,0,0,0,0,1|2,0,0]=3 453 B15R2.6 NC(=O)CSc1n[nH]c2c1nccn2 62a_100000747473_100009819591 [0,0,0,0,0,1|3,0,0]=4 454 B15R2.6 NC(=O)CSc1ncn2c1cccc2 62a_100000747473_100010892795 [0,0,0,0,0,1|3,0,0]=4 455 B15R2.6 NC(=O)CSc1nnc2n1cccc2 62a_100000699609_100000747473 [0,0,0,0,0,1|2,0,1]=4 456 B15R2.6 NC(=O)CSc1nnc2n1cccc2 62a_100000747473_100000699609 [0,0,0,0,0,1|2,0,1]=4 457 B15R2.6 NC(=O)CSc1noc2c1cccc2 62a_100000747473_200000703156 [0,0,0,0,0,1|2,0,0]=3 458 B15R2.6 NC(=O)CSc1noc2c1cccc2 62a_200000703156_100000747473 [0,0,0,0,0,1|2,0,0]=3 459 B15R2.6 O=C([O-])COc1csc2c1cccc2 34a_100000077758_100020667443 [0,0,0,0,0,1|2,0,0]=3 460 B15R2.6 O=C([O-])CSc1c[nH]c2c1cccn2 62a_100020667443_100011934613 [0,0,0,0,0,1|2,0,0]=3 461 B15R2.6 O=C([O-])CSc1c[nH]c2c1ccnc2 62a_100020667443_100010232032 [0,0,0,0,0,1|2,0,0]=3 462 B15R2.6 O=C([O-])CSc1c[nH]c2c1cncc2 62a_100020667443_100000753697 [0,0,0,0,0,1|2,0,0]=3 463 B15R2.6 O=C([O-])CSc1c[nH]c2c1cncn2 62a_100009817560_100020667443 [0,0,0,0,0,1|3,0,0]=4 464 B15R2.6 O=C([O-])CSc1c[nH]c2c1cncn2 62a_100020667443_100000072862 [0,0,0,0,0,1|3,0,0]=4 465 B15R2.6 O=C([O-])CSc1c[nH]c2c1nccc2 62a_100020667443_100009817151 [0,0,0,0,0,1|2,0,0]=3 466 B15R2.6 O=C([O-])CSc1c[nH]c2c1nccn2 62a_100020667443_100009819587 [0,0,0,0,0,1|3,0,0]=4 467 B15R2.6 O=C([O-])CSc1cnc2n1cccc2 62a_100020667443_100011219245 [0,0,0,0,0,1|2,0,1]=4 468 B15R2.6 O=C([O-])CSc1cnn2c1cccc2 62a_100020667443_100009817726 [0,0,0,0,0,1|2,0,1]=4 469 B15R2.6 O=C([O-])CSc1coc2c1cccc2 62a_100020667443_100009812202 [0,0,0,0,0,1|2,0,0]=3 470 B15R2.6 O=C([O-])CSc1coc2c1nccc2 62a_100020667443_100009889148 [0,0,0,0,0,1|3,0,0]=4 471 B15R2.6 O=C([O-])CSc1csc2c1cccc2 62a_100020667443_100009813928 [0,0,0,0,0,1|2,0,0]=3 472 B15R2.6 O=C([O-])CSc1csc2c1cccn2 62a_100009830249_100020667443 [0,0,0,0,0,1|3,0,0]=4 473 B15R2.6 O=C([O-])CSc1csc2c1cccn2 62a_100020667443_100009830249 [0,0,0,0,0,1|3,0,0]=4 474 B15R2.6 O=C([O-])CSc1csc2c1ccnc2 62a_100009817111_100020667443 [0,0,0,0,0,1|3,0,0]=4 475 B15R2.6 O=C([O-])CSc1csc2c1ccnc2 62a_100020667443_100009817111 [0,0,0,0,0,1|3,0,0]=4 476 B15R2.6 O=C([O-])CSc1csc2c1cncc2 62a_100010247091_100020667443 [0,0,0,0,0,1|3,0,0]=4 477 B15R2.6 O=C([O-])CSc1csc2c1cncc2 62a_100020667443_100010247091 [0,0,0,0,0,1|3,0,0]=4 478 B15R2.6 O=C([O-])CSc1csc2c1nccc2 62a_100020667443_100010247092 [0,0,0,0,0,1|3,0,0]=4 479 B15R2.6 O=C([O-])CSc1n[nH]c2c1cccc2 62a_100020667443_100000050141 [0,0,0,0,0,1|2,0,0]=3 480 B15R2.6 O=C([O-])CSc1n[nH]c2c1cccn2 62a_100020667443_100009888962 [0,0,0,0,0,1|3,0,0]=4 481 B15R2.6 O=C([O-])CSc1n[nH]c2c1ccnc2 62a_100020667443_100010244369 [0,0,0,0,0,1|3,0,0]=4 482 B15R2.6 O=C([O-])CSc1n[nH]c2c1cncc2 62a_100020667443_100009820117 [0,0,0,0,0,1|3,0,0]=4 483 B15R2.6 O=C([O-])CSc1n[nH]c2c1nccc2 62a_100020667443_100009817118 [0,0,0,0,0,1|3,0,0]=4 484 B15R2.6 O=C([O-])CSc1noc2c1cccc2 62a_100020667443_200000703156 [0,0,0,0,0,1|3,0,0]=4 485 B15R2.6 O=C([O-])CSc1noc2c1cccc2 62a_200000703156_100020667443 [0,0,0,0,0,1|3,0,0]=4 486 B15R2.6 O=[N+]([O-])COc1csc2c1cccc2 34a_100000077758_100000761209 [0,0,0,0,0,1|3,0,0]=4 487 B15R2.6 [13CH3]C(=O)C=Cc1c[nH]c2c1cccc2 1458a_100016263948_200025704644 [0,0,0,0,0,1|1,0,1]=3 488 B15R2.6 [13CH3]C(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200025704644 [0,0,0,0,0,1|1,0,0]=2 489 B15R2.6 [13CH3]C(=O)CCc1c[nH]c2c1cccn2 1458a_100102525369_200025704644 [0,0,0,0,0,1|2,0,0]=3 490 B15R2.6 [13CH3]C(=O)CCn1ccc2c1cccc2 1458a_100000186764_200025704644 [0,0,0,0,0,1|3,0,0]=4 491 B15R2.6 [13CH3]C(=O)CCn1cnc2c1cccc2 1458a_100000177575_200025704644 [0,0,0,0,0,1|2,0,1]=4 492 B15R2.1668 CC(=O)Cc1cc2ccccc2cn1 1458a_100000070787_100009869231 [0,0,0,0,0,1|3,0,0]=4 493 B15R2.1668 CC(=O)Cc1ccc2ccccc2c1 1458a_100000070787_100011216711 [0,0,0,0,0,1|2,0,0]=3 494 B15R2.1668 CC(=O)Cc1ccc2ccccc2c1 1458a_100000181716_200000210301 [0,0,0,0,0,1|2,0,0]=3 495 B15R2.1668 CC(=O)Cc1ccc2ccccc2n1 1458a_100000070787_100000737579 [0,0,0,0,0,1|2,0,0]=3 496 B15R2.1668 CC(=O)Cc1ccc2cnccc2c1 1458a_100000070787_100020605334 [0,0,0,0,0,1|3,0,0]=4 497 B15R2.1668 CC(=O)Cc1ccc2ncccc2c1 1458a_100000070787_100000703657 [0,0,0,0,0,1|3,0,0]=4 498 B15R2.1668 CC(=O)Cc1ccc2ncccc2c1 1458a_100011218584_200000210301 [0,0,0,0,0,1|3,0,0]=4 499 B15R2.1668 CC(=O)Cc1cnc2ccccc2n1 1458a_100000070787_200000751123 [0,0,0,0,0,1|1,0,1]=3 500 B15R2.1668 CC(=O)Cc1ncc2ccccc2n1 1458a_100000070787_100009868571 [0,0,0,0,0,1|3,0,0]=4 501 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 11a_100000211940_100015343762 [0,0,0,0,0,1|3,0,0]=4 502 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 1626a_100000211940_100015343762 [0,0,0,0,0,1|3,0,0]=4 503 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 22a_100000211940_100000070787 [0,0,0,0,0,1|3,0,0]=4 504 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 527a_100000211940_100103153847 [0,0,0,0,0,1|3,0,0]=4 505 B15R2.1668 NC(=O)CN1CCc2ccccc2C1 2230a_100000188457_100000747473 [0,0,0,0,0,1|2,0,1]=4 506 B15R2.1668 NC(=O)CN1CCc2ccccc2C1 269982a_100000188457_100000187820 [0,0,0,0,0,1|2,0,1]=4 507 B15R2.1668 NC(=O)CN1CCc2ccccc2C1 34a_100000188457_100000187820 [0,0,0,0,0,1|2,0,1]=4 508 B15R2.1668 [13CH3]C(=O)Cc1ccc2ccccc2c1 1458a_100000181716_200025704644 [0,0,0,0,0,1|2,0,0]=3 509 B15R2.1668 [13CH3]C(=O)Cc1ccc2ncccc2c1 1458a_100011218584_200025704644 [0,0,0,0,0,1|3,0,0]=4 510 B15R2.68122 CC(=O)Cc1cccc2c1cccc2 1458a_100000070787_100000188474 [0,0,0,0,0,1|2,0,0]=3 511 B15R2.68122 CC(=O)Cc1cccc2c1cccc2 1458a_100000186155_200000210301 [0,0,0,0,0,1|2,0,0]=3 512 B15R2.68122 CC(=O)Cc1cccc2c1ccnc2 1458a_100000070787_100016989825 [0,0,0,0,0,1|3,0,0]=4 513 B15R2.68122 CC(=O)Cc1cccc2c1nccc2 1458a_100000070787_100000241032 [0,0,0,0,0,1|3,0,0]=4 514 B15R2.68122 CC(=O)Cc1ccnc2c1cccc2 1458a_100000070787_100015192512 [0,0,0,0,0,1|1,0,1]=3 515 B15R2.68122 CC(=O)Cc1nccc2c1cccc2 1458a_100000070787_100000033776 [0,0,0,0,0,1|2,0,0]=3 516 B15R2.68122 CC(=O)Nc1cccc2c1cccc2 11a_100000185869_100015343762 [0,0,0,0,0,1|3,0,0]=4 517 B15R2.68122 CC(=O)Nc1cccc2c1cccc2 1626a_100000185869_100015343762 [0,0,0,0,0,1|3,0,0]=4 518 B15R2.68122 CC(=O)Nc1cccc2c1cccc2 22a_100000185869_100000070787 [0,0,0,0,0,1|3,0,0]=4 519 B15R2.68122 [13CH3]C(=O)Cc1cccc2c1cccc2 1458a_100000186155_200025704644 [0,0,0,0,0,1|2,0,0]=3 520 B12R1.121 C=Cc1ccccc1CCC=O 271570a_100011290941_100011713448 [1,0,1,0,0,0|1,0,1]=4 521 B12R1.121 C=Cc1ccccc1NCC=O 34a_100012022501_200009817547 [1,0,1,0,0,0|2,0,0]=4 522 B12R1.121 C=Cc1ccccc1SCC=O 62a_100011218376_200015260668 [1,0,1,0,0,0|2,0,0]=4 523 B12R1.121 C=Cc1ccccc1SCC=O 62a_200015260668_100011218376 [1,0,1,0,0,0|2,0,0]=4 524 B12R1.121 CNc1ccccc1OCC=O 34a_100000033821_200009817547 [1,0,1,0,0,0|1,0,1]=4 525 B12R1.121 CNc1ccccc1SCC=O 62a_100020606079_200015260668 [1,0,1,0,0,0|1,0,1]=4 526 B12R1.121 CNc1ccccc1SCC=O 62a_200015260668_100020606079 [1,0,1,0,0,0|1,0,1]=4 527 B12R1.121 NNc1ccccc1SCC=O 62a_100000241748_200015260668 [1,0,1,0,0,0|2,0,0]=4 528 B12R1.121 NNc1ccccc1SCC=O 62a_200015260668_100000241748 [1,0,1,0,0,0|2,0,0]=4 529 B12R1.125 Cc1ccccc1NCC(=O)N 34a_100015192222_100000187820 [1,0,1,0,0,0|1,0,1]=4 530 B12R1.125 Cc1ccccc1OCC(=O)N 34a_100000210338_100000187820 [1,0,1,0,0,0|1,0,1]=4 531 B12R1.125 Cc1ccccc1OCC(=O)N 7a_100000210338_100000187820 [1,0,1,0,0,0|1,0,1]=4 532 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000210755_100000747473 [1,0,1,0,0,0|1,0,1]=4 533 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000747473_100000210755 [1,0,1,0,0,0|1,0,1]=4 534 B12R1.125 NC(=O)CCc1ccccc1O 271570a_203496583355_100009814947 [1,0,1,0,0,0|1,0,1]=4 535 B12R1.125 NC(=O)CNc1ccccc1Br 34a_100000210017_100000187820 [1,0,1,0,0,0|2,0,0]=4 536 B12R1.125 NC(=O)CNc1ccccc1Cl 34a_100000185783_100000187820 [1,0,1,0,0,0|2,0,0]=4 537 B12R1.125 NC(=O)CNc1ccccc1F 34a_100000210422_100000187820 [1,0,1,0,0,0|2,0,0]=4 538 B12R1.125 NC(=O)CNc1ccccc1I 34a_100000210053_100000187820 [1,0,1,0,0,0|2,0,0]=4 539 B12R1.125 NC(=O)CNc1ccccc1O 34a_100000185747_100000187820 [1,0,1,0,0,0|2,0,0]=4 540 B12R1.125 NC(=O)COc1ccccc1Br 34a_100000181306_100000187820 [1,0,1,0,0,0|2,0,0]=4 541 B12R1.125 NC(=O)COc1ccccc1Br 7a_100000181306_100000187820 [1,0,1,0,0,0|2,0,0]=4 542 B12R1.125 NC(=O)COc1ccccc1Cl 34a_100000210172_100000187820 [1,0,1,0,0,0|2,0,0]=4 543 B12R1.125 NC(=O)COc1ccccc1Cl 7a_100000210172_100000187820 [1,0,1,0,0,0|2,0,0]=4 544 B12R1.125 NC(=O)COc1ccccc1F 34a_100000210171_100000187820 [1,0,1,0,0,0|2,0,0]=4 545 B12R1.125 NC(=O)COc1ccccc1F 7a_100000210171_100000187820 [1,0,1,0,0,0|2,0,0]=4 546 B12R1.125 NC(=O)COc1ccccc1I 34a_100000739446_100000187820 [1,0,1,0,0,0|2,0,0]=4 547 B12R1.125 NC(=O)COc1ccccc1I 7a_100000739446_100000187820 [1,0,1,0,0,0|2,0,0]=4 548 B12R1.125 NC(=O)COc1ccccc1N 34a_100000185747_100000187820 [1,0,1,0,0,0|1,0,0]=3 549 B12R1.125 NC(=O)COc1ccccc1N 7a_100000185747_100000187820 [1,0,1,0,0,0|1,0,0]=3 550 B12R1.125 NC(=O)COc1ccccc1O 271570a_203496583355_200000148491 [1,0,1,0,0,0|2,0,0]=4 551 B12R1.125 NC(=O)COc1cccnc1N 34a_100000211975_100000187820 [1,0,1,0,0,0|2,0,0]=4 552 B12R1.125 NC(=O)COc1cccnc1N 7a_100000211975_100000187820 [1,0,1,0,0,0|2,0,0]=4 553 B12R1.125 NC(=O)COc1cnccc1N 34a_100000753702_100000187820 [1,0,1,0,0,0|2,0,0]=4 554 B12R1.125 NC(=O)COc1ncccc1N 34a_100000746358_100000187820 [1,0,1,0,0,0|2,0,0]=4 555 B12R1.125 NC(=O)CSc1ccccc1Br 62a_100000695589_100000747473 [1,0,1,0,0,0|2,0,0]=4 556 B12R1.125 NC(=O)CSc1ccccc1Br 62a_100000747473_100000695589 [1,0,1,0,0,0|2,0,0]=4 557 B12R1.125 NC(=O)CSc1ccccc1Cl 62a_100000747473_100000764095 [1,0,1,0,0,0|2,0,0]=4 558 B12R1.125 NC(=O)CSc1ccccc1Cl 62a_100000764095_100000747473 [1,0,1,0,0,0|2,0,0]=4 559 B12R1.125 NC(=O)CSc1ccccc1F 62a_100000747473_100011215700 [1,0,1,0,0,0|2,0,0]=4 560 B12R1.125 NC(=O)CSc1ccccc1F 62a_100011215700_100000747473 [1,0,1,0,0,0|2,0,0]=4 561 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000210017_100000747473 [1,0,1,0,0,0|1,0,0]=3 562 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000747473_100000210017 [1,0,1,0,0,0|1,0,0]=3 563 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000739446_100000747473 [1,0,1,0,0,0|2,0,0]=4 564 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000747473_100000739446 [1,0,1,0,0,0|2,0,0]=4 565 B12R1.125 NC(=O)CSc1cccnc1N 62a_100000045569_100000747473 [1,0,1,0,0,0|2,0,0]=4 566 B12R1.125 NC(=O)CSc1cccnc1N 62a_100000747473_100000045569 [1,0,1,0,0,0|2,0,0]=4 567 B12R1.125 NC(=O)CSc1ccncc1N 62a_100000747473_100000756074 [1,0,1,0,0,0|2,0,0]=4 568 B12R1.125 NC(=O)CSc1ccncc1N 62a_100000756074_100000747473 [1,0,1,0,0,0|2,0,0]=4 569 B12R1.125 NC(=O)CSc1cnccc1N 62a_100000047001_100000747473 [1,0,1,0,0,0|2,0,0]=4 570 B12R1.125 NC(=O)CSc1cnccc1N 62a_100000747473_100000047001 [1,0,1,0,0,0|2,0,0]=4 571 B12R1.125 NC(=O)CSc1ncccc1N 62a_100000688686_100000747473 [1,0,1,0,0,0|2,0,0]=4 572 B12R1.125 NC(=O)CSc1ncccc1N 62a_100000747473_100000688686 [1,0,1,0,0,0|2,0,0]=4 573 B12R1.125 Nc1ccccc1OCC(=O)[O-] 34a_100000185747_100020667443 [1,0,1,0,0,0|2,0,0]=4 574 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100000210017_100020667443 [1,0,1,0,0,0|2,0,0]=4 575 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210017 [1,0,1,0,0,0|2,0,0]=4 576 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [1,0,1,0,0,0|2,0,0]=4 577 B12R1.107 CN(CC(=O)N)c1ccccc1 2230a_100000210012_100000747473 [1,0,1,0,0,0|1,0,1]=4 578 B12R1.107 CN(CC(=O)N)c1ccccc1 2230a_100000212578_200000210301 [1,0,1,0,0,0|1,0,1]=4 579 B12R1.107 CN(CC(=O)N)c1ccccc1 269982a_100000210012_100000187820 [1,0,1,0,0,0|1,0,1]=4 580 B12R1.107 CN(CC(=O)N)c1ccccc1 269982a_100000212578_200000210301 [1,0,1,0,0,0|1,0,1]=4 581 B12R1.107 CN(CC(=O)N)c1ccccc1 34a_100000210012_100000187820 [1,0,1,0,0,0|1,0,1]=4 582 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [1,0,1,0,0,0|1,0,0]=3 583 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [1,0,1,0,0,0|2,0,0]=4 584 B12R1.107 [13CH3]N(CC(=O)N)c1ccccc1 2230a_100000212578_200025704644 [1,0,1,0,0,0|1,0,1]=4 585 B12R1.107 [13CH3]N(CC(=O)N)c1ccccc1 269982a_100000212578_200025704644 [1,0,1,0,0,0|1,0,1]=4 586 B12R2.1 C=Cc1c[nH]c2c1cccn2 271570a_100011290941_100011934613 [2,0,0,0,0,0|1,0,1]=4 587 B12R2.1 C=Cc1c[nH]c2c1ccnc2 271570a_100011290941_100010232032 [2,0,0,0,0,0|1,0,1]=4 588 B12R2.1 C=Cc1c[nH]c2c1cncc2 271570a_100011290941_100011934843 [2,0,0,0,0,0|1,0,1]=4 589 B12R2.1 C=Cc1c[nH]c2c1nccc2 271570a_100011290941_100009817151 [2,0,0,0,0,0|1,0,1]=4 590 B12R2.1 C=Cc1coc2c1cccc2 271570a_100011290941_100009812202 [2,0,0,0,0,0|1,0,1]=4 591 B12R2.1 C=Cc1csc2c1cccc2 271570a_100011290941_100009813928 [2,0,0,0,0,0|1,0,1]=4 592 B12R2.1 C=Cc1n[nH]c2c1cccc2 271570a_100011290941_100000050141 [2,0,0,0,0,0|1,0,1]=4 593 B14R1.118 CNc1c(cccc1SCC(=O)N)N 62a_100010510394_100000747473 [0,1,1,0,0,0|1,0,1]=4 594 B14R1.118 NNc1c(cccc1SCC(=O)N)F 62a_100000747473_100016994982 [0,1,1,0,0,0|2,0,0]=4 595 B14R1.118 NNc1c(cccc1SCC(=O)N)F 62a_100016994982_100000747473 [0,1,1,0,0,0|2,0,0]=4 596 B14R1.482 C/C=C/c1ccccc1OCC(=O)N 34a_200000189419_100000187820 [0,1,1,0,0,0|2,0,0]=4 597 B14R1.482 C/C=C/c1ccccc1OCC(=O)N 7a_200000189419_100000187820 [0,1,1,0,0,0|2,0,0]=4 598 B14R1.482 C=C=Cc1ccccc1CCC(=O)N 271570a_100015277604_100009814947 [0,1,1,0,0,0|1,0,1]=4 599 B14R1.482 C=C=Cc1ccccc1OCC(=O)N 271570a_100015277604_200000148491 [0,1,1,0,0,0|2,0,0]=4 600 B14R1.482 C=CCc1ccccc1NCC(=O)N 2230a_200138433279_100000747473 [0,1,1,0,0,0|2,0,0]=4 601 B14R1.482 C=CCc1ccccc1NCC(=O)N 34a_200138433279_100000187820 [0,1,1,0,0,0|2,0,0]=4 602 B14R1.482 C=CCc1ccccc1OCC(=O)N 34a_100000211836_100000187820 [0,1,1,0,0,0|2,0,0]=4 603 B14R1.482 C=CCc1ccccc1OCC(=O)N 7a_100000211836_100000187820 [0,1,1,0,0,0|2,0,0]=4 604 B14R1.482 C=CCc1ccccc1SCC(=O)N 62a_100000747473_100009828059 [0,1,1,0,0,0|2,0,0]=4 605 B14R1.482 C=CCc1ccccc1SCC(=O)N 62a_100009828059_100000747473 [0,1,1,0,0,0|2,0,0]=4 606 B14R1.482 CC=Cc1ccccc1CCC(=O)N 271570a_100016259895_100009814947 [0,1,1,0,0,0|1,0,1]=4 607 B14R1.482 CC=Cc1ccccc1OCC(=O)N 271570a_100016259895_200000148491 [0,1,1,0,0,0|2,0,0]=4 608 B14R1.482 CCNc1ccccc1OCC(=O)N 34a_103624766699_100000187820 [0,1,1,0,0,0|1,0,1]=4 609 B14R1.482 CCNc1ccccc1OCC(=O)N 7a_103624766699_100000187820 [0,1,1,0,0,0|1,0,1]=4 610 B14R1.482 CCNc1ccccc1SCC(=O)N 62a_100000747473_114873767003 [0,1,1,0,0,0|1,0,1]=4 611 B14R1.482 CCNc1ccccc1SCC(=O)N 62a_114873767003_100000747473 [0,1,1,0,0,0|1,0,1]=4 612 B14R1.482 CCNc1ccccc1SCC(=O)N 7a_100000187061_100000210202 [0,1,1,0,0,0|1,0,1]=4 613 B14R1.482 CNCc1ccccc1OCC(=O)N 207a_100102657272_100000150104 [0,1,1,0,0,0|1,0,1]=4 614 B14R1.482 CNCc1ccccc1OCC(=O)N 270004a_106832991635_100000150104 [0,1,1,0,0,0|1,0,1]=4 615 B14R1.482 CNCc1ccccc1OCC(=O)N 34a_100015189988_100000187820 [0,1,1,0,0,0|1,0,1]=4 616 B14R1.482 CNCc1ccccc1SCC(=O)N 62a_100000184654_100000747473 [0,1,1,0,0,0|1,0,1]=4 617 B14R1.482 CNCc1ccccc1SCC(=O)N 62a_100000747473_100000184654 [0,1,1,0,0,0|1,0,1]=4 618 B14R1.482 N#CNc1ccccc1SCC(=O)N 62a_100000747473_100011685340 [0,1,1,0,0,0|1,0,1]=4 619 B14R1.482 NC(=O)CSc1ccccc1NC=O 62a_100000747473_200020615051 [0,1,1,0,0,0|1,0,0]=3 620 B14R1.482 NC(=O)CSc1ccccc1NC=O 62a_200020615051_100000747473 [0,1,1,0,0,0|1,0,0]=3 621 B14R1.482 NC(=O)CSc1ccccc1NCF 7a_100000187061_100015361967 [0,1,1,0,0,0|1,0,1]=4 622 B14R1.482 NNCc1ccccc1SCC(=O)N 62a_100000747473_200016993956 [0,1,1,0,0,0|2,0,0]=4 623 B14R1.482 NNCc1ccccc1SCC(=O)N 62a_200016993956_100000747473 [0,1,1,0,0,0|2,0,0]=4 624 B14R1.482 O=CNc1ccccc1SCC(=O)[O-] 62a_100020667443_200020615051 [0,1,1,0,0,0|2,0,0]=4 625 B14R1.482 O=CNc1ccccc1SCC(=O)[O-] 62a_200020615051_100020667443 [0,1,1,0,0,0|2,0,0]=4 626 B14R1.840 C#Cc1ccccc1C(=O)CC(=O)N 1458a_100011243808_100000187820 [0,1,1,0,0,0|1,0,1]=4 627 B14R1.840 C=Cc1ccccc1C(=O)CC(=O)C 271570a_100011290941_200011243946 [0,1,1,0,0,0|2,0,0]=4 628 B14R1.840 C=Cc1ccccc1C(=O)CC(=O)N 1458a_100011830265_100000187820 [0,1,1,0,0,0|1,0,0]=3 629 B14R1.840 C=Cc1ccccc1C(=O)CC(=O)[O-] 1458a_100011830265_100020667443 [0,1,1,0,0,0|2,0,0]=4 630 B14R1.840 CCc1ccccc1C(=O)CC(=O)N 1458a_100000689120_100000187820 [0,1,1,0,0,0|1,0,1]=4 631 B14R1.840 COc1ccccc1C(=O)CC(=O)N 1458a_100000185835_100000187820 [0,1,1,0,0,0|1,0,1]=4 632 B14R1.840 CSc1ccccc1C(=O)CC(=O)N 1458a_100000183967_100000187820 [0,1,1,0,0,0|1,0,1]=4 633 B14R1.840 N#Cc1ccccc1C(=O)CC(=O)N 1458a_100000742908_100000187820 [0,1,1,0,0,0|2,0,0]=4 634 B14R1.840 NC(=O)CC(=O)c1ccccc1CO 1458a_100011301526_100000187820 [0,1,1,0,0,0|2,0,0]=4 635 B14R1.840 NC(=O)CC(=O)c1ccccc1I=O 1458a_100000032414_100000187820 [0,1,1,0,0,0|2,0,0]=4 636 B14R1.863 C=Cc1ccccc1NCC(=O)NC 34a_100012022501_100000183359 [0,1,1,0,0,0|2,0,0]=4 637 B14R1.863 C=Cc1ccccc1OCC(=O)NC 271570a_100011290941_200000148481 [0,1,1,0,0,0|2,0,0]=4 638 B14R1.863 C=Cc1ccccc1OCC(=O)NN 271570a_100011290941_100025785231 [0,1,1,0,0,0|2,0,0]=4 639 B14R1.863 C=Cc1ccccc1SCC(=O)NC 62a_100000183359_100011218376 [0,1,1,0,0,0|2,0,0]=4 640 B14R1.863 C=Cc1ccccc1SCC(=O)NC 62a_100011218376_100000183359 [0,1,1,0,0,0|2,0,0]=4 641 B14R1.863 CNC(=O)CCc1ccccc1NC 2230a_100011289560_200000210301 [0,1,1,0,0,0|0,0,2]=4 642 B14R1.863 CNC(=O)CCc1ccccc1NC 34a_100011289560_200000210301 [0,1,1,0,0,0|0,0,2]=4 643 B14R1.863 CNC(=O)CCc1ccccc1NC 7a_100011289560_200000210301 [0,1,1,0,0,0|0,0,2]=4 644 B14R1.863 CNC(=O)CCc1ccccc1N[13CH3] 2230a_100011289560_200025704644 [0,1,1,0,0,0|0,0,2]=4 645 B14R1.863 CNC(=O)CCc1ccccc1N[13CH3] 34a_100011289560_200025704644 [0,1,1,0,0,0|0,0,2]=4 646 B14R1.863 CNC(=O)CCc1ccccc1N[13CH3] 7a_100011289560_200025704644 [0,1,1,0,0,0|0,0,2]=4 647 B14R1.863 CNC(=O)COc1ccccc1NC 34a_100000033821_100000183359 [0,1,1,0,0,0|1,0,1]=4 648 B14R1.863 CNC(=O)CSc1ccccc1NC 62a_100000183359_100020606079 [0,1,1,0,0,0|1,0,1]=4 649 B14R1.863 CNC(=O)CSc1ccccc1NC 62a_100020606079_100000183359 [0,1,1,0,0,0|1,0,1]=4 650 B14R1.863 CNC(=O)CSc1ccccc1NN 62a_100000183359_100000241748 [0,1,1,0,0,0|2,0,0]=4 651 B14R1.863 CNC(=O)CSc1ccccc1NN 62a_100000241748_100000183359 [0,1,1,0,0,0|2,0,0]=4 652 B14R1.1600 C=Cc1cc(ccc1OCC(=O)N)C 271570a_100011290941_200000148664 [0,1,1,0,0,0|2,0,0]=4 653 B14R1.1600 C=Cc1cc(ccc1SCC(=O)N)F 62a_100000747473_100012356183 [0,1,1,0,0,0|2,0,0]=4 654 B14R1.1600 C=Cc1cc(ccc1SCC(=O)N)F 62a_100012356183_100000747473 [0,1,1,0,0,0|2,0,0]=4 655 B14R1.1600 CNc1cc(ccc1SCC(=O)N)F 62a_100000747473_100020633008 [0,1,1,0,0,0|1,0,1]=4 656 B14R1.1600 CNc1cc(ccc1SCC(=O)N)F 62a_100020633008_100000747473 [0,1,1,0,0,0|1,0,1]=4 657 B14R1.1600 NNc1cc(ccc1SCC(=O)N)F 62a_100000747473_100012362518 [0,1,1,0,0,0|2,0,0]=4 658 B14R1.1600 NNc1cc(ccc1SCC(=O)N)F 62a_100012362518_100000747473 [0,1,1,0,0,0|2,0,0]=4 659 B14R1.1865 C=Cc1ccc(cc1SCC(=O)N)F 62a_100000747473_100012354420 [0,1,1,0,0,0|2,0,0]=4 660 B14R1.1865 C=Cc1ccc(cc1SCC(=O)N)F 62a_100012354420_100000747473 [0,1,1,0,0,0|2,0,0]=4 661 B14R1.1865 CNc1ccc(cc1SCC(=O)N)C 62a_100000221369_100000747473 [0,1,1,0,0,0|1,0,1]=4 662 B14R1.1865 CNc1ccc(cc1SCC(=O)N)C 62a_100000747473_100000221369 [0,1,1,0,0,0|1,0,1]=4 663 B14R1.1865 CNc1ccc(cc1SCC(=O)N)F 