0 B21R2.24297 BrCCCCOCc1ccccc1Cc2ccccc2 34a_100011216708_100010254464 [0,0,0,0,0,0|4,0,0]=4 1 B21R2.24297 C#CCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100010269958 [0,0,0,0,0,0|2,0,1]=3 2 B21R2.24297 C#CCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100010269958 [0,0,0,0,0,0|2,0,1]=3 3 B21R2.24297 C#CCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100010269958 [0,0,0,0,0,0|2,0,1]=3 4 B21R2.24297 C#CCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100010269958 [0,0,0,0,0,0|3,0,1]=4 5 B21R2.24297 C#CCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100010269958 [0,0,0,0,0,0|3,0,1]=4 6 B21R2.24297 C#CCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100010269958 [0,0,0,0,0,0|1,0,1]=2 7 B21R2.24297 C#CCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100010269958 [0,0,0,0,0,0|1,0,1]=2 8 B21R2.24297 C#CCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100010269958 [0,0,0,0,0,0|2,0,1]=3 9 B21R2.24297 C#CCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100010269958 [0,0,0,0,0,0|2,0,1]=3 10 B21R2.24297 C#CCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100010269958 [0,0,0,0,0,0|3,0,1]=4 11 B21R2.24297 C#CCCCNCc1ccccc1Cc2ccccc2 207a_100000718082_100009842342 [0,0,0,0,0,0|3,0,1]=4 12 B21R2.24297 C#CCCCNCc1ccccc1Cc2ccccc2 270004a_100000718082_100009842342 [0,0,0,0,0,0|3,0,1]=4 13 B21R2.24297 C#CCCCNCc1ccccc1Cc2ccccc2 34a_100000718082_100010254464 [0,0,0,0,0,0|3,0,1]=4 14 B21R2.24297 C#CCCCOCc1ccccc1Cc2ccccc2 34a_100000215630_100010254464 [0,0,0,0,0,0|3,0,1]=4 15 B21R2.24297 C#CCCCOCc1ccccc1Cc2ccccc2 7a_100000215630_100010254464 [0,0,0,0,0,0|3,0,1]=4 16 B21R2.24297 C#CCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100011215417 [0,0,0,0,0,0|3,0,1]=4 17 B21R2.24297 C#CCCCSCc1ccccc1Cc2ccccc2 62a_100011215417_100010254464 [0,0,0,0,0,0|3,0,1]=4 18 B21R2.24297 C#CCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100010402529 [0,0,0,0,0,0|3,0,1]=4 19 B21R2.24297 C#CCOCCNc1ccccc1Cc2ccccc2 34a_100000211252_100010402529 [0,0,0,0,0,0|3,0,1]=4 20 B21R2.24297 C#CCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_100010402529 [0,0,0,0,0,0|3,0,1]=4 21 B21R2.24297