62a_100000747473_100011246292 [0,1,1,0,0,0|1,0,1]=4 664 B14R1.1865 CNc1ccc(cc1SCC(=O)N)F 62a_100011246292_100000747473 [0,1,1,0,0,0|1,0,1]=4 665 B14R1.1865 Cc1ccc(c(c1)SCC(=O)N)NN 62a_100000747473_100016996181 [0,1,1,0,0,0|2,0,0]=4 666 B14R1.1865 Cc1ccc(c(c1)SCC(=O)N)NN 62a_100016996181_100000747473 [0,1,1,0,0,0|2,0,0]=4 667 B14R1.3135 C=Cc1ccccc1NC(C)C(=O)N 34a_100012022501_100000702099 [0,1,1,0,0,0|2,0,0]=4 668 B14R1.3135 C=Cc1ccccc1NC(F)C(=O)N 34a_100012022501_100009813875 [0,1,1,0,0,0|2,0,0]=4 669 B14R1.3135 C=Cc1ccccc1OC(C)C(=O)N 271570a_100011290941_100000148488 [0,1,1,0,0,0|2,0,0]=4 670 B14R1.3135 C=Cc1ccccc1SC(C)C(=O)N 62a_100000702099_100011218376 [0,1,1,0,0,0|2,0,0]=4 671 B14R1.3135 C=Cc1ccccc1SC(C)C(=O)N 62a_100011218376_100000702099 [0,1,1,0,0,0|2,0,0]=4 672 B14R1.3135 C=Cc1ccccc1SC(F)C(=O)N 62a_100009813875_100011218376 [0,1,1,0,0,0|2,0,0]=4 673 B14R1.3135 C=Cc1ccccc1SC(F)C(=O)N 62a_100011218376_100009813875 [0,1,1,0,0,0|2,0,0]=4 674 B14R1.3135 CC(Sc1ccccc1NN)C(=O)N 62a_100000241748_100000702099 [0,1,1,0,0,0|2,0,0]=4 675 B14R1.3135 CC(Sc1ccccc1NN)C(=O)N 62a_100000702099_100000241748 [0,1,1,0,0,0|2,0,0]=4 676 B14R1.3135 CNc1ccccc1OC(C)C(=O)N 34a_100000033821_100000702099 [0,1,1,0,0,0|1,0,1]=4 677 B14R1.3135 CNc1ccccc1OC(F)C(=O)N 34a_100000033821_100009813875 [0,1,1,0,0,0|1,0,1]=4 678 B14R1.3135 CNc1ccccc1SC(C)C(=O)N 62a_100000702099_100020606079 [0,1,1,0,0,0|1,0,1]=4 679 B14R1.3135 CNc1ccccc1SC(C)C(=O)N 62a_100020606079_100000702099 [0,1,1,0,0,0|1,0,1]=4 680 B14R1.3135 CNc1ccccc1SC(F)C(=O)N 62a_100009813875_100020606079 [0,1,1,0,0,0|1,0,1]=4 681 B14R1.3135 CNc1ccccc1SC(F)C(=O)N 62a_100020606079_100009813875 [0,1,1,0,0,0|1,0,1]=4 682 B14R1.3135 NNc1ccccc1SC(F)C(=O)N 62a_100000241748_100009813875 [0,1,1,0,0,0|2,0,0]=4 683 B14R1.3135 NNc1ccccc1SC(F)C(=O)N 62a_100009813875_100000241748 [0,1,1,0,0,0|2,0,0]=4 684 B14R1.4522 C=C(C)c1ccccc1CCC(=O)N 271570a_100000694244_100009814947 [0,1,1,0,0,0|1,0,1]=4 685 B14R1.4522 C=C(C)c1ccccc1NCC(=O)N 34a_100000037685_100000187820 [0,1,1,0,0,0|2,0,0]=4 686 B14R1.4522 C=C(C)c1ccccc1OCC(=O)N 271570a_100000694244_200000148491 [0,1,1,0,0,0|2,0,0]=4 687 B14R1.4522 CN(C)c1ccccc1SCC(=O)N 62a_100000747473_100011290883 [0,1,1,0,0,0|1,0,1]=4 688 B14R1.4522 CN(C)c1ccccc1SCC(=O)N 62a_100011290883_100000747473 [0,1,1,0,0,0|1,0,1]=4 689 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)Br 1458a_100000760464_100000187820 [0,1,1,0,0,0|2,0,0]=4 690 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)Cl 1458a_100000690184_100000187820 [0,1,1,0,0,0|2,0,0]=4 691 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)F 1458a_100011218272_100000187820 [0,1,1,0,0,0|2,0,0]=4 692 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)I 1458a_100000751865_100000187820 [0,1,1,0,0,0|2,0,0]=4 693 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)O 1458a_100000766327_100000187820 [0,1,1,0,0,0|2,0,0]=4 694 B14R1.152 Cc1cccc(c1Br)C(=O)CC(=O)N 1458a_100000692419_100000187820 [0,1,1,0,0,0|2,0,0]=4 695 B14R1.152 Cc1cccc(c1C)C(=O)CC(=O)N 1458a_100000183679_100000187820 [0,1,1,0,0,0|2,0,0]=4 696 B14R1.152 Cc1cccc(c1Cl)C(=O)CC(=O)N 1458a_100000693142_100000187820 [0,1,1,0,0,0|2,0,0]=4 697 B14R1.152 Cc1cccc(c1F)C(=O)CC(=O)N 1458a_100000766181_100000187820 [0,1,1,0,0,0|2,0,0]=4 698 B14R1.152 Cc1cccc(c1I)C(=O)CC(=O)N 1458a_100000739377_100000187820 [0,1,1,0,0,0|2,0,0]=4 699 B14R1.152 Cc1cccc(c1O)C(=O)CC(=O)N 1458a_100000183896_100000187820 [0,1,1,0,0,0|2,0,0]=4 700 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000187820 [0,1,1,0,0,0|2,0,0]=4 701 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000187820 [0,1,1,0,0,0|2,0,0]=4 702 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)F 1458a_100011217547_100000187820 [0,1,1,0,0,0|2,0,0]=4 703 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)I 1458a_100010232522_100000187820 [0,1,1,0,0,0|2,0,0]=4 704 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)O 1458a_100010230362_100000187820 [0,1,1,0,0,0|2,0,0]=4 705 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000187820 [0,1,1,0,0,0|2,0,0]=4 706 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000187820 [0,1,1,0,0,0|2,0,0]=4 707 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000187820 [0,1,1,0,0,0|2,0,0]=4 708 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000187820 [0,1,1,0,0,0|2,0,0]=4 709 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000187820 [0,1,1,0,0,0|2,0,0]=4 710 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)Br 1458a_100000756403_100000187820 [0,1,1,0,0,0|2,0,0]=4 711 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000187820 [0,1,1,0,0,0|2,0,0]=4 712 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)F 1458a_100000748134_100000187820 [0,1,1,0,0,0|2,0,0]=4 713 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)I 1458a_100010185205_100000187820 [0,1,1,0,0,0|2,0,0]=4 714 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)O 1458a_100000037433_100000187820 [0,1,1,0,0,0|2,0,0]=4 715 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)Br 1458a_100000688019_100000187820 [0,1,1,0,0,0|2,0,0]=4 716 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000187820 [0,1,1,0,0,0|2,0,0]=4 717 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)F 1458a_100000690930_100000187820 [0,1,1,0,0,0|2,0,0]=4 718 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)O 1458a_100010084636_100000187820 [0,1,1,0,0,0|2,0,0]=4 719 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100000187820 [0,1,1,0,0,0|2,0,0]=4 720 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000187820 [0,1,1,0,0,0|2,0,0]=4 721 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)F 1458a_100011217230_100000187820 [0,1,1,0,0,0|2,0,0]=4 722 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)O 1458a_100000690420_100000187820 [0,1,1,0,0,0|2,0,0]=4 723 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1Br 1458a_100000188424_100000702099 [0,1,1,0,0,0|2,0,0]=4 724 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1Cl 1458a_100000185844_100000702099 [0,1,1,0,0,0|2,0,0]=4 725 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1F 1458a_100000188656_100000702099 [0,1,1,0,0,0|2,0,0]=4 726 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1I 1458a_100000187884_100000702099 [0,1,1,0,0,0|2,0,0]=4 727 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1O 1458a_100015234032_100000702099 [0,1,1,0,0,0|2,0,0]=4 728 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1[O-] 1458a_100009911694_100000702099 [0,1,1,0,0,0|2,0,0]=4 729 B14R1.243 Cc1ccccc1C(=O)C(C)C(=O)N 1458a_100000212026_100000702099 [0,1,1,0,0,0|2,0,0]=4 730 B14R1.243 Cc1ccccc1C(=O)C(F)C(=O)N 1458a_100000212026_100009813875 [0,1,1,0,0,0|2,0,0]=4 731 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1Br 1458a_100000188424_100009813875 [0,1,1,0,0,0|2,0,0]=4 732 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1Cl 1458a_100000185844_100009813875 [0,1,1,0,0,0|2,0,0]=4 733 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1F 1458a_100000188656_100009813875 [0,1,1,0,0,0|2,0,0]=4 734 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1I 1458a_100000187884_100009813875 [0,1,1,0,0,0|2,0,0]=4 735 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1O 1458a_100015234032_100009813875 [0,1,1,0,0,0|2,0,0]=4 736 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1[O-] 1458a_100009911694_100009813875 [0,1,1,0,0,0|2,0,0]=4 737 B14R1.587 CNC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000183359 [0,1,1,0,0,0|2,0,0]=4 738 B14R1.587 CNC(=O)CC(=O)c1ccccc1C 1458a_100000212026_100000183359 [0,1,1,0,0,0|2,0,0]=4 739 B14R1.587 CNC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000183359 [0,1,1,0,0,0|2,0,0]=4 740 B14R1.587 CNC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000183359 [0,1,1,0,0,0|2,0,0]=4 741 B14R1.587 CNC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000183359 [0,1,1,0,0,0|2,0,0]=4 742 B14R1.587 CNC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183359 [0,1,1,0,0,0|2,0,0]=4 743 B14R1.587 CNC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000183359 [0,1,1,0,0,0|2,0,0]=4 744 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)Br 1458a_100000701904_100000187820 [0,1,1,0,0,0|2,0,0]=4 745 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)C 1458a_100000758298_100000187820 [0,1,1,0,0,0|2,0,0]=4 746 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)Cl 1458a_100000692601_100000187820 [0,1,1,0,0,0|2,0,0]=4 747 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)F 1458a_100000762013_100000187820 [0,1,1,0,0,0|2,0,0]=4 748 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)I 1458a_100000688020_100000187820 [0,1,1,0,0,0|2,0,0]=4 749 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)O 1458a_100011934116_100000187820 [0,1,1,0,0,0|2,0,0]=4 750 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000187820 [0,1,1,0,0,0|2,0,0]=4 751 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000187820 [0,1,1,0,0,0|2,0,0]=4 752 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)F 1458a_100000752694_100000187820 [0,1,1,0,0,0|2,0,0]=4 753 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100000187820 [0,1,1,0,0,0|2,0,0]=4 754 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000187820 [0,1,1,0,0,0|2,0,0]=4 755 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000187820 [0,1,1,0,0,0|2,0,0]=4 756 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000187820 [0,1,1,0,0,0|2,0,0]=4 757 B14R1.5958 NC(=O)CC(=O)c1c(cccc1F)F 1458a_100000210804_100000187820 [0,1,1,0,0,0|2,0,0]=4 758 B14R1.5958 NC(=O)CC(=O)c1c(cccc1F)O 1458a_100000763259_100000187820 [0,1,1,0,0,0|2,0,0]=4 759 B14R1.5958 NC(=O)CC(=O)c1c(cccc1I)Br 1458a_100010232521_100000187820 [0,1,1,0,0,0|2,0,0]=4 760 B14R1.5958 NC(=O)CC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000187820 [0,1,1,0,0,0|2,0,0]=4 761 B14R1.5958 NC(=O)CC(=O)c1c(cccc1I)F 1458a_100000023732_100000187820 [0,1,1,0,0,0|2,0,0]=4 762 B14R1.5958 NC(=O)CC(=O)c1c(cccc1O)O 1458a_100000755285_100000187820 [0,1,1,0,0,0|2,0,0]=4 763 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)Br 1458a_100000741311_100000187820 [0,1,1,0,0,0|2,0,0]=4 764 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)Cl 1458a_100000688705_100000187820 [0,1,1,0,0,0|2,0,0]=4 765 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)F 1458a_100000686989_100000187820 [0,1,1,0,0,0|2,0,0]=4 766 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)I 1458a_100010189873_100000187820 [0,1,1,0,0,0|2,0,0]=4 767 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)O 1458a_100000692822_100000187820 [0,1,1,0,0,0|2,0,0]=4 768 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)CC(=O)N 1458a_100000685072_100000187820 [0,1,1,0,0,0|2,0,0]=4 769 B14R1.6048 Cc1ccc(c(c1)C)C(=O)CC(=O)N 1458a_100000211164_100000187820 [0,1,1,0,0,0|2,0,0]=4 770 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)CC(=O)N 1458a_100000766932_100000187820 [0,1,1,0,0,0|2,0,0]=4 771 B14R1.6048 Cc1ccc(c(c1)F)C(=O)CC(=O)N 1458a_100000766033_100000187820 [0,1,1,0,0,0|2,0,0]=4 772 B14R1.6048 Cc1ccc(c(c1)I)C(=O)CC(=O)N 1458a_100009999607_100000187820 [0,1,1,0,0,0|2,0,0]=4 773 B14R1.6048 Cc1ccc(c(c1)O)C(=O)CC(=O)N 1458a_100000212137_100000187820 [0,1,1,0,0,0|2,0,0]=4 774 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000187820 [0,1,1,0,0,0|2,0,0]=4 775 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000187820 [0,1,1,0,0,0|2,0,0]=4 776 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000187820 [0,1,1,0,0,0|2,0,0]=4 777 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000187820 [0,1,1,0,0,0|2,0,0]=4 778 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000187820 [0,1,1,0,0,0|2,0,0]=4 779 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000187820 [0,1,1,0,0,0|2,0,0]=4 780 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000187820 [0,1,1,0,0,0|2,0,0]=4 781 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000187820 [0,1,1,0,0,0|2,0,0]=4 782 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000187820 [0,1,1,0,0,0|2,0,0]=4 783 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000187820 [0,1,1,0,0,0|2,0,0]=4 784 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000187820 [0,1,1,0,0,0|2,0,0]=4 785 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000187820 [0,1,1,0,0,0|2,0,0]=4 786 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)F 1458a_100000211022_100000187820 [0,1,1,0,0,0|2,0,0]=4 787 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)I 1458a_100000037189_100000187820 [0,1,1,0,0,0|2,0,0]=4 788 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)O 1458a_100000689029_100000187820 [0,1,1,0,0,0|2,0,0]=4 789 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000187820 [0,1,1,0,0,0|2,0,0]=4 790 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000187820 [0,1,1,0,0,0|2,0,0]=4 791 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1I)F 1458a_100000739341_100000187820 [0,1,1,0,0,0|2,0,0]=4 792 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000187820 [0,1,1,0,0,0|2,0,0]=4 793 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000187820 [0,1,1,0,0,0|2,0,0]=4 794 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100000187820 [0,1,1,0,0,0|2,0,0]=4 795 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100000187820 [0,1,1,0,0,0|2,0,0]=4 796 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000187820 [0,1,1,0,0,0|2,0,0]=4 797 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)Br 1458a_100000689033_100000187820 [0,1,1,0,0,0|2,0,0]=4 798 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)C 1458a_100000195421_100000187820 [0,1,1,0,0,0|2,0,0]=4 799 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)Cl 1458a_100011290873_100000187820 [0,1,1,0,0,0|2,0,0]=4 800 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)F 1458a_100000749327_100000187820 [0,1,1,0,0,0|2,0,0]=4 801 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)I 1458a_100000057929_100000187820 [0,1,1,0,0,0|2,0,0]=4 802 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)O 1458a_100000229998_100000187820 [0,1,1,0,0,0|2,0,0]=4 803 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)Br 1458a_100000759961_100000187820 [0,1,1,0,0,0|2,0,0]=4 804 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)Cl 1458a_100000692595_100000187820 [0,1,1,0,0,0|2,0,0]=4 805 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)F 1458a_100000240043_100000187820 [0,1,1,0,0,0|2,0,0]=4 806 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)I 1458a_100000688012_100000187820 [0,1,1,0,0,0|2,0,0]=4 807 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)O 1458a_100000687834_100000187820 [0,1,1,0,0,0|2,0,0]=4 808 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000187820 [0,1,1,0,0,0|2,0,0]=4 809 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000187820 [0,1,1,0,0,0|2,0,0]=4 810 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000187820 [0,1,1,0,0,0|2,0,0]=4 811 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000187820 [0,1,1,0,0,0|2,0,0]=4 812 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000187820 [0,1,1,0,0,0|2,0,0]=4 813 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000187820 [0,1,1,0,0,0|2,0,0]=4 814 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000187820 [0,1,1,0,0,0|2,0,0]=4 815 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000187820 [0,1,1,0,0,0|2,0,0]=4 816 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000187820 [0,1,1,0,0,0|2,0,0]=4 817 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000187820 [0,1,1,0,0,0|2,0,0]=4 818 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000187820 [0,1,1,0,0,0|2,0,0]=4 819 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000187820 [0,1,1,0,0,0|2,0,0]=4 820 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)F 1458a_100000198512_100000187820 [0,1,1,0,0,0|2,0,0]=4 821 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)I 1458a_100000688014_100000187820 [0,1,1,0,0,0|2,0,0]=4 822 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)O 1458a_100000037260_100000187820 [0,1,1,0,0,0|2,0,0]=4 823 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000187820 [0,1,1,0,0,0|2,0,0]=4 824 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000187820 [0,1,1,0,0,0|2,0,0]=4 825 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)F 1458a_100000748905_100000187820 [0,1,1,0,0,0|2,0,0]=4 826 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)I 1458a_100000750460_100000187820 [0,1,1,0,0,0|2,0,0]=4 827 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)O 1458a_200009995701_100000187820 [0,1,1,0,0,0|2,0,0]=4 828 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000187820 [0,1,1,0,0,0|2,0,0]=4 829 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000187820 [0,1,1,0,0,0|2,0,0]=4 830 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100000187820 [0,1,1,0,0,0|2,0,0]=4 831 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100000187820 [0,1,1,0,0,0|2,0,0]=4 832 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100000187820 [0,1,1,0,0,0|2,0,0]=4 833 B14R1.148 Cc1cccc(c1)NCCCC(=O)N 34a_100000188690_100102525003 [0,1,1,0,0,0|0,0,2]=4 834 B14R1.148 NC(=O)CCCNc1cccc(c1)Br 34a_100000210019_100102525003 [0,1,1,0,0,0|0,0,2]=4 835 B14R1.148 NC(=O)CCCNc1cccc(c1)Cl 34a_100000185859_100102525003 [0,1,1,0,0,0|0,0,2]=4 836 B14R1.148 NC(=O)CCCNc1cccc(c1)F 34a_100000210047_100102525003 [0,1,1,0,0,0|0,0,2]=4 837 B14R1.148 NC(=O)CCCNc1cccc(c1)I 34a_100000211102_100102525003 [0,1,1,0,0,0|0,0,2]=4 838 B14R1.148 NC(=O)CCCNc1cccc(c1)O 34a_100000210217_100102525003 [0,1,1,0,0,0|0,0,2]=4 839 B14R1.159 Cc1ccccc1NCCCC(=O)N 34a_100015192222_100102525003 [0,1,1,0,0,0|0,0,2]=4 840 B14R1.159 NC(=O)CCCNc1ccccc1Br 34a_100000210017_100102525003 [0,1,1,0,0,0|0,0,2]=4 841 B14R1.159 NC(=O)CCCNc1ccccc1Cl 34a_100000185783_100102525003 [0,1,1,0,0,0|0,0,2]=4 842 B14R1.159 NC(=O)CCCNc1ccccc1F 34a_100000210422_100102525003 [0,1,1,0,0,0|0,0,2]=4 843 B14R1.159 NC(=O)CCCNc1ccccc1I 34a_100000210053_100102525003 [0,1,1,0,0,0|0,0,2]=4 844 B14R1.159 NC(=O)CCCNc1ccccc1O 34a_100000185747_100102525003 [0,1,1,0,0,0|0,0,2]=4 845 B14R1.420 CN(CCCC(=O)N)c1ccccc1 269982a_100000210012_100102525003 [0,1,1,0,0,0|0,0,2]=4 846 B14R1.420 CN(CCCC(=O)N)c1ccccc1 34a_100000210012_100102525003 [0,1,1,0,0,0|0,0,2]=4 847 B14R1.423 CC(=O)C=CC(=O)Nc1ccccc1 1458a_200016255450_200000210301 [0,1,1,0,0,0|1,0,1]=4 848 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000070787_100000242058 [0,1,1,0,0,0|1,0,1]=4 849 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200000210301 [0,1,1,0,0,0|1,0,1]=4 850 B14R1.423 CC(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_200000210301 [0,1,1,0,0,0|2,0,0]=4 851 B14R1.423 NC(=O)CCC(=O)Cc1ccccc1 1458a_100011215257_100015291786 [0,1,1,0,0,0|1,0,1]=4 852 B14R1.423 NC(=O)CCC(=O)Nc1ccccc1 22a_100000106764_100011215257 [0,1,1,0,0,0|0,0,1]=3 853 B14R1.423 NC(=O)CCC(=O)Nc1ccccc1 527a_100000106764_100011215257 [0,1,1,0,0,0|0,0,1]=3 854 B14R1.423 NC(=O)CNC(=O)Nc1ccccc1 2430a_100000106764_100000711301 [0,1,1,0,0,0|1,0,0]=3 855 B14R1.423 NC(=O)NCC(=O)Nc1ccccc1 22a_100000106764_100000184981 [0,1,1,0,0,0|1,0,1]=4 856 B14R1.423 NC(=O)NCC(=O)Nc1ccccc1 527a_100000106764_100000184981 [0,1,1,0,0,0|1,0,1]=4 857 B14R1.423 [13CH3]C(=O)C=CC(=O)Nc1ccccc1 1458a_200016255450_200025704644 [0,1,1,0,0,0|1,0,1]=4 858 B14R1.423 [13CH3]C(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200025704644 [0,1,1,0,0,0|1,0,1]=4 859 B14R1.423 [13CH3]C(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_200025704644 [0,1,1,0,0,0|2,0,0]=4 860 B14R1.677 Cc1ccc(cc1)NCCCC(=O)N 34a_100000124888_100102525003 [0,1,1,0,0,0|0,0,2]=4 861 B14R1.677 NC(=O)CCCNc1ccc(cc1)Br 34a_100000210018_100102525003 [0,1,1,0,0,0|0,0,2]=4 862 B14R1.677 NC(=O)CCCNc1ccc(cc1)Cl 34a_100000210052_100102525003 [0,1,1,0,0,0|0,0,2]=4 863 B14R1.677 NC(=O)CCCNc1ccc(cc1)F 34a_100000185862_100102525003 [0,1,1,0,0,0|0,0,2]=4 864 B14R1.677 NC(=O)CCCNc1ccc(cc1)I 34a_100000185761_100102525003 [0,1,1,0,0,0|0,0,2]=4 865 B14R1.677 NC(=O)CCCNc1ccc(cc1)O 34a_100000185829_100102525003 [0,1,1,0,0,0|0,0,2]=4 866 B14R1.716 CNC(=O)C=C/C=C/c1ccccc1 1626a_100102657272_100016289705 [0,1,1,0,0,0|1,0,1]=4 867 B14R1.716 CNC(=O)CCCNc1ccccc1 34a_100000106764_100000741757 [0,1,1,0,0,0|0,0,2]=4 868 B14R1.716 COC(=O)CC=NNc1ccccc1 4a_100015195140_200011552997 [0,1,1,0,0,0|2,0,0]=4 869 B14R1.818 NC(=O)CC(=O)C#Cc1ccccc1 1458a_100000736102_100000187820 [0,1,1,0,0,0|1,0,1]=4 870 B14R1.818 NC(=O)CC(=O)C=Cc1ccccc1 1458a_100000210462_100000187820 [0,1,1,0,0,0|1,0,0]=3 871 B14R1.818 NC(=O)CC(=O)C=Cc1ccccn1 1458a_100000740811_100000187820 [0,1,1,0,0,0|2,0,0]=4 872 B14R1.818 NC(=O)CC(=O)C=Cc1cccnc1 1458a_100000735890_100000187820 [0,1,1,0,0,0|2,0,0]=4 873 B14R1.818 NC(=O)CC(=O)C=Cc1ccncc1 1458a_100000682801_100000187820 [0,1,1,0,0,0|2,0,0]=4 874 B14R1.818 NC(=O)CC(=O)CCc1ccccc1 1458a_100000185753_100000187820 [0,1,1,0,0,0|1,0,1]=4 875 B14R1.818 NC(=O)CC(=O)CCc1ccccc1 1458a_100134613110_100000765856 [0,1,1,0,0,0|1,0,1]=4 876 B14R1.818 NC(=O)CC(=O)COc1ccccc1 1458a_100000186222_100000187820 [0,1,1,0,0,0|1,0,1]=4 877 B14R1.818 NC(=O)CC(=O)CSc1ccccc1 1458a_100000211596_100000187820 [0,1,1,0,0,0|1,0,1]=4 878 B14R1.818 NC(=O)CC(=O)NCc1ccccc1 240690a_100015324214_100134613110 [0,1,1,0,0,0|2,0,0]=4 879 B14R1.818 NC(=O)CC(=O)NCc1ccccc1 527a_100015324214_100134613110 [0,1,1,0,0,0|2,0,0]=4 880 B14R1.818 NC(=O)CC(=O)NNc1ccccc1 22a_100015195140_100134613110 [0,1,1,0,0,0|1,0,0]=3 881 B14R1.818 NC(=O)CC(=O)NNc1ccccn1 22a_100000183288_100134613110 [0,1,1,0,0,0|2,0,0]=4 882 B14R1.818 NC(=O)CC(=O)NNc1cccnc1 22a_100000728903_100134613110 [0,1,1,0,0,0|2,0,0]=4 883 B14R1.818 NC(=O)CC(=O)NNc1ccncc1 22a_100000698918_100134613110 [0,1,1,0,0,0|2,0,0]=4 884 B14R1.818 O=C([O-])CC(=O)C=Cc1ccccc1 1458a_100000210462_100020667443 [0,1,1,0,0,0|2,0,0]=4 885 B14R1.515 C=CCN(CC(=O)N)c1ccccc1 2230a_100000211662_100000747473 [0,1,1,0,0,0|2,0,0]=4 886 B14R1.515 C=CCN(CC(=O)N)c1ccccc1 2230a_100000212578_100000210623 [0,1,1,0,0,0|2,0,0]=4 887 B14R1.515 C=CCN(CC(=O)N)c1ccccc1 269982a_100000211662_100000187820 [0,1,1,0,0,0|2,0,0]=4 888 B14R1.515 C=CCN(CC(=O)N)c1ccccc1 269982a_100000212578_100000210623 [0,1,1,0,0,0|2,0,0]=4 889 B14R1.515 C=CCN(CC(=O)N)c1ccccc1 34a_100000211662_100000187820 [0,1,1,0,0,0|2,0,0]=4 890 B14R1.515 NC(=O)CN(CC=O)c1ccccc1 2230a_100000212578_200015260668 [0,1,1,0,0,0|2,0,0]=4 891 B14R1.515 NC(=O)CN(CC=O)c1ccccc1 269982a_100000212578_200015260668 [0,1,1,0,0,0|2,0,0]=4 892 B14R1.6455 CC(=O)N(CC(=O)N)c1ccccc1 11a_100000212578_100015343762 [0,1,1,0,0,0|2,0,0]=4 893 B14R1.6455 CC(=O)N(CC(=O)N)c1ccccc1 1626a_100000212578_100015343762 [0,1,1,0,0,0|2,0,0]=4 894 B14R2.3 C=CCOc1csc2c1cccc2 34a_100000077758_100015514636 [1,1,0,0,0,0|2,0,0]=4 895 B14R2.3 C=CCOc1csc2c1cccc2 7a_100000077758_100015514636 [1,1,0,0,0,0|2,0,0]=4 896 B14R2.3 C=CCSc1c[nH]c2c1cccn2 62a_100000210623_100011934613 [1,1,0,0,0,0|2,0,0]=4 897 B14R2.3 C=CCSc1c[nH]c2c1ccnc2 62a_100000210623_100010232032 [1,1,0,0,0,0|2,0,0]=4 898 B14R2.3 C=CCSc1c[nH]c2c1cncc2 62a_100000210623_100000753697 [1,1,0,0,0,0|2,0,0]=4 899 B14R2.3 C=CCSc1c[nH]c2c1nccc2 62a_100000210623_100009817151 [1,1,0,0,0,0|2,0,0]=4 900 B14R2.3 C=CCSc1coc2c1cccc2 62a_100000210623_100009812202 [1,1,0,0,0,0|2,0,0]=4 901 B14R2.3 C=CCSc1csc2c1cccc2 62a_100000210623_100009813928 [1,1,0,0,0,0|2,0,0]=4 902 B14R2.3 C=CCSc1n[nH]c2c1cccc2 62a_100000210623_100000050141 [1,1,0,0,0,0|2,0,0]=4 903 B14R2.3 CNCCc1c[nH]c2c1cccc2 2230a_100000211132_200000210301 [1,1,0,0,0,0|0,0,1]=3 904 B14R2.3 CNCCc1c[nH]c2c1cccc2 2230a_106832991635_100011218569 [1,1,0,0,0,0|0,0,1]=3 905 B14R2.3 CNCCc1c[nH]c2c1cccc2 34a_100102657272_100011218569 [1,1,0,0,0,0|0,0,1]=3 906 B14R2.3 CNCCc1c[nH]c2c1cccc2 7a_106832991635_100011218569 [1,1,0,0,0,0|0,0,1]=3 907 B14R2.3 CNCCc1c[nH]c2c1cccn2 2230a_106832991635_100009895007 [1,1,0,0,0,0|1,0,1]=4 908 B14R2.3 CNCCc1c[nH]c2c1cccn2 7a_106832991635_100009895007 [1,1,0,0,0,0|1,0,1]=4 909 B14R2.3 CNCCc1coc2c1cccc2 2230a_100011934666_200000210301 [1,1,0,0,0,0|1,0,1]=4 910 B14R2.3 CNCCc1coc2c1cccc2 34a_100011934666_200000210301 [1,1,0,0,0,0|1,0,1]=4 911 B14R2.3 COCCc1c[nH]c2c1cccc2 34a_100000752351_200000210301 [1,1,0,0,0,0|0,0,2]=4 912 B14R2.3 COCCc1c[nH]c2c1cccc2 34a_100138415774_100011218569 [1,1,0,0,0,0|0,0,2]=4 913 B14R2.3 CSCCc1c[nH]c2c1cccc2 62a_200000210301_100011218569 [1,1,0,0,0,0|0,1,1]=4 914 B14R2.3 O=CCOc1csc2c1cccc2 34a_100000077758_200009817547 [1,1,0,0,0,0|1,0,0]=3 915 B14R2.3 O=CCOc1csc2c1cccc2 7a_100000077758_200015260668 [1,1,0,0,0,0|1,0,0]=3 916 B14R2.3 O=CCSc1c[nH]c2c1cccn2 62a_200015260668_100011934613 [1,1,0,0,0,0|1,0,0]=3 917 B14R2.3 O=CCSc1c[nH]c2c1ccnc2 62a_200015260668_100010232032 [1,1,0,0,0,0|1,0,0]=3 918 B14R2.3 O=CCSc1c[nH]c2c1cncc2 62a_200015260668_100000753697 [1,1,0,0,0,0|1,0,0]=3 919 B14R2.3 O=CCSc1c[nH]c2c1cncn2 62a_100009817560_200015260668 [1,1,0,0,0,0|2,0,0]=4 920 B14R2.3 O=CCSc1c[nH]c2c1cncn2 62a_200015260668_100000072862 [1,1,0,0,0,0|2,0,0]=4 921 B14R2.3 O=CCSc1c[nH]c2c1nccc2 62a_200015260668_100009817151 [1,1,0,0,0,0|1,0,0]=3 922 B14R2.3 O=CCSc1c[nH]c2c1nccn2 62a_200015260668_100009819587 [1,1,0,0,0,0|2,0,0]=4 923 B14R2.3 O=CCSc1cnc2n1cccc2 62a_200015260668_100011219245 [1,1,0,0,0,0|1,0,1]=4 924 B14R2.3 O=CCSc1cnn2c1cccc2 62a_200015260668_100009817726 [1,1,0,0,0,0|1,0,1]=4 925 B14R2.3 O=CCSc1coc2c1cccc2 62a_200015260668_100009812202 [1,1,0,0,0,0|1,0,0]=3 926 B14R2.3 O=CCSc1coc2c1nccc2 62a_200015260668_100009889148 [1,1,0,0,0,0|2,0,0]=4 927 B14R2.3 O=CCSc1csc2c1cccc2 62a_200015260668_100009813928 [1,1,0,0,0,0|1,0,0]=3 928 B14R2.3 O=CCSc1csc2c1cccn2 62a_100009830249_200015260668 [1,1,0,0,0,0|2,0,0]=4 929 B14R2.3 O=CCSc1csc2c1cccn2 62a_200015260668_100009830249 [1,1,0,0,0,0|2,0,0]=4 930 B14R2.3 O=CCSc1csc2c1ccnc2 62a_100009817111_200015260668 [1,1,0,0,0,0|2,0,0]=4 931 B14R2.3 O=CCSc1csc2c1ccnc2 62a_200015260668_100009817111 [1,1,0,0,0,0|2,0,0]=4 932 B14R2.3 O=CCSc1csc2c1cncc2 62a_100010247091_200015260668 [1,1,0,0,0,0|2,0,0]=4 933 B14R2.3 O=CCSc1csc2c1cncc2 62a_200015260668_100010247091 [1,1,0,0,0,0|2,0,0]=4 934 B14R2.3 O=CCSc1csc2c1nccc2 62a_200015260668_100010247092 [1,1,0,0,0,0|2,0,0]=4 935 B14R2.3 O=CCSc1n[nH]c2c1cccc2 62a_200015260668_100000050141 [1,1,0,0,0,0|1,0,0]=3 936 B14R2.3 O=CCSc1n[nH]c2c1cccn2 62a_200015260668_100009888962 [1,1,0,0,0,0|2,0,0]=4 937 B14R2.3 O=CCSc1n[nH]c2c1ccnc2 62a_200015260668_100010244369 [1,1,0,0,0,0|2,0,0]=4 938 B14R2.3 O=CCSc1n[nH]c2c1cncc2 62a_200015260668_100009820117 [1,1,0,0,0,0|2,0,0]=4 939 B14R2.3 O=CCSc1n[nH]c2c1nccc2 62a_200015260668_100009817118 [1,1,0,0,0,0|2,0,0]=4 940 B14R2.3 O=CCSc1noc2c1cccc2 62a_200000703156_200015260668 [1,1,0,0,0,0|2,0,0]=4 941 B14R2.3 O=CCSc1noc2c1cccc2 62a_200015260668_200000703156 [1,1,0,0,0,0|2,0,0]=4 942 B14R2.3 [13CH3]NCCc1c[nH]c2c1cccc2 2230a_100000211132_200025704644 [1,1,0,0,0,0|0,0,1]=3 943 B14R2.3 [13CH3]NCCc1coc2c1cccc2 2230a_100011934666_200025704644 [1,1,0,0,0,0|1,0,1]=4 944 B14R2.3 [13CH3]NCCc1coc2c1cccc2 34a_100011934666_200025704644 [1,1,0,0,0,0|1,0,1]=4 945 B14R2.3 [13CH3]OCCc1c[nH]c2c1cccc2 34a_100000752351_200025704644 [1,1,0,0,0,0|0,0,2]=4 946 B14R2.3 [13CH3]SCCc1c[nH]c2c1cccc2 62a_200025704644_100011218569 [1,1,0,0,0,0|0,1,1]=4 947 B14R2.7 CNCc1c[nH]c2c1cccc2Br 270004a_106832991635_100009814786 [1,1,0,0,0,0|2,0,0]=4 948 B14R2.7 CNCc1c[nH]c2c1cccc2C 270004a_106832991635_100000040139 [1,1,0,0,0,0|2,0,0]=4 949 B14R2.7 CNCc1c[nH]c2c1cccc2Cl 270004a_106832991635_100011361501 [1,1,0,0,0,0|2,0,0]=4 950 B14R2.467 N#CCc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100000690303 [1,1,0,0,0,0|0,0,2]=4 951 B14R2.467 OCCc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010243507 [1,1,0,0,0,0|0,0,2]=4 952 B14R2.510 CNCc1cn(c2c1cccc2)C 34a_100011997738_200000210301 [1,1,0,0,0,0|2,0,0]=4 953 B14R2.510 Cn1cc(c2c1cccc2)CN[13CH3] 34a_100011997738_200025704644 [1,1,0,0,0,0|2,0,0]=4 954 B14R2.6368 N#CCc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100000693483 [1,1,0,0,0,0|0,0,2]=4 955 B14R2.6368 OCCc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100010188552 [1,1,0,0,0,0|0,0,2]=4 956 B14R2.6419 NCCc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100016990496 [1,1,0,0,0,0|0,0,1]=3 957 B14R2.6419 NCCc1csc2c1cc(cc2)O 271570a_203496583355_100016989105 [1,1,0,0,0,0|1,0,1]=4 958 B14R2.6419 OCCc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100011933977 [1,1,0,0,0,0|0,0,2]=4 959 B14R2.5816 CC(=O)c1c[nH]c2c1cc(cc2)O 271570a_203496583355_100000731263 [0,1,0,0,1,0|1,0,0]=3 960 B14R2.5816 CC(=O)c1c[nH]c2c1cc(cn2)O 271570a_203496583355_100012343711 [0,1,0,0,1,0|2,0,0]=4 961 B14R2.5816 CC(=O)c1c[nH]c2c1cc(nc2)O 271570a_203496583355_100010761600 [0,1,0,0,1,0|2,0,0]=4 962 B14R2.5816 CC(=O)c1csc2c1cc(cc2)O 271570a_203496583355_100010167055 [0,1,0,0,1,0|2,0,0]=4 963 B14R2.5816 CC(=O)c1n[nH]c2c1cc(cc2)O 271570a_203496583355_100010178523 [0,1,0,0,1,0|2,0,0]=4 964 B14R2.5816 NC(=O)c1cnc2n1cc(cc2)O 271570a_203496583355_100030059705 [0,1,0,0,1,0|1,0,1]=4 965 B14R2.8032 CC(=O)c1c[nH]c2c1cccc2O 271570a_203496583355_100010272396 [0,1,0,0,1,0|1,0,0]=3 966 B14R2.8053 CC(=O)c1c[nH]c2c1c(ccn2)O 271570a_203496583355_100012185045 [0,1,0,0,1,0|2,0,0]=4 967 B16R2.12 CC(=O)C(C)Oc1csc2c1cccc2 7a_100000077758_100000179758 [0,1,0,0,0,1|2,0,0]=4 968 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1cccn2 62a_100009814033_100011934613 [0,1,0,0,0,1|2,0,0]=4 969 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1ccnc2 62a_100009814033_100010232032 [0,1,0,0,0,1|2,0,0]=4 970 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1cncc2 62a_100009814033_100000753697 [0,1,0,0,0,1|2,0,0]=4 971 B16R2.12 CC(=O)C(C)Sc1c[nH]c2c1nccc2 62a_100009814033_100009817151 [0,1,0,0,0,1|2,0,0]=4 972 B16R2.12 CC(=O)C(C)Sc1coc2c1cccc2 62a_100009814033_100009812202 [0,1,0,0,0,1|2,0,0]=4 973 B16R2.12 CC(=O)C(C)Sc1csc2c1cccc2 62a_100009814033_100009813928 [0,1,0,0,0,1|2,0,0]=4 974 B16R2.12 CC(=O)C(C)Sc1n[nH]c2c1cccc2 62a_100009814033_100000050141 [0,1,0,0,0,1|2,0,0]=4 975 B16R2.12 CC(Oc1csc2c1cccc2)C(=O)N 34a_100000077758_100000702099 [0,1,0,0,0,1|1,0,0]=3 976 B16R2.12 CC(Oc1csc2c1cccc2)C(=O)N 7a_100000077758_100000702099 [0,1,0,0,0,1|1,0,0]=3 977 B16R2.12 CC(Sc1c[nH]c2c1cccn2)C(=O)N 62a_100000702099_100011934613 [0,1,0,0,0,1|1,0,0]=3 978 B16R2.12 CC(Sc1c[nH]c2c1ccnc2)C(=O)N 62a_100000702099_100010232032 [0,1,0,0,0,1|1,0,0]=3 979 B16R2.12 CC(Sc1c[nH]c2c1cncc2)C(=O)N 62a_100000702099_100000753697 [0,1,0,0,0,1|1,0,0]=3 980 B16R2.12 CC(Sc1c[nH]c2c1cncn2)C(=O)N 62a_100000702099_100000072862 [0,1,0,0,0,1|2,0,0]=4 981 B16R2.12 CC(Sc1c[nH]c2c1cncn2)C(=O)N 62a_100009817560_100000702099 [0,1,0,0,0,1|2,0,0]=4 982 B16R2.12 CC(Sc1c[nH]c2c1nccc2)C(=O)N 62a_100000702099_100009817151 [0,1,0,0,0,1|1,0,0]=3 983 B16R2.12 CC(Sc1c[nH]c2c1nccn2)C(=O)N 62a_100000702099_100009819587 [0,1,0,0,0,1|2,0,0]=4 984 B16R2.12 CC(Sc1cnc2n1cccc2)C(=O)N 62a_100000702099_100011219245 [0,1,0,0,0,1|1,0,1]=4 985 B16R2.12 CC(Sc1cnn2c1cccc2)C(=O)N 62a_100000702099_100009817726 [0,1,0,0,0,1|1,0,1]=4 986 B16R2.12 CC(Sc1coc2c1cccc2)C(=O)N 62a_100000702099_100009812202 [0,1,0,0,0,1|1,0,0]=3 987 B16R2.12 CC(Sc1coc2c1nccc2)C(=O)N 62a_100000702099_100009889148 [0,1,0,0,0,1|2,0,0]=4 988 B16R2.12 CC(Sc1csc2c1cccc2)C(=O)N 62a_100000702099_100009813928 [0,1,0,0,0,1|1,0,0]=3 989 B16R2.12 CC(Sc1csc2c1cccn2)C(=O)N 62a_100000702099_100009830249 [0,1,0,0,0,1|2,0,0]=4 990 B16R2.12 CC(Sc1csc2c1cccn2)C(=O)N 62a_100009830249_100000702099 [0,1,0,0,0,1|2,0,0]=4 991 B16R2.12 CC(Sc1csc2c1ccnc2)C(=O)N 62a_100000702099_100009817111 [0,1,0,0,0,1|2,0,0]=4 992 B16R2.12 CC(Sc1csc2c1ccnc2)C(=O)N 62a_100009817111_100000702099 [0,1,0,0,0,1|2,0,0]=4 993 B16R2.12 CC(Sc1csc2c1cncc2)C(=O)N 62a_100000702099_100010247091 [0,1,0,0,0,1|2,0,0]=4 994 B16R2.12 CC(Sc1csc2c1cncc2)C(=O)N 62a_100010247091_100000702099 [0,1,0,0,0,1|2,0,0]=4 995 B16R2.12 CC(Sc1csc2c1nccc2)C(=O)N 62a_100000702099_100010247092 [0,1,0,0,0,1|2,0,0]=4 996 B16R2.12 CC(Sc1n[nH]c2c1cccc2)C(=O)N 62a_100000702099_100000050141 [0,1,0,0,0,1|1,0,0]=3 997 B16R2.12 CC(Sc1n[nH]c2c1cccn2)C(=O)N 62a_100000702099_100009888962 [0,1,0,0,0,1|2,0,0]=4 998 B16R2.12 CC(Sc1n[nH]c2c1ccnc2)C(=O)N 62a_100000702099_100010244369 [0,1,0,0,0,1|2,0,0]=4 999 B16R2.12 CC(Sc1n[nH]c2c1cncc2)C(=O)N 62a_100000702099_100009820117 [0,1,0,0,0,1|2,0,0]=4 1000 B16R2.12 CC(Sc1n[nH]c2c1nccc2)C(=O)N 62a_100000702099_100009817118 [0,1,0,0,0,1|2,0,0]=4 1001 B16R2.12 CC(Sc1noc2c1cccc2)C(=O)N 62a_100000702099_200000703156 [0,1,0,0,0,1|2,0,0]=4 1002 B16R2.12 CC(Sc1noc2c1cccc2)C(=O)N 62a_200000703156_100000702099 [0,1,0,0,0,1|2,0,0]=4 1003 B16R2.12 C[C@@H](Nc1n[nH]c2c1cccn2)C(=O)N 27a_100000119354_100009818534 [0,1,0,0,0,1|2,0,0]=4 1004 B16R2.12 C[C@@H](Nc1n[nH]c2c1cncc2)C(=O)N 27a_100000119354_100009820117 [0,1,0,0,0,1|2,0,0]=4 1005 B16R2.12 C[C@@H](Nc1n[nH]c2c1nccc2)C(=O)N 27a_100000119354_100009817118 [0,1,0,0,0,1|2,0,0]=4 1006 B16R2.12 NC(=O)C(F)Oc1csc2c1cccc2 34a_100000077758_100009813875 [0,1,0,0,0,1|1,0,0]=3 1007 B16R2.12 NC(=O)C(F)Oc1csc2c1cccc2 7a_100000077758_100009813875 [0,1,0,0,0,1|1,0,0]=3 1008 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1cccn2 62a_100009813875_100011934613 [0,1,0,0,0,1|1,0,0]=3 1009 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1ccnc2 62a_100009813875_100010232032 [0,1,0,0,0,1|1,0,0]=3 1010 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1cncc2 62a_100009813875_100000753697 [0,1,0,0,0,1|1,0,0]=3 1011 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1cncn2 62a_100009813875_100000072862 [0,1,0,0,0,1|2,0,0]=4 1012 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1cncn2 62a_100009817560_100009813875 [0,1,0,0,0,1|2,0,0]=4 1013 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1nccc2 62a_100009813875_100009817151 [0,1,0,0,0,1|1,0,0]=3 1014 B16R2.12 NC(=O)C(F)Sc1c[nH]c2c1nccn2 62a_100009813875_100009819587 [0,1,0,0,0,1|2,0,0]=4 1015 B16R2.12 NC(=O)C(F)Sc1cnc2n1cccc2 62a_100009813875_100011219245 [0,1,0,0,0,1|1,0,1]=4 1016 B16R2.12 NC(=O)C(F)Sc1cnn2c1cccc2 62a_100009813875_100009817726 [0,1,0,0,0,1|1,0,1]=4 1017 B16R2.12 NC(=O)C(F)Sc1coc2c1cccc2 62a_100009813875_100009812202 [0,1,0,0,0,1|1,0,0]=3 1018 B16R2.12 NC(=O)C(F)Sc1coc2c1nccc2 62a_100009813875_100009889148 [0,1,0,0,0,1|2,0,0]=4 1019 B16R2.12 NC(=O)C(F)Sc1csc2c1cccc2 62a_100009813875_100009813928 [0,1,0,0,0,1|1,0,0]=3 1020 B16R2.12 NC(=O)C(F)Sc1csc2c1cccn2 62a_100009813875_100009830249 [0,1,0,0,0,1|2,0,0]=4 1021 B16R2.12 NC(=O)C(F)Sc1csc2c1cccn2 62a_100009830249_100009813875 [0,1,0,0,0,1|2,0,0]=4 1022 B16R2.12 NC(=O)C(F)Sc1csc2c1ccnc2 62a_100009813875_100009817111 [0,1,0,0,0,1|2,0,0]=4 1023 B16R2.12 NC(=O)C(F)Sc1csc2c1ccnc2 62a_100009817111_100009813875 [0,1,0,0,0,1|2,0,0]=4 1024 B16R2.12 NC(=O)C(F)Sc1csc2c1cncc2 62a_100009813875_100010247091 [0,1,0,0,0,1|2,0,0]=4 1025 B16R2.12 NC(=O)C(F)Sc1csc2c1cncc2 62a_100010247091_100009813875 [0,1,0,0,0,1|2,0,0]=4 1026 B16R2.12 NC(=O)C(F)Sc1csc2c1nccc2 62a_100009813875_100010247092 [0,1,0,0,0,1|2,0,0]=4 1027 B16R2.12 NC(=O)C(F)Sc1n[nH]c2c1cccc2 62a_100009813875_100000050141 [0,1,0,0,0,1|1,0,0]=3 1028 B16R2.12 NC(=O)C(F)Sc1n[nH]c2c1cccn2 62a_100009813875_100009888962 [0,1,0,0,0,1|2,0,0]=4 1029 B16R2.12 NC(=O)C(F)Sc1n[nH]c2c1ccnc2 62a_100009813875_100010244369 [0,1,0,0,0,1|2,0,0]=4 1030 B16R2.12 NC(=O)C(F)Sc1n[nH]c2c1cncc2 62a_100009813875_100009820117 [0,1,0,0,0,1|2,0,0]=4 1031 B16R2.12 NC(=O)C(F)Sc1n[nH]c2c1nccc2 62a_100009813875_100009817118 [0,1,0,0,0,1|2,0,0]=4 1032 B16R2.12 NC(=O)C(F)Sc1noc2c1cccc2 62a_100009813875_200000703156 [0,1,0,0,0,1|2,0,0]=4 1033 B16R2.12 NC(=O)C(F)Sc1noc2c1cccc2 62a_200000703156_100009813875 [0,1,0,0,0,1|2,0,0]=4 1034 B16R2.12 O=C([O-])C(F)Oc1csc2c1cccc2 34a_100000077758_100020610796 [0,1,0,0,0,1|2,0,0]=4 1035 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1cccn2 62a_100020610796_100011934613 [0,1,0,0,0,1|2,0,0]=4 1036 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1ccnc2 62a_100020610796_100010232032 [0,1,0,0,0,1|2,0,0]=4 1037 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1cncc2 62a_100020610796_100000753697 [0,1,0,0,0,1|2,0,0]=4 1038 B16R2.12 O=C([O-])C(F)Sc1c[nH]c2c1nccc2 62a_100020610796_100009817151 [0,1,0,0,0,1|2,0,0]=4 1039 B16R2.12 O=C([O-])C(F)Sc1coc2c1cccc2 62a_100020610796_100009812202 [0,1,0,0,0,1|2,0,0]=4 1040 B16R2.12 O=C([O-])C(F)Sc1csc2c1cccc2 62a_100020610796_100009813928 [0,1,0,0,0,1|2,0,0]=4 1041 B16R2.12 O=C([O-])C(F)Sc1n[nH]c2c1cccc2 62a_100020610796_100000050141 [0,1,0,0,0,1|2,0,0]=4 1042 B16R2.14 C#CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211873_100011218569 [0,1,0,0,0,1|1,0,0]=3 1043 B16R2.14 C#CC(=O)CCc1c[nH]c2c1cccn2 1458a_100000211873_100009895007 [0,1,0,0,0,1|2,0,0]=4 1044 B16R2.14 C=CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000185746_100011218569 [0,1,0,0,0,1|1,0,0]=3 1045 B16R2.14 C=CC(=O)CCc1c[nH]c2c1cccn2 1458a_100000185746_100009895007 [0,1,0,0,0,1|2,0,0]=4 1046 B16R2.14 C=CC(=O)NCc1c[nH]c2c1cccc2 240690a_100015202335_200121576911 [0,1,0,0,0,1|1,0,0]=3 1047 B16R2.14 C=CC(=O)NCc1csc2c1cccc2 1626a_100000744611_100000185746 [0,1,0,0,0,1|2,0,0]=4 1048 B16R2.14 C=CC(=O)NCc1csc2c1cccc2 240690a_100000744611_200121576911 [0,1,0,0,0,1|2,0,0]=4 1049 B16R2.14 CCC(=O)C=Cc1c[nH]c2c1cccc2 1458a_100016263948_100000210202 [0,1,0,0,0,1|1,0,1]=4 1050 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccc2 1458a_100000210414_100011218569 [0,1,0,0,0,1|1,0,0]=3 1051 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_100000210202 [0,1,0,0,0,1|1,0,0]=3 1052 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccn2 1458a_100000210414_100009895007 [0,1,0,0,0,1|2,0,0]=4 1053 B16R2.14 CCC(=O)CCc1c[nH]c2c1cccn2 1458a_100102525369_100000210202 [0,1,0,0,0,1|2,0,0]=4 1054 B16R2.14 CCC(=O)COc1csc2c1cccc2 7a_100000077758_100000747405 [0,1,0,0,0,1|2,0,0]=4 1055 B16R2.14 CCC(=O)CSc1c[nH]c2c1cccn2 62a_100000747405_100011934613 [0,1,0,0,0,1|2,0,0]=4 1056 B16R2.14 CCC(=O)CSc1c[nH]c2c1ccnc2 62a_100000747405_100010232032 [0,1,0,0,0,1|2,0,0]=4 1057 B16R2.14 CCC(=O)CSc1c[nH]c2c1cncc2 62a_100000747405_100000753697 [0,1,0,0,0,1|2,0,0]=4 1058 B16R2.14 CCC(=O)CSc1c[nH]c2c1nccc2 62a_100000747405_100009817151 [0,1,0,0,0,1|2,0,0]=4 1059 B16R2.14 CCC(=O)CSc1coc2c1cccc2 62a_100000747405_100009812202 [0,1,0,0,0,1|2,0,0]=4 1060 B16R2.14 CCC(=O)CSc1csc2c1cccc2 62a_100000747405_100009813928 [0,1,0,0,0,1|2,0,0]=4 1061 B16R2.14 CCC(=O)CSc1n[nH]c2c1cccc2 62a_100000747405_100000050141 [0,1,0,0,0,1|2,0,0]=4 1062 B16R2.14 CCC(=O)NCc1c[nH]c2c1cccc2 240690a_100015202335_100000210414 [0,1,0,0,0,1|1,0,0]=3 1063 B16R2.14 CCC(=O)NCc1c[nH]c2c1cccc2 527a_100015202335_100000210414 [0,1,0,0,0,1|1,0,0]=3 1064 B16R2.14 CCC(=O)NCc1csc2c1cccc2 11a_100000744611_100000210414 [0,1,0,0,0,1|2,0,0]=4 1065 B16R2.14 CCC(=O)NCc1csc2c1cccc2 1626a_100000744611_100000210414 [0,1,0,0,0,1|2,0,0]=4 1066 B16R2.14 CCC(=O)NCc1csc2c1cccc2 240690a_100000744611_100000210414 [0,1,0,0,0,1|2,0,0]=4 1067 B16R2.14 CCC(=O)NCc1csc2c1cccc2 527a_100000744611_100000210414 [0,1,0,0,0,1|2,0,0]=4 1068 B16R2.14 CNC(=O)C=Cc1c[nH]c2c1cccc2 240690a_100102657272_100016263948 [0,1,0,0,0,1|0,0,1]=3 1069 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 11a_106832991635_100000211458 [0,1,0,0,0,1|0,0,0]=2 1070 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 1626a_100102657272_100000211458 [0,1,0,0,0,1|0,0,0]=2 1071 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 240690a_100102657272_100000211458 [0,1,0,0,0,1|0,0,0]=2 1072 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 527a_100102657272_100000211458 [0,1,0,0,0,1|0,0,0]=2 1073 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccn2 11a_106832991635_100102525369 [0,1,0,0,0,1|1,0,0]=3 1074 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccn2 240690a_100102657272_100102525369 [0,1,0,0,0,1|1,0,0]=3 1075 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccn2 527a_100102657272_100102525369 [0,1,0,0,0,1|1,0,0]=3 1076 B16R2.14 CNC(=O)CCn1ccc2c1cccc2 11a_106832991635_100000186764 [0,1,0,0,0,1|2,0,0]=4 1077 B16R2.14 CNC(=O)CCn1ccc2c1cccc2 1626a_100102657272_100000186764 [0,1,0,0,0,1|2,0,0]=4 1078 B16R2.14 CNC(=O)CCn1ccc2c1cccc2 527a_100102657272_100000186764 [0,1,0,0,0,1|2,0,0]=4 1079 B16R2.14 CNC(=O)CCn1cnc2c1cccc2 240690a_100102657272_100000177575 [0,1,0,0,0,1|1,0,1]=4 1080 B16R2.14 CNC(=O)CCn1cnc2c1cccc2 527a_100102657272_100000177575 [0,1,0,0,0,1|1,0,1]=4 1081 B16R2.14 CNC(=O)CNc1n[nH]c2c1cccn2 27a_100000693194_100009818534 [0,1,0,0,0,1|2,0,0]=4 1082 B16R2.14 CNC(=O)CNc1n[nH]c2c1cncc2 27a_100000693194_100009820117 [0,1,0,0,0,1|2,0,0]=4 1083 B16R2.14 CNC(=O)CNc1n[nH]c2c1nccc2 27a_100000693194_100009817118 [0,1,0,0,0,1|2,0,0]=4 1084 B16R2.14 CNC(=O)COc1csc2c1cccc2 34a_100000077758_100000183359 [0,1,0,0,0,1|1,0,0]=3 1085 B16R2.14 CNC(=O)COc1csc2c1cccc2 7a_100000077758_100000183359 [0,1,0,0,0,1|1,0,0]=3 1086 B16R2.14 CNC(=O)CSc1c[nH]c2c1cccn2 62a_100000183359_100011934613 [0,1,0,0,0,1|1,0,0]=3 1087 B16R2.14 CNC(=O)CSc1c[nH]c2c1ccnc2 62a_100000183359_100010232032 [0,1,0,0,0,1|1,0,0]=3 1088 B16R2.14 CNC(=O)CSc1c[nH]c2c1cncc2 62a_100000183359_100000753697 [0,1,0,0,0,1|1,0,0]=3 1089 B16R2.14 CNC(=O)CSc1c[nH]c2c1cncn2 62a_100000183359_100000072862 [0,1,0,0,0,1|2,0,0]=4 1090 B16R2.14 CNC(=O)CSc1c[nH]c2c1cncn2 62a_100009817560_100000183359 [0,1,0,0,0,1|2,0,0]=4 1091 B16R2.14 CNC(=O)CSc1c[nH]c2c1nccc2 62a_100000183359_100009817151 [0,1,0,0,0,1|1,0,0]=3 1092 B16R2.14 CNC(=O)CSc1c[nH]c2c1nccn2 62a_100000183359_100009819587 [0,1,0,0,0,1|2,0,0]=4 1093 B16R2.14 CNC(=O)CSc1cnc2n1cccc2 62a_100000183359_100011219245 [0,1,0,0,0,1|1,0,1]=4 1094 B16R2.14 CNC(=O)CSc1cnn2c1cccc2 62a_100000183359_100009817726 [0,1,0,0,0,1|1,0,1]=4 1095 B16R2.14 CNC(=O)CSc1coc2c1cccc2 62a_100000183359_100009812202 [0,1,0,0,0,1|1,0,0]=3 1096 B16R2.14 CNC(=O)CSc1coc2c1nccc2 62a_100000183359_100009889148 [0,1,0,0,0,1|2,0,0]=4 1097 B16R2.14 CNC(=O)CSc1csc2c1cccc2 62a_100000183359_100009813928 [0,1,0,0,0,1|1,0,0]=3 1098 B16R2.14 CNC(=O)CSc1csc2c1cccn2 62a_100000183359_100009830249 [0,1,0,0,0,1|2,0,0]=4 1099 B16R2.14 CNC(=O)CSc1csc2c1cccn2 62a_100009830249_100000183359 [0,1,0,0,0,1|2,0,0]=4 1100 B16R2.14 CNC(=O)CSc1csc2c1ccnc2 62a_100000183359_100009817111 [0,1,0,0,0,1|2,0,0]=4 1101 B16R2.14 CNC(=O)CSc1csc2c1ccnc2 62a_100009817111_100000183359 [0,1,0,0,0,1|2,0,0]=4 1102 B16R2.14 CNC(=O)CSc1csc2c1cncc2 62a_100000183359_100010247091 [0,1,0,0,0,1|2,0,0]=4 1103 B16R2.14 CNC(=O)CSc1csc2c1cncc2 62a_100010247091_100000183359 [0,1,0,0,0,1|2,0,0]=4 1104 B16R2.14 CNC(=O)CSc1csc2c1nccc2 62a_100000183359_100010247092 [0,1,0,0,0,1|2,0,0]=4 1105 B16R2.14 CNC(=O)CSc1n[nH]c2c1cccc2 62a_100000183359_100000050141 [0,1,0,0,0,1|1,0,0]=3 1106 B16R2.14 CNC(=O)CSc1n[nH]c2c1cccn2 62a_100000183359_100009888962 [0,1,0,0,0,1|2,0,0]=4 1107 B16R2.14 CNC(=O)CSc1n[nH]c2c1ccnc2 62a_100000183359_100010244369 [0,1,0,0,0,1|2,0,0]=4 1108 B16R2.14 CNC(=O)CSc1n[nH]c2c1cncc2 62a_100000183359_100009820117 [0,1,0,0,0,1|2,0,0]=4 1109 B16R2.14 CNC(=O)CSc1n[nH]c2c1nccc2 62a_100000183359_100009817118 [0,1,0,0,0,1|2,0,0]=4 1110 B16R2.14 CNC(=O)CSc1noc2c1cccc2 62a_100000183359_200000703156 [0,1,0,0,0,1|2,0,0]=4 1111 B16R2.14 CNC(=O)CSc1noc2c1cccc2 62a_200000703156_100000183359 [0,1,0,0,0,1|2,0,0]=4 1112 B16R2.14 CNC(=O)NCc1[nH]nc2c1cccc2 2708a_100011642502_106832991635 [0,1,0,0,0,1|1,0,1]=4 1113 B16R2.14 CNC(=O)NCc1[nH]nc2c1cccc2 2708a_100102657272_100011642502 [0,1,0,0,0,1|1,0,1]=4 1114 B16R2.14 CNC(=O)NCc1[nH]nc2c1cccc2 273464a_100011642502_100102657272 [0,1,0,0,0,1|1,0,1]=4 1115 B16R2.14 CNC(=O)NCc1[nH]nc2c1cccc2 273464a_100102657272_100011642502 [0,1,0,0,0,1|1,0,1]=4 1116 B16R2.14 CNC(=O)NCc1[nH]nc2c1cccc2 512a_106832991638_100011642502 [0,1,0,0,0,1|1,0,1]=4 1117 B16R2.14 CNC(=O)NCc1c[nH]c2c1cccc2 2708a_100015202335_106832991635 [0,1,0,0,0,1|0,0,0]=2 1118 B16R2.14 CNC(=O)NCc1c[nH]c2c1cccc2 2708a_100102657272_100015202335 [0,1,0,0,0,1|0,0,0]=2 1119 B16R2.14 CNC(=O)NCc1c[nH]c2c1cccc2 273464a_100015202335_100102657272 [0,1,0,0,0,1|0,0,0]=2 1120 B16R2.14 CNC(=O)NCc1c[nH]c2c1cccc2 273464a_100102657272_100015202335 [0,1,0,0,0,1|0,0,0]=2 1121 B16R2.14 CNC(=O)NCc1c[nH]c2c1cccc2 512a_106832991638_100015202335 [0,1,0,0,0,1|0,0,0]=2 1122 B16R2.14 CNC(=O)NCc1cnc2n1cccc2 2708a_100015187830_106832991635 [0,1,0,0,0,1|1,0,1]=4 1123 B16R2.14 CNC(=O)NCc1cnc2n1cccc2 2708a_100102657272_100015187830 [0,1,0,0,0,1|1,0,1]=4 1124 B16R2.14 CNC(=O)NCc1cnc2n1cccc2 273464a_100015187830_100102657272 [0,1,0,0,0,1|1,0,1]=4 1125 B16R2.14 CNC(=O)NCc1cnc2n1cccc2 273464a_100102657272_100015187830 [0,1,0,0,0,1|1,0,1]=4 1126 B16R2.14 CNC(=O)NCc1cnc2n1cccc2 512a_106832991638_100015187830 [0,1,0,0,0,1|1,0,1]=4 1127 B16R2.14 CNC(=O)NCc1csc2c1cccc2 2708a_100000744611_106832991635 [0,1,0,0,0,1|1,0,0]=3 1128 B16R2.14 CNC(=O)NCc1csc2c1cccc2 2708a_100102657272_100000744611 [0,1,0,0,0,1|1,0,0]=3 1129 B16R2.14 CNC(=O)NCc1csc2c1cccc2 273464a_100000744611_100102657272 [0,1,0,0,0,1|1,0,0]=3 1130 B16R2.14 CNC(=O)NCc1csc2c1cccc2 273464a_100102657272_100000744611 [0,1,0,0,0,1|1,0,0]=3 1131 B16R2.14 CNC(=O)NCc1csc2c1cccc2 512a_100000744611_100102657272 [0,1,0,0,0,1|1,0,0]=3 1132 B16R2.14 CNC(=O)NCc1csc2c1cccc2 512a_106832991638_100000744611 [0,1,0,0,0,1|1,0,0]=3 1133 B16R2.14 CNC(C)CCc1c[nH]c2c1cccc2 270004a_106832991635_100102524982 [0,1,0,0,0,1|1,0,1]=4 1134 B16R2.14 COC(=O)COc1csc2c1cccc2 34a_100000077758_100000747449 [0,1,0,0,0,1|2,0,0]=4 1135 B16R2.14 COC(=O)COc1csc2c1cccc2 7a_100000077758_100000747449 [0,1,0,0,0,1|2,0,0]=4 1136 B16R2.14 COC(=O)CSc1c[nH]c2c1cccn2 62a_100000747449_100011934613 [0,1,0,0,0,1|2,0,0]=4 1137 B16R2.14 COC(=O)CSc1c[nH]c2c1ccnc2 62a_100000747449_100010232032 [0,1,0,0,0,1|2,0,0]=4 1138 B16R2.14 COC(=O)CSc1c[nH]c2c1cncc2 62a_100000747449_100000753697 [0,1,0,0,0,1|2,0,0]=4 1139 B16R2.14 COC(=O)CSc1c[nH]c2c1nccc2 62a_100000747449_100009817151 [0,1,0,0,0,1|2,0,0]=4 1140 B16R2.14 COC(=O)CSc1coc2c1cccc2 62a_100000747449_100009812202 [0,1,0,0,0,1|2,0,0]=4 1141 B16R2.14 COC(=O)CSc1csc2c1cccc2 62a_100000747449_100009813928 [0,1,0,0,0,1|2,0,0]=4 1142 B16R2.14 COC(=O)CSc1n[nH]c2c1cccc2 62a_100000747449_100000050141 [0,1,0,0,0,1|2,0,0]=4 1143 B16R2.14 O=C(C=Cc1c[nH]c2c1cccc2)CF 1458a_100016263948_100015361967 [0,1,0,0,0,1|1,0,1]=4 1144 B16R2.14 O=C(CF)CCc1c[nH]c2c1cccc2 1458a_100000211458_100015361967 [0,1,0,0,0,1|1,0,0]=3 1145 B16R2.14 O=C(CF)CCc1c[nH]c2c1cccn2 1458a_100102525369_100015361967 [0,1,0,0,0,1|2,0,0]=4 1146 B16R2.14 O=C(CO)CCc1c[nH]c2c1cccc2 1458a_100000210174_100011218569 [0,1,0,0,0,1|1,0,0]=3 1147 B16R2.14 O=C(CO)CCc1c[nH]c2c1cccn2 1458a_100000210174_100009895007 [0,1,0,0,0,1|2,0,0]=4 1148 B16R2.14 O=C(CO)NCc1c[nH]c2c1cccc2 240690a_100015202335_100000210174 [0,1,0,0,0,1|1,0,0]=3 1149 B16R2.14 O=C(CO)NCc1c[nH]c2c1cccc2 527a_100015202335_100000210174 [0,1,0,0,0,1|1,0,0]=3 1150 B16R2.14 O=C(CO)NCc1csc2c1cccc2 240690a_100000744611_100000210174 [0,1,0,0,0,1|2,0,0]=4 1151 B16R2.14 O=C(CO)NCc1csc2c1cccc2 527a_100000744611_100000210174 [0,1,0,0,0,1|2,0,0]=4 1152 B16R2.520 CC(=O)CC(=O)c1c[nH]c2c1cccc2 1458a_100000070787_100000183220 [0,1,0,0,0,1|1,0,0]=3 1153 B16R2.520 CC(=O)CC(=O)c1coc2c1cccc2 1458a_100000070787_100000233777 [0,1,0,0,0,1|2,0,0]=4 1154 B16R2.520 CC(=O)CC(=O)c1csc2c1cccc2 1458a_100000070787_100000689783 [0,1,0,0,0,1|2,0,0]=4 1155 B16R2.520 CN(CC(=O)N)c1n[nH]c2c1cccn2 27a_100000739694_100009818534 [0,1,0,0,0,1|2,0,0]=4 1156 B16R2.520 CN(CC(=O)N)c1n[nH]c2c1cncc2 27a_100000739694_100009820117 [0,1,0,0,0,1|2,0,0]=4 1157 B16R2.520 CN(CC(=O)N)c1n[nH]c2c1nccc2 27a_100000739694_100009817118 [0,1,0,0,0,1|2,0,0]=4 1158 B16R2.520 NC(=O)CC(=O)C1=CCc2c1cccc2 1458a_100000037392_100000187820 [0,1,0,0,0,1|1,0,0]=3 1159 B16R2.520 NC(=O)CC(=O)C1C=Cc2c1cccc2 1458a_200009832160_100000187820 [0,1,0,0,0,1|1,0,1]=4 1160 B16R2.520 O=C([O-])CC(=O)C1=CCc2c1cccc2 1458a_100000037392_100020667443 [0,1,0,0,0,1|2,0,0]=4 1161 B16R2.2947 CS(=O)(=O)NCc1c[nH]c2c1cccc2 40a_100015202335_100000738038 [0,1,0,0,0,1|2,0,0]=4 1162 B16R2.2947 NS(=O)(=O)CSc1c[nH]c2c1cccn2 62a_100000741382_100011934613 [0,1,0,0,0,1|2,0,0]=4 1163 B16R2.2947 NS(=O)(=O)CSc1c[nH]c2c1ccnc2 62a_100000741382_100010232032 [0,1,0,0,0,1|2,0,0]=4 1164 B16R2.2947 NS(=O)(=O)CSc1c[nH]c2c1cncc2 62a_100000741382_100000753697 [0,1,0,0,0,1|2,0,0]=4 1165 B16R2.2947 NS(=O)(=O)CSc1c[nH]c2c1nccc2 62a_100000741382_100009817151 [0,1,0,0,0,1|2,0,0]=4 1166 B16R2.2947 NS(=O)(=O)CSc1coc2c1cccc2 62a_100000741382_100009812202 [0,1,0,0,0,1|2,0,0]=4 1167 B16R2.2947 NS(=O)(=O)CSc1csc2c1cccc2 62a_100000741382_100009813928 [0,1,0,0,0,1|2,0,0]=4 1168 B16R2.2947 NS(=O)(=O)CSc1n[nH]c2c1cccc2 62a_100000741382_100000050141 [0,1,0,0,0,1|2,0,0]=4 1169 B16R2.2976 Cc1ccc2c(n[nH]c2c1)SCC(=O)N 62a_100000747473_100000049534 [0,1,0,0,0,1|1,0,0]=3 1170 B16R2.2976 Cc1ccc2c(n[nH]c2c1)SCC(=O)[O-] 62a_100020667443_100000049534 [0,1,0,0,0,1|2,0,0]=4 1171 B16R2.2976 Cc1ccn2c(cnc2c1)SCC(=O)N 62a_100000747473_100011934683 [0,1,0,0,0,1|1,0,1]=4 1172 B16R2.2976 NC(=O)CSc1c[nH]c2c1ccc(n2)Cl 62a_100000747473_100010168512 [0,1,0,0,0,1|1,0,0]=3 1173 B16R2.2976 NC(=O)CSc1c[nH]c2c1ccc(n2)F 62a_100000747473_100010168364 [0,1,0,0,0,1|1,0,0]=3 1174 B16R2.2976 NC(=O)CSc1c[nH]c2c1cnc(c2)Br 62a_100000747473_100010206817 [0,1,0,0,0,1|1,0,0]=3 1175 B16R2.2976 NC(=O)CSc1c[nH]c2c1cnc(c2)Br 62a_100010206817_100000747473 [0,1,0,0,0,1|1,0,0]=3 1176 B16R2.2976 NC(=O)CSc1c[nH]c2c1cnc(c2)Cl 62a_100000747473_100010206812 [0,1,0,0,0,1|1,0,0]=3 1177 B16R2.2976 NC(=O)CSc1c[nH]c2c1cnc(n2)Cl 62a_100000747473_100010173707 [0,1,0,0,0,1|2,0,0]=4 1178 B16R2.2976 NC(=O)CSc1c[nH]c2c1ncc(c2)Br 62a_100000747473_100010208019 [0,1,0,0,0,1|1,0,0]=3 1179 B16R2.2976 NC(=O)CSc1c[nH]c2c1ncc(c2)Br 62a_100010208019_100000747473 [0,1,0,0,0,1|1,0,0]=3 1180 B16R2.2976 NC(=O)CSc1cnc2n1ccc(c2)Br 62a_100000747473_100010730183 [0,1,0,0,0,1|1,0,1]=4 1181 B16R2.2976 NC(=O)CSc1cnc2n1ccc(c2)Br 62a_100010730183_100000747473 [0,1,0,0,0,1|1,0,1]=4 1182 B16R2.2976 NC(=O)CSc1cnc2n1ccc(c2)F 62a_100000747473_100020640160 [0,1,0,0,0,1|1,0,1]=4 1183 B16R2.2976 NC(=O)CSc1cnc2n1ccc(c2)F 62a_100020640160_100000747473 [0,1,0,0,0,1|1,0,1]=4 1184 B16R2.2976 NC(=O)CSc1n[nH]c2c1ccc(c2)Br 62a_100000747473_100010186045 [0,1,0,0,0,1|1,0,0]=3 1185 B16R2.2976 NC(=O)CSc1n[nH]c2c1ccc(c2)Br 62a_100010186045_100000747473 [0,1,0,0,0,1|1,0,0]=3 1186 B16R2.2976 NC(=O)CSc1n[nH]c2c1ccc(c2)Cl 62a_100000747473_100000049627 [0,1,0,0,0,1|1,0,0]=3 1187 B16R2.2976 NC(=O)CSc1n[nH]c2c1ccc(c2)F 62a_100000747473_100000049990 [0,1,0,0,0,1|1,0,0]=3 1188 B16R2.2976 NC(=O)CSc1n[nH]c2c1ccc(c2)N 62a_100000747473_100009816878 [0,1,0,0,0,1|1,0,0]=3 1189 B16R2.2976 NC(=O)CSc1n[nH]c2c1ccc(n2)Cl 62a_100000747473_100010117091 [0,1,0,0,0,1|2,0,0]=4 1190 B16R2.2976 NC(=O)CSc1n[nH]c2c1cnc(c2)Cl 62a_100000747473_100010134411 [0,1,0,0,0,1|2,0,0]=4 1191 B16R2.2976 NC(=O)CSc1n[nH]c2c1ncc(c2)Br 62a_100000747473_100010289622 [0,1,0,0,0,1|2,0,0]=4 1192 B16R2.2976 Nc1ccc2c(n[nH]c2c1)SCC(=O)[O-] 62a_100020667443_100009816878 [0,1,0,0,0,1|2,0,0]=4 1193 B16R2.2976 O=C([O-])CSc1c[nH]c2c1ccc(n2)Cl 62a_100020667443_100010168512 [0,1,0,0,0,1|2,0,0]=4 1194 B16R2.2976 O=C([O-])CSc1c[nH]c2c1ccc(n2)F 62a_100020667443_100010168364 [0,1,0,0,0,1|2,0,0]=4 1195 B16R2.2976 O=C([O-])CSc1c[nH]c2c1cnc(c2)Br 62a_100010206817_100020667443 [0,1,0,0,0,1|2,0,0]=4 1196 B16R2.2976 O=C([O-])CSc1c[nH]c2c1cnc(c2)Br 62a_100020667443_100010206817 [0,1,0,0,0,1|2,0,0]=4 1197 B16R2.2976 O=C([O-])CSc1c[nH]c2c1cnc(c2)Cl 62a_100020667443_100010206812 [0,1,0,0,0,1|2,0,0]=4 1198 B16R2.2976 O=C([O-])CSc1c[nH]c2c1ncc(c2)Br 62a_100010208019_100020667443 [0,1,0,0,0,1|2,0,0]=4 1199 B16R2.2976 O=C([O-])CSc1c[nH]c2c1ncc(c2)Br 62a_100020667443_100010208019 [0,1,0,0,0,1|2,0,0]=4 1200 B16R2.2976 O=C([O-])CSc1n[nH]c2c1ccc(c2)Br 62a_100010186045_100020667443 [0,1,0,0,0,1|2,0,0]=4 1201 B16R2.2976 O=C([O-])CSc1n[nH]c2c1ccc(c2)Br 62a_100020667443_100010186045 [0,1,0,0,0,1|2,0,0]=4 1202 B16R2.2976 O=C([O-])CSc1n[nH]c2c1ccc(c2)Cl 62a_100020667443_100000049627 [0,1,0,0,0,1|2,0,0]=4 1203 B16R2.2976 O=C([O-])CSc1n[nH]c2c1ccc(c2)F 62a_100020667443_100000049990 [0,1,0,0,0,1|2,0,0]=4 1204 B16R2.4003 CC(=O)CCn1c(=O)[nH]c2c1cccc2 1458a_100000070787_203549783246 [0,1,0,0,0,1|2,0,0]=4 1205 B16R2.4003 CC(=O)NN=C1C(=O)Nc2c1cccc2 4a_100000189765_100000185742 [0,1,0,0,0,1|2,0,0]=4 1206 B16R2.4003 Cc1[nH]c2ncccc2c1SCC(=O)N 62a_100000747473_100010174266 [0,1,0,0,0,1|1,0,0]=3 1207 B16R2.4003 Cc1[nH]c2ncccc2c1SCC(=O)[O-] 62a_100020667443_100010174266 [0,1,0,0,0,1|2,0,0]=4 1208 B16R2.4003 Cc1nc2ccccn2c1SCC(=O)N 62a_100000747473_100000762796 [0,1,0,0,0,1|1,0,1]=4 1209 B16R2.4003 Cc1nc2ccccn2c1SCC(=O)N 62a_100000762796_100000747473 [0,1,0,0,0,1|1,0,1]=4 1210 B16R2.4003 Cc1oc2ccccc2c1SCC(=O)N 62a_100000747473_200010236113 [0,1,0,0,0,1|1,0,0]=3 1211 B16R2.4003 Cc1oc2ccccc2c1SCC(=O)[O-] 62a_100020667443_200010236113 [0,1,0,0,0,1|2,0,0]=4 1212 B16R2.4003 Cc1sc2ccccc2c1SCC(=O)N 62a_100000747473_100010002616 [0,1,0,0,0,1|1,0,0]=3 1213 B16R2.4003 Cc1sc2ccccc2c1SCC(=O)N 62a_100010002616_100000747473 [0,1,0,0,0,1|1,0,0]=3 1214 B16R2.4003 Cc1sc2ccccc2c1SCC(=O)[O-] 62a_100010002616_100020667443 [0,1,0,0,0,1|2,0,0]=4 1215 B16R2.4003 Cc1sc2ccccc2c1SCC(=O)[O-] 62a_100020667443_100010002616 [0,1,0,0,0,1|2,0,0]=4 1216 B16R2.4003 Cn1nc2ccccc2c1SCC(=O)N 62a_100000747473_100010163699 [0,1,0,0,0,1|1,0,1]=4 1217 B16R2.4003 Cn1nc2ccccc2c1SCC(=O)N 62a_100010163699_100000747473 [0,1,0,0,0,1|1,0,1]=4 1218 B16R2.4003 NC(=O)CSC1C(=O)Nc2c1cccc2 62a_100000747473_200009996675 [0,1,0,0,0,1|0,0,1]=3 1219 B16R2.4003 O=C(O)CNC1C(=O)Nc2c1cccc2 269956a_100016091260_200009996675 [0,1,0,0,0,1|1,0,1]=4 1220 B16R2.4003 O=C([O-])CSC1C(=O)Nc2c1cccc2 62a_100020667443_200009996675 [0,1,0,0,0,1|1,0,1]=4 1221 B16R2.15551 CC(=O)CCc1c[nH]c2c1cc(cc2)Br 1458a_100009828173_200000210301 [0,1,0,0,0,1|1,0,0]=3 1222 B16R2.15551 Cc1ccc2[nH]cc(c2n1)SCC(=O)N 62a_100000747473_100010212567 [0,1,0,0,0,1|1,0,0]=3 1223 B16R2.15551 Cc1ccc2[nH]cc(c2n1)SCC(=O)[O-] 62a_100020667443_100010212567 [0,1,0,0,0,1|2,0,0]=4 1224 B16R2.15551 Cc1ccc2[nH]nc(c2c1)SCC(=O)N 62a_100000747473_100000123028 [0,1,0,0,0,1|1,0,0]=3 1225 B16R2.15551 Cc1ccc2[nH]nc(c2c1)SCC(=O)[O-] 62a_100020667443_100000123028 [0,1,0,0,0,1|2,0,0]=4 1226 B16R2.15551 Cc1ccc2ncc(n2c1)SCC(=O)N 62a_100000747473_100012351729 [0,1,0,0,0,1|1,0,1]=4 1227 B16R2.15551 Cc1cnc2[nH]cc(c2c1)SCC(=O)N 62a_100000747473_100010246215 [0,1,0,0,0,1|1,0,0]=3 1228 B16R2.15551 Cc1cnc2[nH]cc(c2c1)SCC(=O)[O-] 62a_100020667443_100010246215 [0,1,0,0,0,1|2,0,0]=4 1229 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)Br 62a_100000747473_100011290788 [0,1,0,0,0,1|1,0,0]=3 1230 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100000747473 [0,1,0,0,0,1|1,0,0]=3 1231 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)Cl 62a_100000747473_100000050100 [0,1,0,0,0,1|1,0,0]=3 1232 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)F 62a_100000747473_100010168383 [0,1,0,0,0,1|1,0,0]=3 1233 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(cn2)N 62a_100000747473_100010168510 [0,1,0,0,0,1|1,0,0]=3 1234 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(nc2)Cl 62a_100000747473_100010168685 [0,1,0,0,0,1|1,0,0]=3 1235 B16R2.15551 NC(=O)CSc1c[nH]c2c1cc(nn2)Cl 62a_100000747473_100161115472 [0,1,0,0,0,1|2,0,0]=4 1236 B16R2.15551 NC(=O)CSc1c[nH]c2c1nc(cc2)Br 62a_100000747473_100010168532 [0,1,0,0,0,1|1,0,0]=3 1237 B16R2.15551 NC(=O)CSc1c[nH]c2c1nc(cc2)Br 62a_100010168532_100000747473 [0,1,0,0,0,1|1,0,0]=3 1238 B16R2.15551 NC(=O)CSc1c[nH]c2c1nc(cc2)Cl 62a_100000747473_100010168529 [0,1,0,0,0,1|1,0,0]=3 1239 B16R2.15551 NC(=O)CSc1c[nH]c2c1nc(cn2)Br 62a_100000747473_100010212349 [0,1,0,0,0,1|2,0,0]=4 1240 B16R2.15551 NC(=O)CSc1c[nH]c2c1nc(cn2)Br 62a_100010212349_100000747473 [0,1,0,0,0,1|2,0,0]=4 1241 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)Br 62a_100000747473_100012343615 [0,1,0,0,0,1|1,0,1]=4 1242 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)Br 62a_100012343615_100000747473 [0,1,0,0,0,1|1,0,1]=4 1243 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)Cl 62a_100000747473_200012351726 [0,1,0,0,0,1|1,0,1]=4 1244 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)Cl 62a_200012351726_100000747473 [0,1,0,0,0,1|1,0,1]=4 1245 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)F 62a_100000747473_100012350704 [0,1,0,0,0,1|1,0,1]=4 1246 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)F 62a_100012350704_100000747473 [0,1,0,0,0,1|1,0,1]=4 1247 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)N 62a_100000747473_102495324787 [0,1,0,0,0,1|1,0,1]=4 1248 B16R2.15551 NC(=O)CSc1cnc2n1cc(cc2)N 62a_102495324787_100000747473 [0,1,0,0,0,1|1,0,1]=4 1249 B16R2.15551 NC(=O)CSc1cnn2c1cc(cc2)Br 62a_100000747473_100015721393 [0,1,0,0,0,1|1,0,1]=4 1250 B16R2.15551 NC(=O)CSc1cnn2c1cc(cc2)Br 62a_100015721393_100000747473 [0,1,0,0,0,1|1,0,1]=4 1251 B16R2.15551 NC(=O)CSc1csc2c1cc(cc2)N 62a_100000747473_100011178648 [0,1,0,0,0,1|1,0,0]=3 1252 B16R2.15551 NC(=O)CSc1csc2c1cc(cc2)N 62a_100011178648_100000747473 [0,1,0,0,0,1|1,0,0]=3 1253 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cc2)Br 62a_100000747473_100010186058 [0,1,0,0,0,1|1,0,0]=3 1254 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cc2)Cl 62a_100000747473_100010174404 [0,1,0,0,0,1|1,0,0]=3 1255 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cc2)F 62a_100000747473_100011934747 [0,1,0,0,0,1|1,0,0]=3 1256 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cc2)N 62a_100000747473_100012353729 [0,1,0,0,0,1|1,0,0]=3 1257 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cn2)Br 62a_100000747473_100010212350 [0,1,0,0,0,1|2,0,0]=4 1258 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cn2)Br 62a_100010212350_100000747473 [0,1,0,0,0,1|2,0,0]=4 1259 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cn2)Cl 62a_100000747473_100010289580 [0,1,0,0,0,1|2,0,0]=4 1260 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cn2)F 62a_100000747473_100010289577 [0,1,0,0,0,1|2,0,0]=4 1261 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(cn2)N 62a_100000747473_100010174952 [0,1,0,0,0,1|2,0,0]=4 1262 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(nc2)Br 62a_100000747473_100010296430 [0,1,0,0,0,1|2,0,0]=4 1263 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(nc2)Br 62a_100010296430_100000747473 [0,1,0,0,0,1|2,0,0]=4 1264 B16R2.15551 NC(=O)CSc1n[nH]c2c1cc(nc2)Cl 62a_100000747473_100010134363 [0,1,0,0,0,1|2,0,0]=4 1265 B16R2.15551 NC(=O)CSc1n[nH]c2c1nc(cc2)Br 62a_100000747473_200010370904 [0,1,0,0,0,1|2,0,0]=4 1266 B16R2.15551 NC(=O)CSc1n[nH]c2c1nc(cc2)Cl 62a_100000747473_100102525187 [0,1,0,0,0,1|2,0,0]=4 1267 B16R2.15551 Nc1ccc2[nH]nc(c2c1)SCC(=O)[O-] 62a_100020667443_100012353729 [0,1,0,0,0,1|2,0,0]=4 1268 B16R2.15551 Nc1ccc2scc(c2c1)SCC(=O)[O-] 62a_100011178648_100020667443 [0,1,0,0,0,1|2,0,0]=4 1269 B16R2.15551 Nc1ccc2scc(c2c1)SCC(=O)[O-] 62a_100020667443_100011178648 [0,1,0,0,0,1|2,0,0]=4 1270 B16R2.15551 Nc1cnc2[nH]cc(c2c1)SCC(=O)[O-] 62a_100020667443_100010168510 [0,1,0,0,0,1|2,0,0]=4 1271 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)Br 62a_100011290788_100020667443 [0,1,0,0,0,1|2,0,0]=4 1272 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)Br 62a_100020667443_100011290788 [0,1,0,0,0,1|2,0,0]=4 1273 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)Cl 62a_100020667443_100000050100 [0,1,0,0,0,1|2,0,0]=4 1274 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(cn2)F 62a_100020667443_100010168383 [0,1,0,0,0,1|2,0,0]=4 1275 B16R2.15551 O=C([O-])CSc1c[nH]c2c1cc(nc2)Cl 62a_100020667443_100010168685 [0,1,0,0,0,1|2,0,0]=4 1276 B16R2.15551 O=C([O-])CSc1c[nH]c2c1nc(cc2)Br 62a_100010168532_100020667443 [0,1,0,0,0,1|2,0,0]=4 1277 B16R2.15551 O=C([O-])CSc1c[nH]c2c1nc(cc2)Br 62a_100020667443_100010168532 [0,1,0,0,0,1|2,0,0]=4 1278 B16R2.15551 O=C([O-])CSc1c[nH]c2c1nc(cc2)Cl 62a_100020667443_100010168529 [0,1,0,0,0,1|2,0,0]=4 1279 B16R2.15551 O=C([O-])CSc1n[nH]c2c1cc(cc2)Br 62a_100020667443_100010186058 [0,1,0,0,0,1|2,0,0]=4 1280 B16R2.15551 O=C([O-])CSc1n[nH]c2c1cc(cc2)Cl 62a_100020667443_100010174404 [0,1,0,0,0,1|2,0,0]=4 1281 B16R2.15551 O=C([O-])CSc1n[nH]c2c1cc(cc2)F 62a_100020667443_100011934747 [0,1,0,0,0,1|2,0,0]=4 1282 B16R2.15551 [13CH3]C(=O)CCc1c[nH]c2c1cc(cc2)Br 1458a_100009828173_200025704644 [0,1,0,0,0,1|1,0,0]=3 1283 B16R2.22833 Cc1cccc2c1[nH]nc2SCC(=O)N 62a_100000747473_100010186057 [0,1,0,0,0,1|1,0,0]=3 1284 B16R2.22833 Cc1cccc2c1[nH]nc2SCC(=O)[O-] 62a_100020667443_100010186057 [0,1,0,0,0,1|2,0,0]=4 1285 B16R2.22833 Cc1cccc2c1onc2OCC(=O)N 34a_100000041175_100000187820 [0,1,0,0,0,1|2,0,0]=4 1286 B16R2.22833 Cc1cccn2c1ncc2SCC(=O)N 62a_100000747473_100012351083 [0,1,0,0,0,1|1,0,1]=4 1287 B16R2.22833 NC(=O)CSc1c[nH]c2c1nc[nH]c2=O 62a_100000747473_200010089858 [0,1,0,0,0,1|2,0,0]=4 1288 B16R2.22833 NC(=O)CSc1c[nH]c2c1nccc2Cl 62a_100000747473_100010168581 [0,1,0,0,0,1|1,0,0]=3 1289 B16R2.22833 NC(=O)CSc1c[nH]c2c1ncnc2Cl 62a_100000747473_100010988924 [0,1,0,0,0,1|2,0,0]=4 1290 B16R2.22833 NC(=O)CSc1cnc2n1cccc2Br 62a_100000747473_100013004016 [0,1,0,0,0,1|1,0,1]=4 1291 B16R2.22833 NC(=O)CSc1cnc2n1cccc2Br 62a_100013004016_100000747473 [0,1,0,0,0,1|1,0,1]=4 1292 B16R2.22833 NC(=O)CSc1cnc2n1cccc2Cl 62a_100000747473_100010025871 [0,1,0,0,0,1|1,0,1]=4 1293 B16R2.22833 NC(=O)CSc1cnc2n1cccc2F 62a_100000747473_100009817165 [0,1,0,0,0,1|1,0,1]=4 1294 B16R2.22833 NC(=O)CSc1cnc2n1cccc2F 62a_100009817165_100000747473 [0,1,0,0,0,1|1,0,1]=4 1295 B16R2.22833 NC(=O)CSc1cnc2n1cccc2O 62a_100000747473_200020799507 [0,1,0,0,0,1|1,0,1]=4 1296 B16R2.22833 NC(=O)CSc1n[nH]c2c1cccc2Br 62a_100000747473_100010197283 [0,1,0,0,0,1|1,0,0]=3 1297 B16R2.22833 NC(=O)CSc1n[nH]c2c1cccc2Cl 62a_100000747473_100000050086 [0,1,0,0,0,1|1,0,0]=3 1298 B16R2.22833 NC(=O)CSc1n[nH]c2c1cccc2F 62a_100000747473_100010231504 [0,1,0,0,0,1|1,0,0]=3 1299 B16R2.22833 NC(=O)CSc1n[nH]c2c1cccc2N 62a_100000747473_100009888981 [0,1,0,0,0,1|1,0,0]=3 1300 B16R2.22833 NC(=O)CSc1n[nH]c2c1cccc2O 62a_100000747473_200010988877 [0,1,0,0,0,1|1,0,0]=3 1301 B16R2.22833 NC(=O)CSc1n[nH]c2c1ccnc2Cl 62a_100000747473_100010009562 [0,1,0,0,0,1|2,0,0]=4 1302 B16R2.22833 Nc1cccc2c1[nH]nc2SCC(=O)[O-] 62a_100020667443_100009888981 [0,1,0,0,0,1|2,0,0]=4 1303 B16R2.22833 O=C([O-])CSc1c[nH]c2c1nccc2Cl 62a_100020667443_100010168581 [0,1,0,0,0,1|2,0,0]=4 1304 B16R2.22833 O=C([O-])CSc1n[nH]c2c1cccc2Br 62a_100020667443_100010197283 [0,1,0,0,0,1|2,0,0]=4 1305 B16R2.22833 O=C([O-])CSc1n[nH]c2c1cccc2Cl 62a_100020667443_100000050086 [0,1,0,0,0,1|2,0,0]=4 1306 B16R2.22833 O=C([O-])CSc1n[nH]c2c1cccc2F 62a_100020667443_100010231504 [0,1,0,0,0,1|2,0,0]=4 1307 B16R2.22833 O=C([O-])CSc1n[nH]c2c1cccc2O 62a_100020667443_200010988877 [0,1,0,0,0,1|2,0,0]=4 1308 B16R2.22904 Cc1cccc2c1c(n[nH]2)SCC(=O)N 62a_100000747473_100000049903 [0,1,0,0,0,1|1,0,0]=3 1309 B16R2.22904 Cc1cccc2c1c(n[nH]2)SCC(=O)[O-] 62a_100020667443_100000049903 [0,1,0,0,0,1|2,0,0]=4 1310 B16R2.22904 Cc1cccc2n1c(cn2)SCC(=O)N 62a_100000747473_100012566946 [0,1,0,0,0,1|1,0,1]=4 1311 B16R2.22904 NC(=O)COc1noc2c1c(ccc2)F 34a_100009888067_100000187820 [0,1,0,0,0,1|2,0,0]=4 1312 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(=O)[nH]cn2 62a_100000747473_100010220714 [0,1,0,0,0,1|2,0,0]=4 1313 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)Br 62a_100000747473_100010212587 [0,1,0,0,0,1|1,0,0]=3 1314 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100000747473 [0,1,0,0,0,1|1,0,0]=3 1315 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)Cl 62a_100000747473_100011356983 [0,1,0,0,0,1|1,0,0]=3 1316 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ccn2)F 62a_100000747473_100010168365 [0,1,0,0,0,1|1,0,0]=3 1317 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ncn2)Cl 62a_100000747473_100000062014 [0,1,0,0,0,1|2,0,0]=4 1318 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ncn2)N 62a_100000747473_100010179808 [0,1,0,0,0,1|2,0,0]=4 1319 B16R2.22904 NC(=O)CSc1c[nH]c2c1c(ncn2)N 62a_100010179808_100000747473 [0,1,0,0,0,1|2,0,0]=4 1320 B16R2.22904 NC(=O)CSc1coc2c1c(ncc2)N 62a_100000747473_200010135222 [0,1,0,0,0,1|2,0,0]=4 1321 B16R2.22904 NC(=O)CSc1coc2c1c(ncc2)N 62a_200010135222_100000747473 [0,1,0,0,0,1|2,0,0]=4 1322 B16R2.22904 NC(=O)CSc1csc2c1c(ncc2)N 62a_200010188537_100000747473 [0,1,0,0,0,1|2,0,0]=4 1323 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ccc2)Br 62a_100000747473_100010186043 [0,1,0,0,0,1|1,0,0]=3 1324 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ccc2)Cl 62a_100000747473_100000049730 [0,1,0,0,0,1|1,0,0]=3 1325 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ccc2)F 62a_100000747473_100000049989 [0,1,0,0,0,1|1,0,0]=3 1326 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ccc2)N 62a_100000747473_100010186038 [0,1,0,0,0,1|1,0,0]=3 1327 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ccn2)Cl 62a_100000747473_100010090772 [0,1,0,0,0,1|2,0,0]=4 1328 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ncc2)Br 62a_100000747473_100010370910 [0,1,0,0,0,1|2,0,0]=4 1329 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ncc2)Br 62a_100010370910_100000747473 [0,1,0,0,0,1|2,0,0]=4 1330 B16R2.22904 NC(=O)CSc1n[nH]c2c1c(ncc2)Cl 62a_100000747473_100010080173 [0,1,0,0,0,1|2,0,0]=4 1331 B16R2.22904 Nc1cccc2c1c(n[nH]2)SCC(=O)[O-] 62a_100020667443_100010186038 [0,1,0,0,0,1|2,0,0]=4 1332 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)Br 62a_100010212587_100020667443 [0,1,0,0,0,1|2,0,0]=4 1333 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)Br 62a_100020667443_100010212587 [0,1,0,0,0,1|2,0,0]=4 1334 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)Cl 62a_100020667443_100011356983 [0,1,0,0,0,1|2,0,0]=4 1335 B16R2.22904 O=C([O-])CSc1c[nH]c2c1c(ccn2)F 62a_100020667443_100010168365 [0,1,0,0,0,1|2,0,0]=4 1336 B16R2.22904 O=C([O-])CSc1n[nH]c2c1c(ccc2)Br 62a_100020667443_100010186043 [0,1,0,0,0,1|2,0,0]=4 1337 B16R2.22904 O=C([O-])CSc1n[nH]c2c1c(ccc2)Cl 62a_100020667443_100000049730 [0,1,0,0,0,1|2,0,0]=4 1338 B16R2.22904 O=C([O-])CSc1n[nH]c2c1c(ccc2)F 62a_100020667443_100000049989 [0,1,0,0,0,1|2,0,0]=4 1339 B16R2.104522 CC(=O)CCc1cn(c2c1cccc2)C 1458a_100000686839_200000210301 [0,1,0,0,0,1|1,0,0]=3 1340 B16R2.104522 CC(=O)NCc1cn(c2c1cccc2)C 11a_100011997738_100015343762 [0,1,0,0,0,1|1,0,0]=3 1341 B16R2.104522 CC(=O)NCc1cn(c2c1cccc2)C 1626a_100011997738_100015343762 [0,1,0,0,0,1|1,0,0]=3 1342 B16R2.104522 CC(=O)NCc1cn(c2c1cccc2)C 240690a_100011997738_100015343762 [0,1,0,0,0,1|1,0,0]=3 1343 B16R2.104522 CC(=O)NCc1cn(c2c1cccc2)C 527a_100011997738_100103153847 [0,1,0,0,0,1|1,0,0]=3 1344 B16R2.104522 CC(=O)NCc1nn(c2c1cccc2)C 11a_200011934655_100015343762 [0,1,0,0,0,1|2,0,0]=4 1345 B16R2.104522 CC(=O)NCc1nn(c2c1cccc2)C 1626a_200011934655_100015343762 [0,1,0,0,0,1|2,0,0]=4 1346 B16R2.104522 CC(=O)NCc1nn(c2c1cccc2)C 240690a_200011934655_100015343762 [0,1,0,0,0,1|2,0,0]=4 1347 B16R2.104522 CC(=O)NCc1nn(c2c1cccc2)C 527a_200011934655_100103153847 [0,1,0,0,0,1|2,0,0]=4 1348 B16R2.104522 Cn1cc(c2c1cccc2)CCC(=O)[13CH3] 1458a_100000686839_200025704644 [0,1,0,0,0,1|1,0,0]=3 1349 B16R2.104522 Cn1cc(c2c1nccc2)SCC(=O)N 62a_100000747473_100010205794 [0,1,0,0,0,1|1,0,0]=3 1350 B16R2.104522 Cn1cc(c2c1nccc2)SCC(=O)[O-] 62a_100020667443_100010205794 [0,1,0,0,0,1|2,0,0]=4 1351 B16R2.104522 Cn1cc(c2c1ncnc2)SCC(=O)N 62a_100000747473_200011012545 [0,1,0,0,0,1|2,0,0]=4 1352 B16R2.104522 Cn1cc(c2c1ncnc2)SCC(=O)N 62a_200011012545_100000747473 [0,1,0,0,0,1|2,0,0]=4 1353 B16R2.104522 Cn1nc(c2c1cccc2)SCC(=O)N 62a_100000747473_100009817141 [0,1,0,0,0,1|1,0,0]=3 1354 B16R2.104522 Cn1nc(c2c1cccc2)SCC(=O)N 62a_100009817141_100000747473 [0,1,0,0,0,1|1,0,0]=3 1355 B16R2.104522 Cn1nc(c2c1cccc2)SCC(=O)[O-] 62a_100009817141_100020667443 [0,1,0,0,0,1|2,0,0]=4 1356 B16R2.104522 Cn1nc(c2c1cccc2)SCC(=O)[O-] 62a_100020667443_100009817141 [0,1,0,0,0,1|2,0,0]=4 1357 B16R2.104522 Cn1nc(c2c1cccn2)SCC(=O)N 62a_100000747473_100000761950 [0,1,0,0,0,1|2,0,0]=4 1358 B16R2.104522 Cn1nc(c2c1nccc2)SCC(=O)N 62a_100000747473_100010248644 [0,1,0,0,0,1|2,0,0]=4 1359 B16R2.104522 Cn1nc(c2c1nccc2)SCC(=O)N 62a_100010248644_100000747473 [0,1,0,0,0,1|2,0,0]=4 1360 B16R2.3989 CC(=O)CC1Oc2ccccc2NC1=O 1458a_100000016180_200000210301 [0,1,0,0,0,1|1,0,1]=4 1361 B16R2.3989 CC(=O)CC1Sc2ccccc2NC1=O 1458a_100000010723_200000210301 [0,1,0,0,0,1|1,0,1]=4 1362 B16R2.3989 CC(=O)Cc1cc2ccccc2nc1Cl 1458a_100000070787_100000189640 [0,1,0,0,0,1|1,0,1]=4 1363 B16R2.3989 CC(=O)Cc1nc2ccccc2[nH]c1=O 1458a_100000070787_100000736137 [0,1,0,0,0,1|1,0,0]=3 1364 B16R2.3989 [13CH3]C(=O)CC1Oc2ccccc2NC1=O 1458a_100000016180_200025704644 [0,1,0,0,0,1|1,0,1]=4 1365 B16R2.3989 [13CH3]C(=O)CC1Sc2ccccc2NC1=O 1458a_100000010723_200025704644 [0,1,0,0,0,1|1,0,1]=4 1366 B16R2.5347 C#CC(=O)Cc1ccc2ccccc2c1 1458a_100000211873_100011216711 [0,1,0,0,0,1|2,0,0]=4 1367 B16R2.5347 C#CC(=O)Cc1ccc2ccccc2n1 1458a_100000211873_100000737579 [0,1,0,0,0,1|2,0,0]=4 1368 B16R2.5347 C#CC(=O)Cc1cnc2ccccc2n1 1458a_100000211873_200000751123 [0,1,0,0,0,1|1,0,1]=4 1369 B16R2.5347 C=CC(=O)Cc1ccc2ccccc2c1 1458a_100000185746_100011216711 [0,1,0,0,0,1|2,0,0]=4 1370 B16R2.5347 C=CC(=O)Cc1ccc2ccccc2n1 1458a_100000185746_100000737579 [0,1,0,0,0,1|2,0,0]=4 1371 B16R2.5347 C=CC(=O)Cc1cnc2ccccc2n1 1458a_100000185746_200000751123 [0,1,0,0,0,1|1,0,1]=4 1372 B16R2.5347 CCC(=O)Cc1ccc2ccccc2c1 1458a_100000181716_100000210202 [0,1,0,0,0,1|2,0,0]=4 1373 B16R2.5347 CCC(=O)Cc1ccc2ccccc2c1 1458a_100000210414_100011216711 [0,1,0,0,0,1|2,0,0]=4 1374 B16R2.5347 CCC(=O)Cc1ccc2ccccc2n1 1458a_100000210414_100000737579 [0,1,0,0,0,1|2,0,0]=4 1375 B16R2.5347 CCC(=O)Cc1cnc2ccccc2n1 1458a_100000210414_200000751123 [0,1,0,0,0,1|1,0,1]=4 1376 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 11a_106832991635_100000181716 [0,1,0,0,0,1|1,0,0]=3 1377 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 1626a_100102657272_100000181716 [0,1,0,0,0,1|1,0,0]=3 1378 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 240690a_100102657272_100000181716 [0,1,0,0,0,1|1,0,0]=3 1379 B16R2.5347 CNC(=O)Cc1ccc2ccccc2c1 527a_100102657272_100000181716 [0,1,0,0,0,1|1,0,0]=3 1380 B16R2.5347 CNC(=O)Cc1ccc2ncccc2c1 11a_106832991635_100011218584 [0,1,0,0,0,1|2,0,0]=4 1381 B16R2.5347 CNC(=O)Cc1ccc2ncccc2c1 240690a_100102657272_100011218584 [0,1,0,0,0,1|2,0,0]=4 1382 B16R2.5347 CNC(=O)Cc1ccc2ncccc2c1 527a_100102657272_100011218584 [0,1,0,0,0,1|2,0,0]=4 1383 B16R2.5347 CNC(=O)Nc1ccc2ccccc2c1 2430a_100000211940_100102657272 [0,1,0,0,0,1|2,0,0]=4 1384 B16R2.5347 O=C(CF)Cc1ccc2ccccc2c1 1458a_100000181716_100015361967 [0,1,0,0,0,1|2,0,0]=4 1385 B16R2.5347 O=C(CO)Cc1ccc2ccccc2c1 1458a_100000210174_100011216711 [0,1,0,0,0,1|2,0,0]=4 1386 B16R2.5347 O=C(CO)Cc1ccc2ccccc2n1 1458a_100000210174_100000737579 [0,1,0,0,0,1|2,0,0]=4 1387 B16R2.5347 O=C(CO)Cc1cnc2ccccc2n1 1458a_100000210174_200000751123 [0,1,0,0,0,1|1,0,1]=4 1388 B16R2.11975 CC(=O)Cc1ccc2ccc(cc2n1)Cl 1458a_100000070787_100010196396 [0,1,0,0,0,1|2,0,0]=4 1389 B16R2.11988 CC(=O)Cc1ccc2cc(ccc2c1)Br 1458a_100000070787_100012356510 [0,1,0,0,0,1|2,0,0]=4 1390 B16R2.11988 CC(=O)Cc1ccc2cc(ccc2n1)C 1458a_100000070787_100009884411 [0,1,0,0,0,1|2,0,0]=4 1391 B16R2.83538 CC(=O)Cc1ccc2ccccc2c1Br 1458a_100000070787_100009813938 [0,1,0,0,0,1|2,0,0]=4 1392 B16R2.333 CC(=O)Cc1c(ccc2c1cccc2)C 1458a_100000070787_100000689653 [0,1,0,0,0,1|2,0,0]=4 1393 B16R2.3995 CC(=O)Cc1cc(nc2c1cccc2)C 1458a_100000070787_100000755639 [0,1,0,0,0,1|1,0,1]=4 1394 B16R2.3995 CC(=O)Cc1cc(nc2c1cccc2)Cl 1458a_100000070787_200010137201 [0,1,0,0,0,1|1,0,1]=4 1395 B16R2.3995 CC(=O)Cc1cc(nc2c1cccc2)O 1458a_100000070787_100000187625 [0,1,0,0,0,1|1,0,1]=4 1396 B16R2.24414 CC(=O)Cc1ccc(c2c1cccc2)Br 1458a_100000070787_100012352185 [0,1,0,0,0,1|2,0,0]=4 1397 B16R2.24414 CC(=O)Cc1ccc(c2c1cccc2)C 1458a_100000070787_100012073487 [0,1,0,0,0,1|2,0,0]=4 1398 B16R2.24414 CC(=O)Cc1ccc(c2c1cccc2)F 1458a_100000070787_100011988723 [0,1,0,0,0,1|2,0,0]=4 1399 B16R2.24414 CC(=O)Cc1n[nH]c(=O)c2c1cccc2 1458a_100000010072_200000210301 [0,1,0,0,0,1|2,0,0]=4 1400 B16R2.24414 [13CH3]C(=O)Cc1n[nH]c(=O)c2c1cccc2 1458a_100000010072_200025704644 [0,1,0,0,0,1|2,0,0]=4 1401 B16R2.170412 C#CC(=O)Cc1cccc2c1cccc2 1458a_100000211873_100000188474 [0,1,0,0,0,1|2,0,0]=4 1402 B16R2.170412 C#CC(=O)Cc1ccnc2c1cccc2 1458a_100000211873_100015192512 [0,1,0,0,0,1|1,0,1]=4 1403 B16R2.170412 C#CC(=O)Cc1nccc2c1cccc2 1458a_100000211873_100000033776 [0,1,0,0,0,1|2,0,0]=4 1404 B16R2.170412 C=CC(=O)Cc1cccc2c1cccc2 1458a_100000185746_100000188474 [0,1,0,0,0,1|2,0,0]=4 1405 B16R2.170412 C=CC(=O)Cc1ccnc2c1cccc2 1458a_100000185746_100015192512 [0,1,0,0,0,1|1,0,1]=4 1406 B16R2.170412 C=CC(=O)Cc1nccc2c1cccc2 1458a_100000185746_100000033776 [0,1,0,0,0,1|2,0,0]=4 1407 B16R2.170412 CCC(=O)Cc1cccc2c1cccc2 1458a_100000186155_100000210202 [0,1,0,0,0,1|2,0,0]=4 1408 B16R2.170412 CCC(=O)Cc1cccc2c1cccc2 1458a_100000210414_100000188474 [0,1,0,0,0,1|2,0,0]=4 1409 B16R2.170412 CCC(=O)Cc1ccnc2c1cccc2 1458a_100000210414_100015192512 [0,1,0,0,0,1|1,0,1]=4 1410 B16R2.170412 CCC(=O)Cc1nccc2c1cccc2 1458a_100000210414_100000033776 [0,1,0,0,0,1|2,0,0]=4 1411 B16R2.170412 CNC(=O)Cc1cccc2c1cccc2 11a_106832991635_100000186155 [0,1,0,0,0,1|1,0,0]=3 1412 B16R2.170412 CNC(=O)Cc1cccc2c1cccc2 1626a_100102657272_100000186155 [0,1,0,0,0,1|1,0,0]=3 1413 B16R2.170412 CNC(=O)Cc1cccc2c1cccc2 240690a_100102657272_100000186155 [0,1,0,0,0,1|1,0,0]=3 1414 B16R2.170412 CNC(=O)Cc1cccc2c1cccc2 527a_100102657272_100000186155 [0,1,0,0,0,1|1,0,0]=3 1415 B16R2.170412 CNC(=O)Nc1cccc2c1cccc2 2430a_100000185869_100102657272 [0,1,0,0,0,1|2,0,0]=4 1416 B16R2.170412 O=C(CF)Cc1cccc2c1cccc2 1458a_100000186155_100015361967 [0,1,0,0,0,1|2,0,0]=4 1417 B16R2.170412 O=C(CO)Cc1cccc2c1cccc2 1458a_100000210174_100000188474 [0,1,0,0,0,1|2,0,0]=4 1418 B16R2.170412 O=C(CO)Cc1ccnc2c1cccc2 1458a_100000210174_100015192512 [0,1,0,0,0,1|1,0,1]=4 1419 B16R2.170412 O=C(CO)Cc1nccc2c1cccc2 1458a_100000210174_100000033776 [0,1,0,0,0,1|2,0,0]=4 1420 B16R2.4 CN[C@@H](CO)Cc1c[nH]c2c1cccc2 2230a_100102526151_200000210301 [0,2,0,0,0,0|0,0,2]=4 1421 B16R2.4 [13CH3]N[C@@H](CO)Cc1c[nH]c2c1cccc2 2230a_100102526151_200025704644 [0,2,0,0,0,0|0,0,2]=4 1422 B16R2.5 C#CCC(=O)Cc1c[nH]c2c1cccc2 1458a_100000183835_100000184674 [0,2,0,0,0,0|1,0,0]=3 1423 B16R2.5 C#CCC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000184674 [0,2,0,0,0,0|2,0,0]=4 1424 B16R2.5 C#CCC(=O)Cc1coc2c1cccc2 1458a_100000217546_100000184674 [0,2,0,0,0,0|2,0,0]=4 1425 B16R2.5 C#CCC(=O)Cc1csc2c1cccc2 1458a_100000741031_100000184674 [0,2,0,0,0,0|2,0,0]=4 1426 B16R2.5 C#CCC(=O)Cc1csc2c1cccc2 1458a_100011220946_200000742921 [0,2,0,0,0,0|2,0,0]=4 1427 B16R2.5 C#CCC(=O)Cc1n[nH]c2c1cccc2 1458a_100000044345_100000184674 [0,2,0,0,0,0|2,0,0]=4 1428 B16R2.5 C=CCC(=O)Cc1c[nH]c2c1cccc2 1458a_100000183835_100000210623 [0,2,0,0,0,0|1,0,0]=3 1429 B16R2.5 C=CCC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000210623 [0,2,0,0,0,0|2,0,0]=4 1430 B16R2.5 C=CCC(=O)Cc1coc2c1cccc2 1458a_100000217546_100000210623 [0,2,0,0,0,0|2,0,0]=4 1431 B16R2.5 C=CCC(=O)Cc1csc2c1cccc2 1458a_100000210193_200000742921 [0,2,0,0,0,0|2,0,0]=4 1432 B16R2.5 C=CCC(=O)Cc1csc2c1cccc2 1458a_100000741031_100000210623 [0,2,0,0,0,0|2,0,0]=4 1433 B16R2.5 C=CCC(=O)Cc1n[nH]c2c1cccc2 1458a_100000044345_100000210623 [0,2,0,0,0,0|2,0,0]=4 1434 B16R2.5 CC#CC(=O)Cc1csc2c1cccc2 1458a_100000763181_200000742921 [0,2,0,0,0,0|2,0,0]=4 1435 B16R2.5 CC=CC(=O)Cc1csc2c1cccc2 1458a_100000210699_200000742921 [0,2,0,0,0,0|2,0,0]=4 1436 B16R2.5 CCCC(=O)Cc1c[nH]c2c1cccc2 1458a_100000183835_100000210303 [0,2,0,0,0,0|1,0,0]=3 1437 B16R2.5 CCCC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000210303 [0,2,0,0,0,0|2,0,0]=4 1438 B16R2.5 CCCC(=O)Cc1coc2c1cccc2 1458a_100000217546_100000210303 [0,2,0,0,0,0|2,0,0]=4 1439 B16R2.5 CCCC(=O)Cc1csc2c1cccc2 1458a_100000211992_200000742921 [0,2,0,0,0,0|2,0,0]=4 1440 B16R2.5 CCCC(=O)Cc1csc2c1cccc2 1458a_100000741031_100000210303 [0,2,0,0,0,0|2,0,0]=4 1441 B16R2.5 CCCC(=O)Cc1n[nH]c2c1cccc2 1458a_100000044345_100000210303 [0,2,0,0,0,0|2,0,0]=4 1442 B16R2.5 CCNC(=O)C[n+]1csc2c1cccc2 11a_100015525214_100009813389 [0,2,0,0,0,0|2,0,0]=4 1443 B16R2.5 CCNC(=O)C[n+]1csc2c1cccc2 240690a_100015525214_100009813389 [0,2,0,0,0,0|2,0,0]=4 1444 B16R2.5 CCNC(=O)C[n+]1csc2c1cccc2 527a_100015525214_100009813389 [0,2,0,0,0,0|2,0,0]=4 1445 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccc2 11a_100015525214_100000183835 [0,2,0,0,0,0|0,0,0]=2 1446 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccc2 240690a_100015525214_100000183835 [0,2,0,0,0,0|0,0,0]=2 1447 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccc2 527a_100015525214_100000183835 [0,2,0,0,0,0|0,0,0]=2 1448 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccn2 11a_100015525214_100000687015 [0,2,0,0,0,0|1,0,0]=3 1449 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccn2 240690a_100015525214_100000687015 [0,2,0,0,0,0|1,0,0]=3 1450 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccn2 527a_100015525214_100000687015 [0,2,0,0,0,0|1,0,0]=3 1451 B16R2.5 CCNC(=O)Cc1cnc2n1cccc2 11a_100015525214_100000070654 [0,2,0,0,0,0|1,0,1]=4 1452 B16R2.5 CCNC(=O)Cc1cnc2n1cccc2 240690a_100015525214_100000070654 [0,2,0,0,0,0|1,0,1]=4 1453 B16R2.5 CCNC(=O)Cc1coc2c1cccc2 11a_100015525214_100000217546 [0,2,0,0,0,0|1,0,0]=3 1454 B16R2.5 CCNC(=O)Cc1coc2c1cccc2 240690a_100015525214_100000217546 [0,2,0,0,0,0|1,0,0]=3 1455 B16R2.5 CCNC(=O)Cc1coc2c1cccc2 527a_100015525214_100000217546 [0,2,0,0,0,0|1,0,0]=3 1456 B16R2.5 CCNC(=O)Cc1csc2c1cccc2 11a_100015525214_100000741031 [0,2,0,0,0,0|1,0,0]=3 1457 B16R2.5 CCNC(=O)Cc1csc2c1cccc2 240690a_100015525214_100000741031 [0,2,0,0,0,0|1,0,0]=3 1458 B16R2.5 CCNC(=O)Cc1csc2c1cccc2 527a_100015525214_100000741031 [0,2,0,0,0,0|1,0,0]=3 1459 B16R2.5 CCNC(=O)Cc1n[nH]c2c1cccc2 240690a_100015525214_100000044345 [0,2,0,0,0,0|1,0,0]=3 1460 B16R2.5 CCNC(=O)Cc1n[nH]c2c1cccc2 527a_100015525214_100000044345 [0,2,0,0,0,0|1,0,0]=3 1461 B16R2.5 CCNC(=O)Cc1noc2c1cccc2 11a_100015525214_100000205995 [0,2,0,0,0,0|2,0,0]=4 1462 B16R2.5 CCNC(=O)Cc1noc2c1cccc2 240690a_100015525214_100000205995 [0,2,0,0,0,0|2,0,0]=4 1463 B16R2.5 CCNC(=O)Cn1ccc2c1cccc2 11a_100015525214_100000743657 [0,2,0,0,0,0|2,0,0]=4 1464 B16R2.5 CCNC(=O)Cn1ccc2c1cccc2 240690a_100015525214_100000743657 [0,2,0,0,0,0|2,0,0]=4 1465 B16R2.5 CCNC(=O)Cn1ccc2c1cccc2 527a_100015525214_100000743657 [0,2,0,0,0,0|2,0,0]=4 1466 B16R2.5 CCNC(=O)Cn1cnc2c1cccc2 240690a_100015525214_100025771165 [0,2,0,0,0,0|1,0,1]=4 1467 B16R2.5 CCNC(C)Cc1c[nH]c2c1cccc2 270004a_100015525214_100000030300 [0,2,0,0,0,0|1,0,1]=4 1468 B16R2.5 CNNC(=O)C[n+]1csc2c1cccc2 22a_100016993582_100009813389 [0,2,0,0,0,0|2,0,0]=4 1469 B16R2.5 CNNC(=O)Cc1c[nH]c2c1cccc2 22a_100016993582_100000183835 [0,2,0,0,0,0|0,0,0]=2 1470 B16R2.5 CNNC(=O)Cc1c[nH]c2c1cccn2 22a_100016993582_100000687015 [0,2,0,0,0,0|1,0,0]=3 1471 B16R2.5 CNNC(=O)Cc1cnc2n1cccc2 22a_100016993582_100000070654 [0,2,0,0,0,0|1,0,1]=4 1472 B16R2.5 CNNC(=O)Cc1coc2c1cccc2 22a_100016993582_100000217546 [0,2,0,0,0,0|1,0,0]=3 1473 B16R2.5 CNNC(=O)Cc1csc2c1cccc2 22a_100016993582_100000741031 [0,2,0,0,0,0|1,0,0]=3 1474 B16R2.5 CNNC(=O)Cc1n[nH]c2c1cccc2 22a_100016993582_100000044345 [0,2,0,0,0,0|1,0,0]=3 1475 B16R2.5 CNNC(=O)Cc1noc2c1cccc2 22a_100016993582_100000205995 [0,2,0,0,0,0|2,0,0]=4 1476 B16R2.5 CNNC(=O)Cn1ccc2c1cccc2 22a_100016993582_100000743657 [0,2,0,0,0,0|2,0,0]=4 1477 B16R2.5 CNNC(=O)Cn1cnc2c1cccc2 22a_100016993582_100025771165 [0,2,0,0,0,0|1,0,1]=4 1478 B16R2.5 COCC(=O)Cc1csc2c1cccc2 1458a_100000210968_200000742921 [0,2,0,0,0,0|2,0,0]=4 1479 B16R2.5 CSCC(=O)Cc1csc2c1cccc2 1458a_100000184570_200000742921 [0,2,0,0,0,0|2,0,0]=4 1480 B16R2.5 N#CCC(=O)Cc1c[nH]c2c1cccc2 1458a_100000183835_100011214920 [0,2,0,0,0,0|0,0,1]=3 1481 B16R2.5 N#CCC(=O)Cc1c[nH]c2c1cccn2 1458a_100000687015_100011214920 [0,2,0,0,0,0|1,0,1]=4 1482 B16R2.5 N#CCC(=O)Cc1coc2c1cccc2 1458a_100000217546_100011214920 [0,2,0,0,0,0|1,0,1]=4 1483 B16R2.5 N#CCC(=O)Cc1csc2c1cccc2 1458a_100000741031_100011214920 [0,2,0,0,0,0|1,0,1]=4 1484 B16R2.5 N#CCC(=O)Cc1csc2c1cccc2 1458a_100051588842_200000742921 [0,2,0,0,0,0|1,0,1]=4 1485 B16R2.5 N#CCC(=O)Cc1n[nH]c2c1cccc2 1458a_100000044345_100011214920 [0,2,0,0,0,0|1,0,1]=4 1486 B16R2.5 O=C(C=CBr)Cc1csc2c1cccc2 1458a_100016273825_200000742921 [0,2,0,0,0,0|2,0,0]=4 1487 B16R2.5 O=C(C=CCl)Cc1csc2c1cccc2 1458a_200016279998_200000742921 [0,2,0,0,0,0|2,0,0]=4 1488 B16R2.5 O=C(C=CI)Cc1csc2c1cccc2 1458a_100016256311_200000742921 [0,2,0,0,0,0|2,0,0]=4 1489 B16R2.5 O=C(CCF)Cc1c[nH]c2c1cccc2 1458a_100000183835_100011217306 [0,2,0,0,0,0|1,0,0]=3 1490 B16R2.5 O=C(CCF)Cc1c[nH]c2c1cccn2 1458a_100000687015_100011217306 [0,2,0,0,0,0|2,0,0]=4 1491 B16R2.5 O=C(CCF)Cc1coc2c1cccc2 1458a_100000217546_100011217306 [0,2,0,0,0,0|2,0,0]=4 1492 B16R2.5 O=C(CCF)Cc1csc2c1cccc2 1458a_100000741031_100011217306 [0,2,0,0,0,0|2,0,0]=4 1493 B16R2.5 O=C(CCF)Cc1n[nH]c2c1cccc2 1458a_100000044345_100011217306 [0,2,0,0,0,0|2,0,0]=4 1494 B16R2.5 O=C(CCO)Cc1c[nH]c2c1cccc2 1458a_100000183835_100000211926 [0,2,0,0,0,0|1,0,0]=3 1495 B16R2.5 O=C(CCO)Cc1c[nH]c2c1cccn2 1458a_100000687015_100000211926 [0,2,0,0,0,0|2,0,0]=4 1496 B16R2.5 O=C(CCO)Cc1coc2c1cccc2 1458a_100000217546_100000211926 [0,2,0,0,0,0|2,0,0]=4 1497 B16R2.5 O=C(CCO)Cc1csc2c1cccc2 1458a_100000741031_100000211926 [0,2,0,0,0,0|2,0,0]=4 1498 B16R2.5 O=C(CCO)Cc1csc2c1cccc2 1458a_100011216618_200000742921 [0,2,0,0,0,0|2,0,0]=4 1499 B16R2.5 O=C(CCO)Cc1n[nH]c2c1cccc2 1458a_100000044345_100000211926 [0,2,0,0,0,0|2,0,0]=4 1500 B16R2.140 CCC(=O)Cc1c[nH]c2c1cccc2Br 1458a_100010219219_100000210202 [0,2,0,0,0,0|1,0,0]=3 1501 B16R2.140 CCC(=O)Cc1c[nH]c2c1cccc2C 1458a_200000049093_100000210202 [0,2,0,0,0,0|1,0,0]=3 1502 B16R2.140 CCC(=O)Cc1c[nH]c2c1cccc2Cl 1458a_100012356222_100000210202 [0,2,0,0,0,0|1,0,0]=3 1503 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2Br 11a_106832991635_100010219219 [0,2,0,0,0,0|0,0,0]=2 1504 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2Br 240690a_100102657272_100010219219 [0,2,0,0,0,0|0,0,0]=2 1505 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2Br 527a_100102657272_100010219219 [0,2,0,0,0,0|0,0,0]=2 1506 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2C 11a_106832991635_200000049093 [0,2,0,0,0,0|0,0,0]=2 1507 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2C 240690a_100102657272_200000049093 [0,2,0,0,0,0|0,0,0]=2 1508 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2C 527a_100102657272_200000049093 [0,2,0,0,0,0|0,0,0]=2 1509 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2Cl 11a_106832991635_100012356222 [0,2,0,0,0,0|0,0,0]=2 1510 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2Cl 240690a_100102657272_100012356222 [0,2,0,0,0,0|0,0,0]=2 1511 B16R2.140 CNC(=O)Cc1c[nH]c2c1cccc2Cl 527a_100102657272_100012356222 [0,2,0,0,0,0|0,0,0]=2 1512 B16R2.140 CNC(=O)Cc1cnc2n1cccc2C 11a_106832991635_100102706221 [0,2,0,0,0,0|1,0,1]=4 1513 B16R2.140 CNC(=O)Cc1cnc2n1cccc2C 1626a_100102657272_100102706221 [0,2,0,0,0,0|1,0,1]=4 1514 B16R2.140 CNC(=O)Cc1cnc2n1cccc2C 240690a_100102657272_100102706221 [0,2,0,0,0,0|1,0,1]=4 1515 B16R2.140 CNC(=O)Cn1ccc2c1cccc2Cl 11a_106832991635_200000721796 [0,2,0,0,0,0|2,0,0]=4 1516 B16R2.140 CNC(=O)Cn1ccc2c1cccc2Cl 1626a_100102657272_200000721796 [0,2,0,0,0,0|2,0,0]=4 1517 B16R2.140 CNC(=O)Cn1ccc2c1cccc2Cl 240690a_100102657272_200000721796 [0,2,0,0,0,0|2,0,0]=4 1518 B16R2.140 CNC(=O)Cn1ccc2c1cccc2Cl 527a_100102657272_200000721796 [0,2,0,0,0,0|2,0,0]=4 1519 B16R2.140 CNC(=O)Cn1ccc2c1cccc2F 11a_106832991635_100012177210 [0,2,0,0,0,0|2,0,0]=4 1520 B16R2.140 CNC(=O)Cn1ccc2c1cccc2F 1626a_100102657272_100012177210 [0,2,0,0,0,0|2,0,0]=4 1521 B16R2.140 CNC(=O)Cn1ccc2c1cccc2F 240690a_100102657272_100012177210 [0,2,0,0,0,0|2,0,0]=4 1522 B16R2.140 CNC(=O)Cn1ccc2c1cccc2F 527a_100102657272_100012177210 [0,2,0,0,0,0|2,0,0]=4 1523 B16R2.140 Cc1cccc2c1[nH]cc2CC(=O)CF 1458a_200000049093_100015361967 [0,2,0,0,0,0|1,0,0]=3 1524 B16R2.140 O=C(CF)Cc1c[nH]c2c1cccc2Br 1458a_100010219219_100015361967 [0,2,0,0,0,0|1,0,0]=3 1525 B16R2.140 O=C(CF)Cc1c[nH]c2c1cccc2Cl 1458a_100012356222_100015361967 [0,2,0,0,0,0|1,0,0]=3 1526 B16R2.2224 CNC(=O)C(C)n1cnc2c1cccc2 11a_106832991635_100000691514 [0,2,0,0,0,0|1,0,1]=4 1527 B16R2.2224 CNC(=O)C(C)n1cnc2c1cccc2 1626a_100102657272_100000691514 [0,2,0,0,0,0|1,0,1]=4 1528 B16R2.2224 CNC(=O)C(C)n1cnc2c1cccc2 240690a_100102657272_100000691514 [0,2,0,0,0,0|1,0,1]=4 1529 B16R2.2224 CNC(=O)C(C)n1cnc2c1cccc2 527a_100102657272_100000691514 [0,2,0,0,0,0|1,0,1]=4 1530 B16R2.33556 CCC(=O)Cc1cn(c2c1cccc2)C 1458a_100011218532_100000210202 [0,2,0,0,0,0|1,0,0]=3 1531 B16R2.33556 CNC(=O)Cc1cn(c2c1cccc2)C 11a_106832991635_100011218532 [0,2,0,0,0,0|0,0,0]=2 1532 B16R2.33556 CNC(=O)Cc1cn(c2c1cccc2)C 1626a_100102657272_100011218532 [0,2,0,0,0,0|0,0,0]=2 1533 B16R2.33556 CNC(=O)Cc1cn(c2c1cccc2)C 240690a_100102657272_100011218532 [0,2,0,0,0,0|0,0,0]=2 1534 B16R2.33556 CNC(=O)Cc1cn(c2c1cccc2)C 527a_100102657272_100011218532 [0,2,0,0,0,0|0,0,0]=2 1535 B16R2.33556 Cn1cc(c2c1cccc2)CC(=O)CF 1458a_100011218532_100015361967 [0,2,0,0,0,0|1,0,0]=3 1536 B16R2.33562 CCC(=O)Cc1c([nH]c2c1cccc2)C 1458a_100000737320_100000210202 [0,2,0,0,0,0|1,0,0]=3 1537 B16R2.33562 CNC(=O)CC1C(=O)Nc2c1cccc2 527a_100102657272_100000747281 [0,2,0,0,0,0|0,0,1]=3 1538 B16R2.33562 CNC(=O)Cc1c([nH]c2c1cccc2)C 11a_106832991635_100000737320 [0,2,0,0,0,0|0,0,0]=2 1539 B16R2.33562 CNC(=O)Cc1c([nH]c2c1cccc2)C 240690a_100102657272_100000737320 [0,2,0,0,0,0|0,0,0]=2 1540 B16R2.33562 CNC(=O)Cc1c([nH]c2c1cccc2)C 527a_100102657272_100000737320 [0,2,0,0,0,0|0,0,0]=2 1541 B16R2.33562 CNC(=O)Cn1c(=O)oc2c1cccc2 11a_106832991635_100000184755 [0,2,0,0,0,0|2,0,0]=4 1542 B16R2.33562 CNC(=O)Cn1c(=O)oc2c1cccc2 1626a_100102657272_100000184755 [0,2,0,0,0,0|2,0,0]=4 1543 B16R2.33562 CNC(=O)Cn1c(=O)oc2c1cccc2 240690a_100102657272_100000184755 [0,2,0,0,0,0|2,0,0]=4 1544 B16R2.33562 CNC(=O)Cn1c(=O)oc2c1cccc2 527a_100102657272_100000184755 [0,2,0,0,0,0|2,0,0]=4 1545 B16R2.33562 CNC(=O)Cn1c(=O)sc2c1cccc2 11a_106832991635_100000019295 [0,2,0,0,0,0|2,0,0]=4 1546 B16R2.33562 CNC(=O)Cn1c(=O)sc2c1cccc2 1626a_100102657272_100000019295 [0,2,0,0,0,0|2,0,0]=4 1547 B16R2.33562 CNC(=O)Cn1c(=O)sc2c1cccc2 240690a_100102657272_100000019295 [0,2,0,0,0,0|2,0,0]=4 1548 B16R2.33562 CNC(=O)Cn1c(=O)sc2c1cccc2 527a_100102657272_100000019295 [0,2,0,0,0,0|2,0,0]=4 1549 B16R2.33562 CNC(=O)Cn1c(cc2c1cccc2)C 11a_106832991635_100000209841 [0,2,0,0,0,0|2,0,0]=4 1550 B16R2.33562 CNC(=O)Cn1c(cc2c1cccc2)C 1626a_100102657272_100000209841 [0,2,0,0,0,0|2,0,0]=4 1551 B16R2.33562 CNC(=O)Cn1c(cc2c1cccc2)C 240690a_100102657272_100000209841 [0,2,0,0,0,0|2,0,0]=4 1552 B16R2.33562 CNC(=O)Cn1c(cc2c1cccc2)C 527a_100102657272_100000209841 [0,2,0,0,0,0|2,0,0]=4 1553 B16R2.33562 CNC(=O)Cn1c(nc2c1cccc2)C 11a_106832991635_100000766443 [0,2,0,0,0,0|1,0,1]=4 1554 B16R2.33562 CNC(=O)Cn1c(nc2c1cccc2)C 1626a_100102657272_100000766443 [0,2,0,0,0,0|1,0,1]=4 1555 B16R2.33562 CNC(=O)Cn1c(nc2c1cccc2)C 240690a_100102657272_100000766443 [0,2,0,0,0,0|1,0,1]=4 1556 B16R2.33562 CNC(=O)Cn1c(nc2c1cccc2)C 527a_100102657272_100000766443 [0,2,0,0,0,0|1,0,1]=4 1557 B16R2.33562 CNC(=O)NC1C(=O)Nc2c1cccc2 273464a_100102657272_200000746459 [0,2,0,0,0,0|1,0,1]=4 1558 B16R2.33562 Cc1[nH]c2ccccc2c1CC(=O)CF 1458a_100000737320_100015361967 [0,2,0,0,0,0|1,0,0]=3 1559 B16R2.34357 CCC(=O)Cc1c[nH]c2c1ccc(c2)Br 1458a_100000689255_100000210202 [0,2,0,0,0,0|1,0,0]=3 1560 B16R2.34357 CCC(=O)Cc1c[nH]c2c1ccc(c2)Cl 1458a_100000747776_100000210202 [0,2,0,0,0,0|1,0,0]=3 1561 B16R2.34357 CCC(=O)Cc1c[nH]c2c1ccc(c2)F 1458a_100102524959_100000210202 [0,2,0,0,0,0|1,0,0]=3 1562 B16R2.34357 CCC(=O)Cc1coc2c1ccc(c2)O 1458a_100000010777_100000210202 [0,2,0,0,0,0|2,0,0]=4 1563 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)Br 11a_106832991635_100000689255 [0,2,0,0,0,0|0,0,0]=2 1564 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)Br 240690a_100102657272_100000689255 [0,2,0,0,0,0|0,0,0]=2 1565 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)Br 527a_100102657272_100000689255 [0,2,0,0,0,0|0,0,0]=2 1566 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)Cl 11a_106832991635_100000747776 [0,2,0,0,0,0|0,0,0]=2 1567 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)Cl 1626a_100102657272_100000747776 [0,2,0,0,0,0|0,0,0]=2 1568 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)Cl 240690a_100102657272_100000747776 [0,2,0,0,0,0|0,0,0]=2 1569 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)Cl 527a_100102657272_100000747776 [0,2,0,0,0,0|0,0,0]=2 1570 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)F 11a_106832991635_100102524959 [0,2,0,0,0,0|0,0,0]=2 1571 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)F 1626a_100102657272_100102524959 [0,2,0,0,0,0|0,0,0]=2 1572 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)F 240690a_100102657272_100102524959 [0,2,0,0,0,0|0,0,0]=2 1573 B16R2.34357 CNC(=O)Cc1c[nH]c2c1ccc(c2)F 527a_100102657272_100102524959 [0,2,0,0,0,0|0,0,0]=2 1574 B16R2.34357 CNC(=O)Cc1coc2c1ccc(c2)O 240690a_100102657272_100000010777 [0,2,0,0,0,0|1,0,0]=3 1575 B16R2.34357 CNC(=O)Cc1noc2c1ccc(c2)Br 11a_106832991635_100010987740 [0,2,0,0,0,0|2,0,0]=4 1576 B16R2.34357 CNC(=O)Cc1noc2c1ccc(c2)Br 1626a_100102657272_100010987740 [0,2,0,0,0,0|2,0,0]=4 1577 B16R2.34357 CNC(=O)Cc1noc2c1ccc(c2)Br 240690a_100102657272_100010987740 [0,2,0,0,0,0|2,0,0]=4 1578 B16R2.34357 COC(=O)Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010364033 [0,2,0,0,0,0|1,0,0]=3 1579 B16R2.34357 O=C(CF)Cc1c[nH]c2c1ccc(c2)Br 1458a_100000689255_100015361967 [0,2,0,0,0,0|1,0,0]=3 1580 B16R2.34357 O=C(CF)Cc1c[nH]c2c1ccc(c2)Cl 1458a_100000747776_100015361967 [0,2,0,0,0,0|1,0,0]=3 1581 B16R2.34357 O=C(CF)Cc1c[nH]c2c1ccc(c2)F 1458a_100102524959_100015361967 [0,2,0,0,0,0|1,0,0]=3 1582 B16R2.34357 O=C(CF)Cc1coc2c1ccc(c2)O 1458a_100000010777_100015361967 [0,2,0,0,0,0|2,0,0]=4 1583 B16R2.176317 CCC(=O)Cc1c[nH]c2c1c(ccc2)Br 1458a_100000692793_100000210202 [0,2,0,0,0,0|1,0,0]=3 1584 B16R2.176317 CCC(=O)Cc1c[nH]c2c1c(ccc2)C 1458a_100102558282_100000210202 [0,2,0,0,0,0|1,0,0]=3 1585 B16R2.176317 CCC(=O)Cc1c[nH]c2c1c(ccc2)Cl 1458a_100012339537_100000210202 [0,2,0,0,0,0|1,0,0]=3 1586 B16R2.176317 CCC(=O)Cc1c[nH]c2c1c(ccc2)F 1458a_100011997205_100000210202 [0,2,0,0,0,0|1,0,0]=3 1587 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)Br 11a_106832991635_100000692793 [0,2,0,0,0,0|0,0,0]=2 1588 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)Br 240690a_100102657272_100000692793 [0,2,0,0,0,0|0,0,0]=2 1589 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)Br 527a_100102657272_100000692793 [0,2,0,0,0,0|0,0,0]=2 1590 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)C 11a_106832991635_100102558282 [0,2,0,0,0,0|0,0,0]=2 1591 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)C 527a_100102657272_100102558282 [0,2,0,0,0,0|0,0,0]=2 1592 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)Cl 11a_106832991635_100012339537 [0,2,0,0,0,0|0,0,0]=2 1593 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)Cl 240690a_100102657272_100012339537 [0,2,0,0,0,0|0,0,0]=2 1594 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)Cl 527a_100102657272_100012339537 [0,2,0,0,0,0|0,0,0]=2 1595 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)F 11a_106832991635_100011997205 [0,2,0,0,0,0|0,0,0]=2 1596 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)F 240690a_100102657272_100011997205 [0,2,0,0,0,0|0,0,0]=2 1597 B16R2.176317 CNC(=O)Cc1c[nH]c2c1c(ccc2)F 527a_100102657272_100011997205 [0,2,0,0,0,0|0,0,0]=2 1598 B16R2.176317 Cc1cccc2c1c(c[nH]2)CC(=O)CF 1458a_100102558282_100015361967 [0,2,0,0,0,0|1,0,0]=3 1599 B16R2.176317 O=C(CF)Cc1c[nH]c2c1c(ccc2)Br 1458a_100000692793_100015361967 [0,2,0,0,0,0|1,0,0]=3 1600 B16R2.176317 O=C(CF)Cc1c[nH]c2c1c(ccc2)Cl 1458a_100012339537_100015361967 [0,2,0,0,0,0|1,0,0]=3 1601 B16R2.176317 O=C(CF)Cc1c[nH]c2c1c(ccc2)F 1458a_100011997205_100015361967 [0,2,0,0,0,0|1,0,0]=3 1602 B16R2.176359 C#CC(=O)Cc1csc2c1cc(cc2)Cl 1458a_100000211873_100009814428 [0,2,0,0,0,0|2,0,0]=4 1603 B16R2.176359 C#CC(=O)Cc1csc2c1cc(cc2)F 1458a_100000211873_100010109839 [0,2,0,0,0,0|2,0,0]=4 1604 B16R2.176359 C=CC(=O)Cc1csc2c1cc(cc2)Cl 1458a_100000185746_100009814428 [0,2,0,0,0,0|2,0,0]=4 1605 B16R2.176359 C=CC(=O)Cc1csc2c1cc(cc2)F 1458a_100000185746_100010109839 [0,2,0,0,0,0|2,0,0]=4 1606 B16R2.176359 CCC(=O)Cc1c[nH]c2c1cc(cc2)Br 1458a_100000742623_100000210202 [0,2,0,0,0,0|1,0,0]=3 1607 B16R2.176359 CCC(=O)Cc1c[nH]c2c1cc(cc2)C 1458a_100102525273_100000210202 [0,2,0,0,0,0|1,0,0]=3 1608 B16R2.176359 CCC(=O)Cc1c[nH]c2c1cc(cc2)Cl 1458a_100000758855_100000210202 [0,2,0,0,0,0|1,0,0]=3 1609 B16R2.176359 CCC(=O)Cc1c[nH]c2c1cc(cc2)F 1458a_100102525430_100000210202 [0,2,0,0,0,0|1,0,0]=3 1610 B16R2.176359 CCC(=O)Cc1c[nH]c2c1cc(cc2)O 1458a_100000031536_100000210202 [0,2,0,0,0,0|1,0,0]=3 1611 B16R2.176359 CCC(=O)Cc1coc2c1cc(cc2)C 1458a_100000188615_100000210202 [0,2,0,0,0,0|2,0,0]=4 1612 B16R2.176359 CCC(=O)Cc1csc2c1cc(cc2)C 1458a_100000242747_100000210202 [0,2,0,0,0,0|2,0,0]=4 1613 B16R2.176359 CCC(=O)Cc1csc2c1cc(cc2)Cl 1458a_100000210414_100009814428 [0,2,0,0,0,0|2,0,0]=4 1614 B16R2.176359 CCC(=O)Cc1csc2c1cc(cc2)Cl 1458a_100000692288_100000210202 [0,2,0,0,0,0|2,0,0]=4 1615 B16R2.176359 CCC(=O)Cc1csc2c1cc(cc2)F 1458a_100000210414_100010109839 [0,2,0,0,0,0|2,0,0]=4 1616 B16R2.176359 CCC(=O)Cc1n[nH]c2c1cc(cc2)Cl 1458a_100010209749_100000210202 [0,2,0,0,0,0|2,0,0]=4 1617 B16R2.176359 CCC(=O)Cc1n[nH]c2c1cc(cc2)F 1458a_200102525442_100000210202 [0,2,0,0,0,0|2,0,0]=4 1618 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)Br 11a_106832991635_100000742623 [0,2,0,0,0,0|0,0,0]=2 1619 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)Br 240690a_100102657272_100000742623 [0,2,0,0,0,0|0,0,0]=2 1620 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)Br 527a_100102657272_100000742623 [0,2,0,0,0,0|0,0,0]=2 1621 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)C 240690a_100102657272_100102525273 [0,2,0,0,0,0|0,0,0]=2 1622 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)C 527a_100102657272_100102525273 [0,2,0,0,0,0|0,0,0]=2 1623 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)Cl 11a_106832991635_100000758855 [0,2,0,0,0,0|0,0,0]=2 1624 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)Cl 1626a_100102657272_100000758855 [0,2,0,0,0,0|0,0,0]=2 1625 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)Cl 240690a_100102657272_100000758855 [0,2,0,0,0,0|0,0,0]=2 1626 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)Cl 527a_100102657272_100000758855 [0,2,0,0,0,0|0,0,0]=2 1627 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)F 11a_106832991635_100102525430 [0,2,0,0,0,0|0,0,0]=2 1628 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)F 1626a_100102657272_100102525430 [0,2,0,0,0,0|0,0,0]=2 1629 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)F 240690a_100102657272_100102525430 [0,2,0,0,0,0|0,0,0]=2 1630 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)F 527a_100102657272_100102525430 [0,2,0,0,0,0|0,0,0]=2 1631 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)O 11a_106832991635_100000031536 [0,2,0,0,0,0|0,0,0]=2 1632 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)O 240690a_100102657272_100000031536 [0,2,0,0,0,0|0,0,0]=2 1633 B16R2.176359 CNC(=O)Cc1c[nH]c2c1cc(cc2)O 527a_100102657272_100000031536 [0,2,0,0,0,0|0,0,0]=2 1634 B16R2.176359 CNC(=O)Cc1coc2c1cc(cc2)C 11a_106832991635_100000188615 [0,2,0,0,0,0|1,0,0]=3 1635 B16R2.176359 CNC(=O)Cc1coc2c1cc(cc2)C 1626a_100102657272_100000188615 [0,2,0,0,0,0|1,0,0]=3 1636 B16R2.176359 CNC(=O)Cc1coc2c1cc(cc2)C 240690a_100102657272_100000188615 [0,2,0,0,0,0|1,0,0]=3 1637 B16R2.176359 CNC(=O)Cc1coc2c1cc(cc2)C 527a_100102657272_100000188615 [0,2,0,0,0,0|1,0,0]=3 1638 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)C 11a_106832991635_100000242747 [0,2,0,0,0,0|1,0,0]=3 1639 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)C 1626a_100102657272_100000242747 [0,2,0,0,0,0|1,0,0]=3 1640 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)C 240690a_100102657272_100000242747 [0,2,0,0,0,0|1,0,0]=3 1641 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)C 527a_100102657272_100000242747 [0,2,0,0,0,0|1,0,0]=3 1642 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)Cl 11a_106832991635_100000692288 [0,2,0,0,0,0|1,0,0]=3 1643 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)Cl 1626a_100102657272_100000692288 [0,2,0,0,0,0|1,0,0]=3 1644 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)Cl 240690a_100102657272_100000692288 [0,2,0,0,0,0|1,0,0]=3 1645 B16R2.176359 CNC(=O)Cc1csc2c1cc(cc2)Cl 527a_100102657272_100000692288 [0,2,0,0,0,0|1,0,0]=3 1646 B16R2.176359 CNC(=O)Cc1n[nH]c2c1cc(cc2)Cl 240690a_100102657272_100010209749 [0,2,0,0,0,0|1,0,0]=3 1647 B16R2.176359 CNC(=O)Cc1n[nH]c2c1cc(cc2)Cl 527a_100102657272_100010209749 [0,2,0,0,0,0|1,0,0]=3 1648 B16R2.176359 CNC(=O)Cc1n[nH]c2c1cc(cc2)F 240690a_100102657272_200102525442 [0,2,0,0,0,0|1,0,0]=3 1649 B16R2.176359 CNC(=O)Cc1n[nH]c2c1cc(cc2)F 527a_100102657272_200102525442 [0,2,0,0,0,0|1,0,0]=3 1650 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Br 11a_106832991635_200000721800 [0,2,0,0,0,0|2,0,0]=4 1651 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Br 1626a_100102657272_200000721800 [0,2,0,0,0,0|2,0,0]=4 1652 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Br 240690a_100102657272_200000721800 [0,2,0,0,0,0|2,0,0]=4 1653 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Br 527a_100102657272_200000721800 [0,2,0,0,0,0|2,0,0]=4 1654 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Cl 11a_106832991635_100000744275 [0,2,0,0,0,0|2,0,0]=4 1655 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Cl 1626a_100102657272_100000744275 [0,2,0,0,0,0|2,0,0]=4 1656 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Cl 240690a_100102657272_100000744275 [0,2,0,0,0,0|2,0,0]=4 1657 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)Cl 527a_100102657272_100000744275 [0,2,0,0,0,0|2,0,0]=4 1658 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)F 11a_106832991635_100000721773 [0,2,0,0,0,0|2,0,0]=4 1659 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)F 1626a_100102657272_100000721773 [0,2,0,0,0,0|2,0,0]=4 1660 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)F 240690a_100102657272_100000721773 [0,2,0,0,0,0|2,0,0]=4 1661 B16R2.176359 CNC(=O)Cn1ccc2c1cc(cc2)F 527a_100102657272_100000721773 [0,2,0,0,0,0|2,0,0]=4 1662 B16R2.176359 Cc1ccc2[nH]cc(c2c1)CC(=O)CF 1458a_100102525273_100015361967 [0,2,0,0,0,0|1,0,0]=3 1663 B16R2.176359 Cc1ccc2occ(c2c1)CC(=O)CF 1458a_100000188615_100015361967 [0,2,0,0,0,0|2,0,0]=4 1664 B16R2.176359 Cc1ccc2scc(c2c1)CC(=O)CF 1458a_100000242747_100015361967 [0,2,0,0,0,0|2,0,0]=4 1665 B16R2.176359 O=C(CF)Cc1c[nH]c2c1cc(cc2)Br 1458a_100000742623_100015361967 [0,2,0,0,0,0|1,0,0]=3 1666 B16R2.176359 O=C(CF)Cc1c[nH]c2c1cc(cc2)Cl 1458a_100000758855_100015361967 [0,2,0,0,0,0|1,0,0]=3 1667 B16R2.176359 O=C(CF)Cc1c[nH]c2c1cc(cc2)F 1458a_100102525430_100015361967 [0,2,0,0,0,0|1,0,0]=3 1668 B16R2.176359 O=C(CF)Cc1c[nH]c2c1cc(cc2)O 1458a_100000031536_100015361967 [0,2,0,0,0,0|1,0,0]=3 1669 B16R2.176359 O=C(CF)Cc1csc2c1cc(cc2)Cl 1458a_100000692288_100015361967 [0,2,0,0,0,0|2,0,0]=4 1670 B16R2.176359 O=C(CF)Cc1n[nH]c2c1cc(cc2)Cl 1458a_100010209749_100015361967 [0,2,0,0,0,0|2,0,0]=4 1671 B16R2.176359 O=C(CF)Cc1n[nH]c2c1cc(cc2)F 1458a_200102525442_100015361967 [0,2,0,0,0,0|2,0,0]=4 1672 B16R2.176359 O=C(CO)Cc1csc2c1cc(cc2)Cl 1458a_100000210174_100009814428 [0,2,0,0,0,0|2,0,0]=4 1673 B16R2.176359 O=C(CO)Cc1csc2c1cc(cc2)F 1458a_100000210174_100010109839 [0,2,0,0,0,0|2,0,0]=4 1674 B16R2.2482 C=Cc1ccc2c(c[nH]c2c1)OC(=O)C 271570a_100011290941_200009817283 [0,2,0,0,0,0|2,0,0]=4 1675 B16R2.2482 COc1ccc2c(c[nH]c2c1)CC(=O)C 1458a_100102525305_200000210301 [0,2,0,0,0,0|1,0,0]=3 1676 B16R2.2482 COc1ccc2c(c[nH]c2c1)CC(=O)[13CH3] 1458a_100102525305_200025704644 [0,2,0,0,0,0|1,0,0]=3 1677 B16R2.2482 COc1ccc2c(coc2c1)CC(=O)C 1458a_100000184357_200000210301 [0,2,0,0,0,0|2,0,0]=4 1678 B16R2.2482 COc1ccc2c(coc2c1)CC(=O)[13CH3] 1458a_100000184357_200025704644 [0,2,0,0,0,0|2,0,0]=4 1679 B16R2.13690 CC(=O)Cc1c[nH]c2c1cc(c(c2)F)F 1458a_100102524944_200000210301 [0,2,0,0,0,0|1,0,0]=3 1680 B16R2.13690 [13CH3]C(=O)Cc1c[nH]c2c1cc(c(c2)F)F 1458a_100102524944_200025704644 [0,2,0,0,0,0|1,0,0]=3 1681 B16R2.16135 CC(=O)Cc1coc2c1c(cc(c2)C)C 1458a_200011934317_200000210301 [0,2,0,0,0,0|2,0,0]=4 1682 B16R2.16135 Cc1cc(c2c(coc2c1)CC(=O)[13CH3])C 1458a_200011934317_200025704644 [0,2,0,0,0,0|2,0,0]=4 1683 B16R2.12021 CC(=O)CC1=C(Cc2c1cc(cc2)F)C 1458a_100000066454_200000210301 [0,2,0,0,0,0|2,0,0]=4 1684 B16R2.12021 CC(=O)Cc1c([nH]c2c1cc(cc2)Br)C 1458a_100000738758_200000210301 [0,2,0,0,0,0|1,0,0]=3 1685 B16R2.12021 CC(=O)Cc1c([nH]c2c1cc(cc2)Cl)C 1458a_100016600606_200000210301 [0,2,0,0,0,0|1,0,0]=3 1686 B16R2.12021 CC(=O)Cc1c([nH]c2c1cc(cc2)F)C 1458a_100000044558_200000210301 [0,2,0,0,0,0|1,0,0]=3 1687 B16R2.12021 CC1=C(c2cc(ccc2C1)F)CC(=O)[13CH3] 1458a_100000066454_200025704644 [0,2,0,0,0,0|2,0,0]=4 1688 B16R2.12021 Cc1[nH]c2ccc(cc2c1CC(=O)[13CH3])Br 1458a_100000738758_200025704644 [0,2,0,0,0,0|1,0,0]=3 1689 B16R2.12021 Cc1[nH]c2ccc(cc2c1CC(=O)[13CH3])Cl 1458a_100016600606_200025704644 [0,2,0,0,0,0|1,0,0]=3 1690 B16R2.12021 Cc1[nH]c2ccc(cc2c1CC(=O)[13CH3])F 1458a_100000044558_200025704644 [0,2,0,0,0,0|1,0,0]=3 1691 B16R2.44951 CC(=O)Cn1c(=O)n(c2c1cccc2)C 1458a_100000244626_200000210301 [0,2,0,0,0,0|2,0,0]=4 1692 B16R2.44951 Cn1c(=O)n(c2c1cccc2)CC(=O)[13CH3] 1458a_100000244626_200025704644 [0,2,0,0,0,0|2,0,0]=4 1693 B16R2.42567 C=Cc1ccc2[nH]cc(c2c1)CC(=O)N 271570a_100011290941_100009990690 [0,2,0,0,0,0|0,0,0]=2 1694 B16R2.42567 C=Cc1ccc2[nH]cc(c2c1)OC(=O)C 271570a_100011290941_100000755435 [0,2,0,0,0,0|2,0,0]=4 1695 B16R2.42567 CCc1ccc2[nH]cc(c2c1)CC(=O)C 1458a_100000049097_200000210301 [0,2,0,0,0,0|1,0,0]=3 1696 B16R2.42567 CCc1ccc2[nH]cc(c2c1)CC(=O)[13CH3] 1458a_100000049097_200025704644 [0,2,0,0,0,0|1,0,0]=3 1697 B16R2.42567 COc1ccc2[nH]cc(c2c1)CC(=O)C 1458a_100000739362_200000210301 [0,2,0,0,0,0|1,0,0]=3 1698 B16R2.42567 COc1ccc2[nH]cc(c2c1)CC(=O)[13CH3] 1458a_100000739362_200025704644 [0,2,0,0,0,0|1,0,0]=3 1699 B16R2.42567 CSc1ccc2[nH]cc(c2c1)CC(=O)N 62a_100009990690_200000210301 [0,2,0,0,0,0|0,0,0]=2 1700 B16R2.42567 [13CH3]Sc1ccc2[nH]cc(c2c1)CC(=O)N 62a_100009990690_200025704644 [0,2,0,0,0,0|0,0,0]=2 1701 B14R2.1073 C=Cc1cccc2c1CCC(=O)N2 271570a_100011290941_100010232564 [0,0,1,1,0,0|1,0,1]=4 1702 B14R2.1073 C=Cc1cccc2c1OCC(=O)N2 271570a_100011290941_100012355675 [0,0,1,1,0,0|2,0,0]=4 1703 B14R2.1073 C=Cc1cccc2c1ccc(=O)[nH]2 271570a_100011290941_100000726145 [0,0,1,1,0,0|1,0,1]=4 1704 B14R2.256 Cc1nc(c[nH]1)c2ccccc2N 271570a_100000034411_100009814057 [0,0,1,1,0,0|2,0,0]=4 1705 B14R2.256 Nc1nc(cs1)c2ccccc2N 271570a_100000034411_100011998049 [0,0,1,1,0,0|1,1,0]=4 1706 B14R2.21 O=c1cccc([nH]1)c2ccccc2 271570a_100011218836_100000761760 [0,0,1,1,0,0|1,0,1]=4 1707 B14R2.768 CC(=O)Cc1cn2ccccc2n1 1458a_100000070787_100000689847 [0,0,1,1,0,0|2,0,0]=4 1708 B14R2.1146 C=Cc1cc(=O)[nH]c2c1cccc2 271570a_100011290941_100000075698 [0,0,1,1,0,0|1,0,1]=4 1709 B14R2.9440 CC(=O)Cc1cccc2c1[nH]nc2 1458a_100000070787_100000099550 [0,0,1,1,0,0|2,0,0]=4 1710 B14R2.9440 CC(=O)Cc1cccc2c1scc2 1458a_100000070787_100009816938 [0,0,1,1,0,0|2,0,0]=4 1711 B14R2.9440 CC(=O)Nc1cccc2c1[nH]cc2 11a_100000685717_100015343762 [0,0,1,1,0,0|2,0,0]=4 1712 B14R2.9440 CC(=O)Nc1cccc2c1[nH]cc2 1626a_100000685717_100015343762 [0,0,1,1,0,0|2,0,0]=4 1713 B14R2.9440 CC(=O)Nc1cccc2c1[nH]cc2 22a_100000685717_100000070787 [0,0,1,1,0,0|2,0,0]=4 1714 B14R2.9440 CC(=O)Nc1cccc2c1[nH]cc2 527a_100000685717_100103153847 [0,0,1,1,0,0|2,0,0]=4 1715 B16R3.1272 CNC1Cc2[nH]c3ccccc3c2C1 2230a_100009852730_200000210301 [0,1,0,1,0,0|1,0,1]=4 1716 B16R3.1272 [13CH3]NC1Cc2[nH]c3ccccc3c2C1 2230a_100009852730_200025704644 [0,1,0,1,0,0|1,0,1]=4 1717 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [0,0,1,0,1,0|2,0,0]=4 1718 B12R1.75 C=Cc1ccccc1CC(=O)N 271570a_100011290941_200009814924 [0,0,1,0,1,0|1,0,0]=3 1719 B12R1.75 C=Cc1ccccc1NC(=O)N 271570a_100011290941_100000742221 [0,0,1,0,1,0|2,0,0]=4 1720 B12R1.75 CSc1ccccc1CC(=O)N 62a_200000210301_200009814924 [0,0,1,0,1,0|1,0,1]=4 1721 B12R1.75 CSc1ccccc1CC(=O)N 62a_200009814924_200000210301 [0,0,1,0,1,0|1,0,1]=4 1722 B12R1.75 [13CH3]Sc1ccccc1CC(=O)N 62a_200009814924_200025704644 [0,0,1,0,1,0|1,0,1]=4 1723 B12R1.75 [13CH3]Sc1ccccc1CC(=O)N 62a_200025704644_200009814924 [0,0,1,0,1,0|1,0,1]=4 1724 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [0,0,1,0,1,0|1,0,0]=3 1725 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [0,0,1,0,1,0|1,0,0]=3 1726 B12R1.252 CC(=O)C=CSc1ccccc1 1458a_100016262050_200000210301 [0,0,1,0,1,0|2,0,0]=4 1727 B12R1.252 NC(=O)CCNc1ccccc1 34a_100000106764_100000731001 [0,0,1,0,1,0|0,0,1]=3 1728 B12R1.252 NC(=O)CCOc1ccccc1 34a_100000210340_100000731001 [0,0,1,0,1,0|1,0,1]=4 1729 B12R1.252 NC(=O)CCOc1ccccc1 7a_100000210340_100000744528 [0,0,1,0,1,0|1,0,1]=4 1730 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000719477_100000744528 [0,0,1,0,1,0|1,0,1]=4 1731 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000744528_100000041952 [0,0,1,0,1,0|1,0,1]=4 1732 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100000711301_100015291786 [0,0,1,0,1,0|1,0,1]=4 1733 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100015324214_100000747473 [0,0,1,0,1,0|1,0,1]=4 1734 B12R1.252 NC(=O)CNCc1ccccc1 34a_100015324214_100000187820 [0,0,1,0,1,0|1,0,1]=4 1735 B12R1.252 NC(=O)COCc1ccccc1 34a_100000210790_100000187820 [0,0,1,0,1,0|1,0,1]=4 1736 B12R1.252 NC(=O)COCc1ccccc1 7a_100000210790_100000187820 [0,0,1,0,1,0|1,0,1]=4 1737 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000211182_100000747473 [0,0,1,0,1,0|1,0,1]=4 1738 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000747473_100015291786 [0,0,1,0,1,0|1,0,1]=4 1739 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [0,0,1,0,1,0|1,0,0]=3 1740 B12R1.252 [13CH3]C(=O)C=CSc1ccccc1 1458a_100016262050_200025704644 [0,0,1,0,1,0|2,0,0]=4 1741 B14R1.96 C=Cc1ccccc1COCC(=O)N 34a_200010883148_100000187820 [0,0,1,0,0,1|1,0,1]=4 1742 B14R1.96 C=Cc1ccccc1COCC(=O)N 7a_200010883148_100000187820 [0,0,1,0,0,1|1,0,1]=4 1743 B14R1.96 C=Cc1ccccc1NCCC(=O)N 34a_100012022501_100000731001 [0,0,1,0,0,1|1,0,1]=4 1744 B14R1.96 C=Cc1ccccc1SCCC(=O)N 62a_100000744528_100011218376 [0,0,1,0,0,1|1,0,1]=4 1745 B14R1.96 C=Cc1ccccc1SCCC(=O)N 62a_100011218376_100000744528 [0,0,1,0,0,1|1,0,1]=4 1746 B14R1.96 CNc1ccccc1OCCC(=O)N 34a_100000033821_100000731001 [0,0,1,0,0,1|0,0,2]=4 1747 B14R1.96 CNc1ccccc1SCCC(=O)N 62a_100000744528_100020606079 [0,0,1,0,0,1|0,0,2]=4 1748 B14R1.96 CNc1ccccc1SCCC(=O)N 62a_100020606079_100000744528 [0,0,1,0,0,1|0,0,2]=4 1749 B14R1.96 NNc1ccccc1SCCC(=O)N 62a_100000241748_100000744528 [0,0,1,0,0,1|1,0,1]=4 1750 B14R1.96 NNc1ccccc1SCCC(=O)N 62a_100000744528_100000241748 [0,0,1,0,0,1|1,0,1]=4 1751 B14R1.160 CC(OCC(=O)N)c1ccccc1N 7a_100011405641_100000187820 [0,0,1,0,0,1|0,0,2]=4 1752 B14R1.160 Cc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000212026 [0,0,1,0,0,1|2,0,0]=4 1753 B14R1.160 Cc1ccccc1C(=O)NCC(=O)N 240690a_100000711301_100000212026 [0,0,1,0,0,1|2,0,0]=4 1754 B14R1.160 Cc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000212026 [0,0,1,0,0,1|2,0,0]=4 1755 B14R1.160 NC(=O)CNC(=O)c1ccccc1Br 11a_100000711301_100000188424 [0,0,1,0,0,1|2,0,0]=4 1756 B14R1.160 NC(=O)CNC(=O)c1ccccc1Br 240690a_100000711301_100000188424 [0,0,1,0,0,1|2,0,0]=4 1757 B14R1.160 NC(=O)CNC(=O)c1ccccc1Br 527a_100000711301_100000188424 [0,0,1,0,0,1|2,0,0]=4 1758 B14R1.160 NC(=O)CNC(=O)c1ccccc1Cl 11a_100000711301_100000185844 [0,0,1,0,0,1|2,0,0]=4 1759 B14R1.160 NC(=O)CNC(=O)c1ccccc1Cl 240690a_100000711301_100000185844 [0,0,1,0,0,1|2,0,0]=4 1760 B14R1.160 NC(=O)CNC(=O)c1ccccc1Cl 527a_100000711301_100000185844 [0,0,1,0,0,1|2,0,0]=4 1761 B14R1.160 NC(=O)CNC(=O)c1ccccc1F 11a_100000711301_100000188656 [0,0,1,0,0,1|2,0,0]=4 1762 B14R1.160 NC(=O)CNC(=O)c1ccccc1F 240690a_100000711301_100000188656 [0,0,1,0,0,1|2,0,0]=4 1763 B14R1.160 NC(=O)CNC(=O)c1ccccc1F 527a_100000711301_100000188656 [0,0,1,0,0,1|2,0,0]=4 1764 B14R1.160 NC(=O)CNC(=O)c1ccccc1I 11a_100000711301_100000187884 [0,0,1,0,0,1|2,0,0]=4 1765 B14R1.160 NC(=O)CNC(=O)c1ccccc1I 240690a_100000711301_100000187884 [0,0,1,0,0,1|2,0,0]=4 1766 B14R1.160 NC(=O)CNC(=O)c1ccccc1I 527a_100000711301_100000187884 [0,0,1,0,0,1|2,0,0]=4 1767 B14R1.160 NC(=O)CNC(=O)c1ccccc1O 240690a_100000711301_100015234032 [0,0,1,0,0,1|2,0,0]=4 1768 B14R1.160 NC(=O)CNC(=O)c1ccccc1[O-] 240690a_100000711301_100009911694 [0,0,1,0,0,1|2,0,0]=4 1769 B14R1.160 NC(=O)CNC(=O)c1ccccc1[O-] 527a_100000711301_100009911694 [0,0,1,0,0,1|2,0,0]=4 1770 B14R1.337 Cc1ccccc1CC(=O)CC(=O)N 1458a_100000212180_100000187820 [0,0,1,0,0,1|2,0,0]=4 1771 B14R1.337 Cc1ccccc1CC(=O)CC(=O)N 1458a_100134613110_100000211839 [0,0,1,0,0,1|2,0,0]=4 1772 B14R1.337 Cc1ccccc1NC(=O)CC(=O)N 22a_100015192222_100134613110 [0,0,1,0,0,1|2,0,0]=4 1773 B14R1.337 Cc1ccccc1NC(=O)CC(=O)N 527a_100015192222_100134613110 [0,0,1,0,0,1|2,0,0]=4 1774 B14R1.337 NC(=O)CC(=O)Cc1ccccc1Br 1458a_100000751119_100000187820 [0,0,1,0,0,1|2,0,0]=4 1775 B14R1.337 NC(=O)CC(=O)Cc1ccccc1Br 1458a_100134613110_100000184730 [0,0,1,0,0,1|2,0,0]=4 1776 B14R1.337 NC(=O)CC(=O)Cc1ccccc1Cl 1458a_100000183793_100000187820 [0,0,1,0,0,1|2,0,0]=4 1777 B14R1.337 NC(=O)CC(=O)Cc1ccccc1Cl 1458a_100134613110_100000187162 [0,0,1,0,0,1|2,0,0]=4 1778 B14R1.337 NC(=O)CC(=O)Cc1ccccc1F 1458a_100000212012_100000187820 [0,0,1,0,0,1|2,0,0]=4 1779 B14R1.337 NC(=O)CC(=O)Cc1ccccc1F 1458a_100134613110_100000187165 [0,0,1,0,0,1|2,0,0]=4 1780 B14R1.337 NC(=O)CC(=O)Cc1ccccc1I 1458a_100000036491_100000187820 [0,0,1,0,0,1|2,0,0]=4 1781 B14R1.337 NC(=O)CC(=O)Cc1ccccc1I 1458a_100134613110_100011216222 [0,0,1,0,0,1|2,0,0]=4 1782 B14R1.337 NC(=O)CC(=O)Cc1ccccc1O 1458a_100000743006_100000187820 [0,0,1,0,0,1|2,0,0]=4 1783 B14R1.337 NC(=O)CC(=O)Nc1ccccc1Cl 22a_100000185783_100134613110 [0,0,1,0,0,1|2,0,0]=4 1784 B14R1.337 NC(=O)CC(=O)Nc1ccccc1Cl 527a_100000185783_100134613110 [0,0,1,0,0,1|2,0,0]=4 1785 B14R1.337 NC(=O)CC(=O)Nc1ccccc1F 22a_100000210422_100134613110 [0,0,1,0,0,1|2,0,0]=4 1786 B14R1.337 NC(=O)CC(=O)Nc1ccccc1F 527a_100000210422_100134613110 [0,0,1,0,0,1|2,0,0]=4 1787 B14R1.337 NC(=O)CC(=O)Nc1ccccc1O 22a_100000185747_100134613110 [0,0,1,0,0,1|2,0,0]=4 1788 B14R1.337 NC(=O)CC(=O)Nc1ccccc1O 527a_100000185747_100134613110 [0,0,1,0,0,1|2,0,0]=4 1789 B14R1.422 NC(=O)CCCNCc1ccccc1 34a_100000739312_100015291786 [0,0,1,0,0,1|0,0,2]=4 1790 B14R1.422 NC(=O)CCCNCc1ccccc1 34a_100015324214_100102525003 [0,0,1,0,0,1|0,0,2]=4 1791 B14R1.422 NC(=O)CNC/C=C/c1ccccc1 2230a_100000711301_100016265936 [0,0,1,0,0,1|1,0,1]=4 1792 B14R1.422 NC(=O)CNC/C=C/c1ccccc1 2230a_100020603302_100000747473 [0,0,1,0,0,1|1,0,1]=4 1793 B14R1.422 NC(=O)CNC/C=C/c1ccccc1 34a_100020603302_100000187820 [0,0,1,0,0,1|1,0,1]=4 1794 B14R1.422 NC(=O)COC/C=C/c1ccccc1 34a_100000210256_100000187820 [0,0,1,0,0,1|1,0,1]=4 1795 B14R1.422 NC(=O)COCCNc1ccccc1 34a_100000106764_100000076697 [0,0,1,0,0,1|0,0,2]=4 1796 B14R1.422 NC(=O)COCCNc1ccccc1 34a_100000211345_100000187820 [0,0,1,0,0,1|0,0,2]=4 1797 B14R1.422 NC(=O)CSC/C=C/c1ccccc1 62a_100000747473_100016265936 [0,0,1,0,0,1|1,0,1]=4 1798 B14R1.422 NC(=O)CSC/C=C/c1ccccc1 62a_100016265936_100000747473 [0,0,1,0,0,1|1,0,1]=4 1799 B14R1.540 C=CC(NCC(=O)N)c1ccccc1 2230a_100000711301_200000085779 [0,0,1,0,0,1|1,0,1]=4 1800 B14R1.540 C=CC(OCC(=O)N)c1ccccc1 34a_100011215659_100000187820 [0,0,1,0,0,1|1,0,1]=4 1801 B14R1.540 C=CC(OCC(=O)N)c1ccccc1 7a_100011215659_100000187820 [0,0,1,0,0,1|1,0,1]=4 1802 B14R1.540 C=CC(SCC(=O)N)c1ccccc1 62a_100000747473_200000085779 [0,0,1,0,0,1|1,0,1]=4 1803 B14R1.540 C=CC(SCC(=O)N)c1ccccc1 62a_200000085779_100000747473 [0,0,1,0,0,1|1,0,1]=4 1804 B14R1.540 NCC(OCC(=O)N)c1ccccc1 34a_100000210709_100000187820 [0,0,1,0,0,1|0,0,2]=4 1805 B14R2.9451 NC(=O)CSc1csc2c1scc2 62a_100000747473_100009817191 [0,0,0,0,1,1|2,0,0]=4 1806 B16R2.36 CC(=O)CCCc1c[nH]c2c1cccc2 1458a_100000181718_200000210301 [0,0,0,0,0,2|1,0,0]=3 1807 B16R2.36 CC(=O)CCOc1csc2c1cccc2 7a_100000077758_100000053229 [0,0,0,0,0,2|2,0,0]=4 1808 B16R2.36 CC(=O)CCSc1c[nH]c2c1cccn2 62a_100000053229_100011934613 [0,0,0,0,0,2|2,0,0]=4 1809 B16R2.36 CC(=O)CCSc1c[nH]c2c1ccnc2 62a_100000053229_100010232032 [0,0,0,0,0,2|2,0,0]=4 1810 B16R2.36 CC(=O)CCSc1c[nH]c2c1cncc2 62a_100000053229_100000753697 [0,0,0,0,0,2|2,0,0]=4 1811 B16R2.36 CC(=O)CCSc1c[nH]c2c1nccc2 62a_100000053229_100009817151 [0,0,0,0,0,2|2,0,0]=4 1812 B16R2.36 CC(=O)CCSc1coc2c1cccc2 62a_100000053229_100009812202 [0,0,0,0,0,2|2,0,0]=4 1813 B16R2.36 CC(=O)CCSc1csc2c1cccc2 62a_100000053229_100009813928 [0,0,0,0,0,2|2,0,0]=4 1814 B16R2.36 CC(=O)CCSc1n[nH]c2c1cccc2 62a_100000053229_100000050141 [0,0,0,0,0,2|2,0,0]=4 1815 B16R2.36 CC(=O)COCc1csc2c1cccc2 34a_100000211253_200000742921 [0,0,0,0,0,2|2,0,0]=4 1816 B16R2.36 CC(=O)NCCc1c[nH]c2c1cccc2 240690a_100000211132_100015343762 [0,0,0,0,0,2|1,0,0]=3 1817 B16R2.36 CC(=O)NCCc1c[nH]c2c1cccc2 527a_100000211132_100103153847 [0,0,0,0,0,2|1,0,0]=3 1818 B16R2.36 CC(=O)NCCc1coc2c1cccc2 11a_100011934666_100015343762 [0,0,0,0,0,2|2,0,0]=4 1819 B16R2.36 CC(=O)NCCc1coc2c1cccc2 1626a_100011934666_100015343762 [0,0,0,0,0,2|2,0,0]=4 1820 B16R2.36 CC(=O)NCCc1coc2c1cccc2 240690a_100011934666_100015343762 [0,0,0,0,0,2|2,0,0]=4 1821 B16R2.36 CC(=O)NCCc1coc2c1cccc2 527a_100011934666_100103153847 [0,0,0,0,0,2|2,0,0]=4 1822 B16R2.36 CC(=O)NN=Cc1c[nH]c2c1cccc2 4a_100000189765_100000182151 [0,0,0,0,0,2|1,0,1]=4 1823 B16R2.36 CC(=O)OCOc1csc2c1cccc2 34a_100000077758_100009813279 [0,0,0,0,0,2|2,0,0]=4 1824 B16R2.36 CC(=O)OCSc1c[nH]c2c1cccn2 62a_100000076356_100011934613 [0,0,0,0,0,2|2,0,0]=4 1825 B16R2.36 CC(=O)OCSc1c[nH]c2c1ccnc2 62a_100000076356_100010232032 [0,0,0,0,0,2|2,0,0]=4 1826 B16R2.36 CC(=O)OCSc1c[nH]c2c1cncc2 62a_100000076356_100000753697 [0,0,0,0,0,2|2,0,0]=4 1827 B16R2.36 CC(=O)OCSc1c[nH]c2c1nccc2 62a_100000076356_100009817151 [0,0,0,0,0,2|2,0,0]=4 1828 B16R2.36 CC(=O)OCSc1coc2c1cccc2 62a_100000076356_100009812202 [0,0,0,0,0,2|2,0,0]=4 1829 B16R2.36 CC(=O)OCSc1csc2c1cccc2 62a_100000076356_100009813928 [0,0,0,0,0,2|2,0,0]=4 1830 B16R2.36 CC(=O)OCSc1n[nH]c2c1cccc2 62a_100000076356_100000050141 [0,0,0,0,0,2|2,0,0]=4 1831 B16R2.36 NC(=O)CCNc1n[nH]c2c1cccn2 27a_100000740010_100009818534 [0,0,0,0,0,2|2,0,0]=4 1832 B16R2.36 NC(=O)CCNc1n[nH]c2c1cncc2 27a_100000740010_100009820117 [0,0,0,0,0,2|2,0,0]=4 1833 B16R2.36 NC(=O)CCNc1n[nH]c2c1nccc2 27a_100000740010_100009817118 [0,0,0,0,0,2|2,0,0]=4 1834 B16R2.36 NC(=O)CCOc1csc2c1cccc2 34a_100000077758_100000731001 [0,0,0,0,0,2|1,0,0]=3 1835 B16R2.36 NC(=O)CCOc1csc2c1cccc2 7a_100000077758_100000744528 [0,0,0,0,0,2|1,0,0]=3 1836 B16R2.36 NC(=O)CCSc1c[nH]c2c1cccn2 62a_100000744528_100011934613 [0,0,0,0,0,2|1,0,0]=3 1837 B16R2.36 NC(=O)CCSc1c[nH]c2c1ccnc2 62a_100000744528_100010232032 [0,0,0,0,0,2|1,0,0]=3 1838 B16R2.36 NC(=O)CCSc1c[nH]c2c1cncc2 62a_100000744528_100000753697 [0,0,0,0,0,2|1,0,0]=3 1839 B16R2.36 NC(=O)CCSc1c[nH]c2c1cncn2 62a_100000744528_100000072862 [0,0,0,0,0,2|2,0,0]=4 1840 B16R2.36 NC(=O)CCSc1c[nH]c2c1cncn2 62a_100009817560_100000744528 [0,0,0,0,0,2|2,0,0]=4 1841 B16R2.36 NC(=O)CCSc1c[nH]c2c1nccc2 62a_100000744528_100009817151 [0,0,0,0,0,2|1,0,0]=3 1842 B16R2.36 NC(=O)CCSc1c[nH]c2c1nccn2 62a_100000744528_100009819587 [0,0,0,0,0,2|2,0,0]=4 1843 B16R2.36 NC(=O)CCSc1cnc2n1cccc2 62a_100000744528_100011219245 [0,0,0,0,0,2|1,0,1]=4 1844 B16R2.36 NC(=O)CCSc1cnn2c1cccc2 62a_100000744528_100009817726 [0,0,0,0,0,2|1,0,1]=4 1845 B16R2.36 NC(=O)CCSc1coc2c1cccc2 62a_100000744528_100009812202 [0,0,0,0,0,2|1,0,0]=3 1846 B16R2.36 NC(=O)CCSc1coc2c1nccc2 62a_100000744528_100009889148 [0,0,0,0,0,2|2,0,0]=4 1847 B16R2.36 NC(=O)CCSc1csc2c1cccc2 62a_100000744528_100009813928 [0,0,0,0,0,2|1,0,0]=3 1848 B16R2.36 NC(=O)CCSc1csc2c1cccn2 62a_100000744528_100009830249 [0,0,0,0,0,2|2,0,0]=4 1849 B16R2.36 NC(=O)CCSc1csc2c1cccn2 62a_100009830249_100000744528 [0,0,0,0,0,2|2,0,0]=4 1850 B16R2.36 NC(=O)CCSc1csc2c1ccnc2 62a_100000744528_100009817111 [0,0,0,0,0,2|2,0,0]=4 1851 B16R2.36 NC(=O)CCSc1csc2c1ccnc2 62a_100009817111_100000744528 [0,0,0,0,0,2|2,0,0]=4 1852 B16R2.36 NC(=O)CCSc1csc2c1cncc2 62a_100000744528_100010247091 [0,0,0,0,0,2|2,0,0]=4 1853 B16R2.36 NC(=O)CCSc1csc2c1cncc2 62a_100010247091_100000744528 [0,0,0,0,0,2|2,0,0]=4 1854 B16R2.36 NC(=O)CCSc1csc2c1nccc2 62a_100000744528_100010247092 [0,0,0,0,0,2|2,0,0]=4 1855 B16R2.36 NC(=O)CCSc1n[nH]c2c1cccc2 62a_100000744528_100000050141 [0,0,0,0,0,2|1,0,0]=3 1856 B16R2.36 NC(=O)CCSc1n[nH]c2c1cccn2 62a_100000744528_100009888962 [0,0,0,0,0,2|2,0,0]=4 1857 B16R2.36 NC(=O)CCSc1n[nH]c2c1ccnc2 62a_100000744528_100010244369 [0,0,0,0,0,2|2,0,0]=4 1858 B16R2.36 NC(=O)CCSc1n[nH]c2c1cncc2 62a_100000744528_100009820117 [0,0,0,0,0,2|2,0,0]=4 1859 B16R2.36 NC(=O)CCSc1n[nH]c2c1nccc2 62a_100000744528_100009817118 [0,0,0,0,0,2|2,0,0]=4 1860 B16R2.36 NC(=O)CCSc1noc2c1cccc2 62a_100000744528_200000703156 [0,0,0,0,0,2|2,0,0]=4 1861 B16R2.36 NC(=O)CCSc1noc2c1cccc2 62a_200000703156_100000744528 [0,0,0,0,0,2|2,0,0]=4 1862 B16R2.36 NC(=O)CNCc1cnc2n1cccc2 2230a_100015187830_100000747473 [0,0,0,0,0,2|1,0,1]=4 1863 B16R2.36 NC(=O)CNCc1csc2c1cccc2 2230a_100000711301_200000742921 [0,0,0,0,0,2|1,0,0]=3 1864 B16R2.36 NC(=O)CNCc1csc2c1cccc2 34a_100000744611_100000187820 [0,0,0,0,0,2|1,0,0]=3 1865 B16R2.36 NC(=O)COCc1csc2c1cccc2 34a_100011219454_100000187820 [0,0,0,0,0,2|1,0,0]=3 1866 B16R2.36 NC(=O)CSCc1csc2c1cccc2 62a_100000747473_200000742921 [0,0,0,0,0,2|1,0,0]=3 1867 B16R2.36 NC(=O)CSCc1csc2c1cccc2 62a_200000742921_100000747473 [0,0,0,0,0,2|1,0,0]=3 1868 B16R2.36 NC(=O)CSCc1noc2c1cccc2 62a_100000747473_100009813815 [0,0,0,0,0,2|2,0,0]=4 1869 B16R2.36 NC(=O)CSCc1noc2c1cccc2 62a_100009813815_100000747473 [0,0,0,0,0,2|2,0,0]=4 1870 B16R2.36 O=C(O)CNCc1csc2c1cccc2 269956a_100016091260_200000742921 [0,0,0,0,0,2|2,0,0]=4 1871 B16R2.36 O=C([O-])CNCc1csc2c1cccc2 34a_100000744611_100020667443 [0,0,0,0,0,2|2,0,0]=4 1872 B16R2.36 O=C([O-])COCc1csc2c1cccc2 34a_100011219454_100020667443 [0,0,0,0,0,2|2,0,0]=4 1873 B16R2.36 O=C([O-])CSCc1csc2c1cccc2 62a_100020667443_200000742921 [0,0,0,0,0,2|2,0,0]=4 1874 B16R2.36 O=C([O-])CSCc1csc2c1cccc2 62a_200000742921_100020667443 [0,0,0,0,0,2|2,0,0]=4 1875 B16R2.36 [13CH3]C(=O)CCCc1c[nH]c2c1cccc2 1458a_100000181718_200025704644 [0,0,0,0,0,2|1,0,0]=3 1876 B16R2.477 CC(=O)CCc1ccc2ccccc2c1 1458a_100000743016_200000210301 [0,0,0,0,0,2|2,0,0]=4 1877 B16R2.477 CC(=O)COc1ccc2ccccc2c1 1458a_100000185456_200000210301 [0,0,0,0,0,2|2,0,0]=4 1878 B16R2.477 CC(=O)CSc1ccc2ccccc2c1 1458a_100000181792_200000210301 [0,0,0,0,0,2|2,0,0]=4 1879 B16R2.477 CC(=O)CSc1cnc2ccccc2n1 1458a_100000185120_200000210301 [0,0,0,0,0,2|1,0,1]=4 1880 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 11a_100000739491_100015343762 [0,0,0,0,0,2|2,0,0]=4 1881 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 1626a_100000739491_100015343762 [0,0,0,0,0,2|2,0,0]=4 1882 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 240690a_100000739491_100015343762 [0,0,0,0,0,2|2,0,0]=4 1883 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 527a_100000739491_100103153847 [0,0,0,0,0,2|2,0,0]=4 1884 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 11a_100015185970_100015343762 [0,0,0,0,0,2|2,0,0]=4 1885 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 1626a_100015185970_100015343762 [0,0,0,0,0,2|2,0,0]=4 1886 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 240690a_100015185970_100015343762 [0,0,0,0,0,2|2,0,0]=4 1887 B16R2.477 CC(=O)NCc1ccc2ccccc2n1 527a_100015185970_100103153847 [0,0,0,0,0,2|2,0,0]=4 1888 B16R2.477 CC(=O)NCc1cnc2ccccc2c1 11a_100000742225_100015343762 [0,0,0,0,0,2|1,0,1]=4 1889 B16R2.477 CC(=O)NCc1cnc2ccccc2c1 240690a_100000742225_100015343762 [0,0,0,0,0,2|1,0,1]=4 1890 B16R2.477 CC(=O)NCc1cnc2ccccc2c1 527a_100000742225_100103153847 [0,0,0,0,0,2|1,0,1]=4 1891 B16R2.477 NC(=O)CNc1ccc2ccccc2c1 34a_100000211940_100000187820 [0,0,0,0,0,2|1,0,0]=3 1892 B16R2.477 NC(=O)CNc1ccc2ccccc2c1 7a_100000211940_100000187820 [0,0,0,0,0,2|1,0,0]=3 1893 B16R2.477 NC(=O)CNc1ccc2cccnc2c1 34a_100102887122_100000187820 [0,0,0,0,0,2|2,0,0]=4 1894 B16R2.477 NC(=O)CNc1ccc2cnccc2c1 34a_100000039641_100000187820 [0,0,0,0,0,2|2,0,0]=4 1895 B16R2.477 NC(=O)CNc1ccc2ncccc2c1 34a_100011198106_100000187820 [0,0,0,0,0,2|2,0,0]=4 1896 B16R2.477 NC(=O)COc1ccc2ccccc2c1 34a_100000185828_100000187820 [0,0,0,0,0,2|1,0,0]=3 1897 B16R2.477 NC(=O)COc1ccc2ccccc2c1 7a_100000185828_100000187820 [0,0,0,0,0,2|1,0,0]=3 1898 B16R2.477 NC(=O)COc1ccc2cccnc2c1 34a_100011216045_100000187820 [0,0,0,0,0,2|2,0,0]=4 1899 B16R2.477 NC(=O)COc1ccc2ccncc2c1 7a_100000752006_100000187820 [0,0,0,0,0,2|2,0,0]=4 1900 B16R2.477 NC(=O)COc1ccc2cnccc2c1 34a_100000046372_100000187820 [0,0,0,0,0,2|2,0,0]=4 1901 B16R2.477 NC(=O)COc1ccc2cnccc2c1 7a_100000046372_100000187820 [0,0,0,0,0,2|2,0,0]=4 1902 B16R2.477 NC(=O)COc1ccc2ncccc2c1 34a_100011215586_100000187820 [0,0,0,0,0,2|2,0,0]=4 1903 B16R2.477 NC(=O)COc1ccc2ncccc2c1 7a_100011215586_100000187820 [0,0,0,0,0,2|2,0,0]=4 1904 B16R2.477 NC(=O)COc1cnc2ccccc2c1 34a_100011934006_100000187820 [0,0,0,0,0,2|0,0,1]=3 1905 B16R2.477 NC(=O)COc1cnc2ccccc2c1 7a_100011934006_100000187820 [0,0,0,0,0,2|0,0,1]=3 1906 B16R2.477 NC(=O)CSc1cc2ccccc2cn1 62a_100000747473_100000047361 [0,0,0,0,0,2|2,0,0]=4 1907 B16R2.477 NC(=O)CSc1cc2ccccc2cn1 62a_100009816522_100000747473 [0,0,0,0,0,2|2,0,0]=4 1908 B16R2.477 NC(=O)CSc1ccc2ccccc2c1 62a_100000747473_100000233703 [0,0,0,0,0,2|1,0,0]=3 1909 B16R2.477 NC(=O)CSc1ccc2ccccc2n1 62a_100000747473_100011291633 [0,0,0,0,0,2|1,0,0]=3 1910 B16R2.477 NC(=O)CSc1ccc2ccccc2n1 62a_100011291633_100000747473 [0,0,0,0,0,2|1,0,0]=3 1911 B16R2.477 NC(=O)CSc1ccc2cccnc2c1 62a_100000747473_100009816655 [0,0,0,0,0,2|2,0,0]=4 1912 B16R2.477 NC(=O)CSc1ccc2cccnc2n1 62a_100000075685_100000747473 [0,0,0,0,0,2|2,0,0]=4 1913 B16R2.477 NC(=O)CSc1ccc2cccnc2n1 62a_100000747473_100000075685 [0,0,0,0,0,2|2,0,0]=4 1914 B16R2.477 NC(=O)CSc1ccc2ccncc2c1 62a_100000686496_100000747473 [0,0,0,0,0,2|2,0,0]=4 1915 B16R2.477 NC(=O)CSc1ccc2ccncc2c1 62a_100000747473_100000686496 [0,0,0,0,0,2|2,0,0]=4 1916 B16R2.477 NC(=O)CSc1ccc2ccncc2n1 62a_100000747473_100000020162 [0,0,0,0,0,2|2,0,0]=4 1917 B16R2.477 NC(=O)CSc1ccc2cnccc2c1 62a_100000747473_100009816743 [0,0,0,0,0,2|2,0,0]=4 1918 B16R2.477 NC(=O)CSc1ccc2cnccc2c1 62a_100009816743_100000747473 [0,0,0,0,0,2|2,0,0]=4 1919 B16R2.477 NC(=O)CSc1ccc2ncccc2c1 62a_100000747473_100011215947 [0,0,0,0,0,2|2,0,0]=4 1920 B16R2.477 NC(=O)CSc1ccc2ncccc2c1 62a_100011215947_100000747473 [0,0,0,0,0,2|2,0,0]=4 1921 B16R2.477 NC(=O)CSc1ccc2ncccc2n1 62a_100000747473_100000073381 [0,0,0,0,0,2|2,0,0]=4 1922 B16R2.477 NC(=O)CSc1cnc2ccccc2c1 62a_100000747473_100000737414 [0,0,0,0,0,2|0,0,1]=3 1923 B16R2.477 NC(=O)CSc1cnc2ccccc2n1 62a_100000747473_100000756483 [0,0,0,0,0,2|0,0,1]=3 1924 B16R2.477 NC(=O)CSc1cnc2ccccc2n1 62a_100000756483_100000747473 [0,0,0,0,0,2|0,0,1]=3 1925 B16R2.477 NC(=O)CSc1cnc2cccnc2c1 62a_100000747473_100010246316 [0,0,0,0,0,2|1,0,1]=4 1926 B16R2.477 NC(=O)CSc1cnc2cccnc2c1 62a_100010246316_100000747473 [0,0,0,0,0,2|1,0,1]=4 1927 B16R2.477 NC(=O)CSc1cnc2cccnc2n1 62a_100000747473_200010275043 [0,0,0,0,0,2|1,0,1]=4 1928 B16R2.477 NC(=O)CSc1cnc2cccnc2n1 62a_200010275043_100000747473 [0,0,0,0,0,2|1,0,1]=4 1929 B16R2.477 NC(=O)CSc1cnc2ncccc2n1 62a_100000084304_100000747473 [0,0,0,0,0,2|1,0,1]=4 1930 B16R2.477 NC(=O)CSc1cnc2ncccc2n1 62a_100000747473_100000084304 [0,0,0,0,0,2|1,0,1]=4 1931 B16R2.477 NC(=O)CSc1ncc2ccccc2n1 62a_100000747473_100000097389 [0,0,0,0,0,2|2,0,0]=4 1932 B16R2.477 O=C([O-])CNc1ccc2ccccc2c1 34a_100000211940_100020667443 [0,0,0,0,0,2|2,0,0]=4 1933 B16R2.477 O=C([O-])COc1ccc2ccccc2c1 34a_100000185828_100020667443 [0,0,0,0,0,2|2,0,0]=4 1934 B16R2.477 O=C([O-])COc1cnc2ccccc2c1 34a_100011934006_100020667443 [0,0,0,0,0,2|1,0,1]=4 1935 B16R2.477 O=C([O-])CSc1ccc2ccccc2c1 62a_100020667443_100000233703 [0,0,0,0,0,2|2,0,0]=4 1936 B16R2.477 O=C([O-])CSc1ccc2ccccc2n1 62a_100011291633_100020667443 [0,0,0,0,0,2|2,0,0]=4 1937 B16R2.477 O=C([O-])CSc1ccc2ccccc2n1 62a_100020667443_100011291633 [0,0,0,0,0,2|2,0,0]=4 1938 B16R2.477 O=C([O-])CSc1cnc2ccccc2c1 62a_100020667443_100000737414 [0,0,0,0,0,2|1,0,1]=4 1939 B16R2.477 O=C([O-])CSc1cnc2ccccc2n1 62a_100000756483_100020667443 [0,0,0,0,0,2|1,0,1]=4 1940 B16R2.477 O=C([O-])CSc1cnc2ccccc2n1 62a_100020667443_100000756483 [0,0,0,0,0,2|1,0,1]=4 1941 B16R2.477 [13CH3]C(=O)CCc1ccc2ccccc2c1 1458a_100000743016_200025704644 [0,0,0,0,0,2|2,0,0]=4 1942 B16R2.477 [13CH3]C(=O)COc1ccc2ccccc2c1 1458a_100000185456_200025704644 [0,0,0,0,0,2|2,0,0]=4 1943 B16R2.477 [13CH3]C(=O)CSc1ccc2ccccc2c1 1458a_100000181792_200025704644 [0,0,0,0,0,2|2,0,0]=4 1944 B16R2.477 [13CH3]C(=O)CSc1cnc2ccccc2n1 1458a_100000185120_200025704644 [0,0,0,0,0,2|1,0,1]=4 1945 B16R2.179941 CC(=O)CCc1cccc2c1cccc2 1458a_100000070787_100011290781 [0,0,0,0,0,2|2,0,0]=4 1946 B16R2.179941 CC(=O)CCc1cccc2c1cccc2 1458a_100011218451_200000210301 [0,0,0,0,0,2|2,0,0]=4 1947 B16R2.179941 CC(=O)COc1cccc2c1cccc2 1458a_100000183701_200000210301 [0,0,0,0,0,2|2,0,0]=4 1948 B16R2.179941 CC(=O)COc1ncnc2c1cccc2 1458a_100000216300_200000210301 [0,0,0,0,0,2|1,0,1]=4 1949 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 11a_100000753325_100015343762 [0,0,0,0,0,2|2,0,0]=4 1950 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 1626a_100000753325_100015343762 [0,0,0,0,0,2|2,0,0]=4 1951 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 240690a_100000753325_100015343762 [0,0,0,0,0,2|2,0,0]=4 1952 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 527a_100000753325_100103153847 [0,0,0,0,0,2|2,0,0]=4 1953 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 11a_100015187208_100015343762 [0,0,0,0,0,2|1,0,1]=4 1954 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 1626a_100015187208_100015343762 [0,0,0,0,0,2|1,0,1]=4 1955 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 240690a_100015187208_100015343762 [0,0,0,0,0,2|1,0,1]=4 1956 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 527a_100015187208_100103153847 [0,0,0,0,0,2|1,0,1]=4 1957 B16R2.179941 CC(=O)NCc1nccc2c1cccc2 11a_100000735229_100015343762 [0,0,0,0,0,2|2,0,0]=4 1958 B16R2.179941 CC(=O)NCc1nccc2c1cccc2 240690a_100000735229_100015343762 [0,0,0,0,0,2|2,0,0]=4 1959 B16R2.179941 CC(=O)NCc1nccc2c1cccc2 527a_100000735229_100103153847 [0,0,0,0,0,2|2,0,0]=4 1960 B16R2.179941 NC(=O)CNc1cccc2c1cccc2 34a_100000185869_100000187820 [0,0,0,0,0,2|1,0,0]=3 1961 B16R2.179941 NC(=O)CNc1cccc2c1cccn2 34a_100000183906_100000187820 [0,0,0,0,0,2|2,0,0]=4 1962 B16R2.179941 NC(=O)CNc1cccc2c1nccc2 34a_100000181377_100000187820 [0,0,0,0,0,2|2,0,0]=4 1963 B16R2.179941 NC(=O)COc1cccc2c1cccc2 34a_100000210388_100000187820 [0,0,0,0,0,2|1,0,0]=3 1964 B16R2.179941 NC(=O)COc1cccc2c1cccc2 7a_100000210388_100000187820 [0,0,0,0,0,2|1,0,0]=3 1965 B16R2.179941 NC(=O)COc1cccc2c1cccn2 34a_100011197808_100000187820 [0,0,0,0,0,2|2,0,0]=4 1966 B16R2.179941 NC(=O)COc1cccc2c1ccnc2 34a_100011218533_100000187820 [0,0,0,0,0,2|2,0,0]=4 1967 B16R2.179941 NC(=O)COc1cccc2c1cncc2 34a_103624766955_100000187820 [0,0,0,0,0,2|2,0,0]=4 1968 B16R2.179941 NC(=O)COc1cccc2c1nccc2 34a_100000056035_100000187820 [0,0,0,0,0,2|2,0,0]=4 1969 B16R2.179941 NC(=O)COc1cncc2c1cccc2 34a_100000066178_100000187820 [0,0,0,0,0,2|0,0,1]=3 1970 B16R2.179941 NC(=O)COc1cncc2c1cccc2 7a_100000066178_100000187820 [0,0,0,0,0,2|0,0,1]=3 1971 B16R2.179941 NC(=O)COc1nccc2c1cccc2 34a_102531767632_100000187820 [0,0,0,0,0,2|1,0,0]=3 1972 B16R2.179941 NC(=O)CSc1cccc2c1cccc2 62a_100000747473_100000210605 [0,0,0,0,0,2|1,0,0]=3 1973 B16R2.179941 NC(=O)CSc1cccc2c1cccn2 62a_100000747473_100011290932 [0,0,0,0,0,2|2,0,0]=4 1974 B16R2.179941 NC(=O)CSc1cccc2c1cccn2 62a_100011290932_100000747473 [0,0,0,0,0,2|2,0,0]=4 1975 B16R2.179941 NC(=O)CSc1cccc2c1ccnc2 62a_100000186358_100000747473 [0,0,0,0,0,2|2,0,0]=4 1976 B16R2.179941 NC(=O)CSc1cccc2c1ccnc2 62a_100000747473_100000186358 [0,0,0,0,0,2|2,0,0]=4 1977 B16R2.179941 NC(=O)CSc1cccc2c1cncc2 62a_100000685578_100000747473 [0,0,0,0,0,2|2,0,0]=4 1978 B16R2.179941 NC(=O)CSc1cccc2c1cncc2 62a_100000747473_100000685578 [0,0,0,0,0,2|2,0,0]=4 1979 B16R2.179941 NC(=O)CSc1cccc2c1nccc2 62a_100000747473_100011215545 [0,0,0,0,0,2|2,0,0]=4 1980 B16R2.179941 NC(=O)CSc1ccnc2c1cccc2 62a_100000747473_100011215880 [0,0,0,0,0,2|0,0,1]=3 1981 B16R2.179941 NC(=O)CSc1ccnc2c1cccc2 62a_100011458314_100000747473 [0,0,0,0,0,2|0,0,1]=3 1982 B16R2.179941 NC(=O)CSc1ccnc2c1cccn2 62a_100000087570_100000747473 [0,0,0,0,0,2|1,0,1]=4 1983 B16R2.179941 NC(=O)CSc1ccnc2c1cccn2 62a_100000747473_100000087570 [0,0,0,0,0,2|1,0,1]=4 1984 B16R2.179941 NC(=O)CSc1ccnc2c1cncc2 62a_100000095135_100000747473 [0,0,0,0,0,2|1,0,1]=4 1985 B16R2.179941 NC(=O)CSc1ccnc2c1cncc2 62a_100000747473_100000095135 [0,0,0,0,0,2|1,0,1]=4 1986 B16R2.179941 NC(=O)CSc1cncc2c1cccc2 62a_100000187577_100000747473 [0,0,0,0,0,2|0,0,1]=3 1987 B16R2.179941 NC(=O)CSc1cncc2c1cccc2 62a_100000747473_100000187577 [0,0,0,0,0,2|0,0,1]=3 1988 B16R2.179941 NC(=O)CSc1cncc2c1cccn2 62a_100000747473_100010211308 [0,0,0,0,0,2|1,0,1]=4 1989 B16R2.179941 NC(=O)CSc1cncc2c1cccn2 62a_100010211308_100000747473 [0,0,0,0,0,2|1,0,1]=4 1990 B16R2.179941 NC(=O)CSc1cncc2c1ccnc2 62a_100000747473_100010134378 [0,0,0,0,0,2|1,0,1]=4 1991 B16R2.179941 NC(=O)CSc1cncc2c1ccnc2 62a_100010134378_100000747473 [0,0,0,0,0,2|1,0,1]=4 1992 B16R2.179941 NC(=O)CSc1cnnc2c1cccc2 62a_100000747473_100000063506 [0,0,0,0,0,2|0,0,1]=3 1993 B16R2.179941 NC(=O)CSc1nccc2c1cccc2 62a_100000747473_100011934041 [0,0,0,0,0,2|1,0,0]=3 1994 B16R2.179941 NC(=O)CSc1nccc2c1cccc2 62a_100011934041_100000747473 [0,0,0,0,0,2|1,0,0]=3 1995 B16R2.179941 NC(=O)CSc1nccc2c1cccn2 62a_100000747473_100000077681 [0,0,0,0,0,2|2,0,0]=4 1996 B16R2.179941 NC(=O)CSc1nccc2c1cncc2 62a_100000747473_100000116921 [0,0,0,0,0,2|2,0,0]=4 1997 B16R2.179941 NC(=O)CSc1nccc2c1cncc2 62a_200010063730_100000747473 [0,0,0,0,0,2|2,0,0]=4 1998 B16R2.179941 NC(=O)CSc1nccc2c1nccc2 62a_100000747473_100010063729 [0,0,0,0,0,2|2,0,0]=4 1999 B16R2.179941 NC(=O)CSc1ncnc2c1cccc2 62a_100000747473_100000217608 [0,0,0,0,0,2|0,0,1]=3 2000 B16R2.179941 NC(=O)CSc1ncnc2c1cccc2 62a_100000753007_100000747473 [0,0,0,0,0,2|0,0,1]=3 2001 B16R2.179941 NC(=O)CSc1ncnc2c1cccn2 62a_100000026734_100000747473 [0,0,0,0,0,2|1,0,1]=4 2002 B16R2.179941 NC(=O)CSc1ncnc2c1cccn2 62a_100000747473_100000026734 [0,0,0,0,0,2|1,0,1]=4 2003 B16R2.179941 NC(=O)CSc1ncnc2c1ccnc2 62a_100000747473_100000098430 [0,0,0,0,0,2|1,0,1]=4 2004 B16R2.179941 NC(=O)CSc1ncnc2c1nccc2 62a_100000747473_100000063688 [0,0,0,0,0,2|1,0,1]=4 2005 B16R2.179941 NC(=O)CSc1nncc2c1cccc2 62a_100000747473_100025712358 [0,0,0,0,0,2|1,0,1]=4 2006 B16R2.179941 O=C([O-])CNc1cccc2c1cccc2 34a_100000185869_100020667443 [0,0,0,0,0,2|2,0,0]=4 2007 B16R2.179941 O=C([O-])COc1cccc2c1cccc2 34a_100000210388_100020667443 [0,0,0,0,0,2|2,0,0]=4 2008 B16R2.179941 O=C([O-])COc1cncc2c1cccc2 34a_100000066178_100020667443 [0,0,0,0,0,2|1,0,1]=4 2009 B16R2.179941 O=C([O-])COc1nccc2c1cccc2 34a_102531767632_100020667443 [0,0,0,0,0,2|2,0,0]=4 2010 B16R2.179941 O=C([O-])CSc1cccc2c1cccc2 62a_100020667443_100000210605 [0,0,0,0,0,2|2,0,0]=4 2011 B16R2.179941 O=C([O-])CSc1ccnc2c1cccc2 62a_100011458314_100020667443 [0,0,0,0,0,2|1,0,1]=4 2012 B16R2.179941 O=C([O-])CSc1ccnc2c1cccc2 62a_100020667443_100011215880 [0,0,0,0,0,2|1,0,1]=4 2013 B16R2.179941 O=C([O-])CSc1cncc2c1cccc2 62a_100000187577_100020667443 [0,0,0,0,0,2|1,0,1]=4 2014 B16R2.179941 O=C([O-])CSc1cncc2c1cccc2 62a_100020667443_100000187577 [0,0,0,0,0,2|1,0,1]=4 2015 B16R2.179941 O=C([O-])CSc1cnnc2c1cccc2 62a_100020667443_100000063506 [0,0,0,0,0,2|1,0,1]=4 2016 B16R2.179941 O=C([O-])CSc1nccc2c1cccc2 62a_100011934041_100020667443 [0,0,0,0,0,2|2,0,0]=4 2017 B16R2.179941 O=C([O-])CSc1nccc2c1cccc2 62a_100020667443_100011934041 [0,0,0,0,0,2|2,0,0]=4 2018 B16R2.179941 O=C([O-])CSc1ncnc2c1cccc2 62a_100000753007_100020667443 [0,0,0,0,0,2|1,0,1]=4 2019 B16R2.179941 O=C([O-])CSc1ncnc2c1cccc2 62a_100020667443_100000217608 [0,0,0,0,0,2|1,0,1]=4 2020 B16R2.179941 [13CH3]C(=O)CCc1cccc2c1cccc2 1458a_100011218451_200025704644 [0,0,0,0,0,2|2,0,0]=4 2021 B16R2.179941 [13CH3]C(=O)COc1cccc2c1cccc2 1458a_100000183701_200025704644 [0,0,0,0,0,2|2,0,0]=4 2022 B16R2.179941 [13CH3]C(=O)COc1ncnc2c1cccc2 1458a_100000216300_200025704644 [0,0,0,0,0,2|1,0,1]=4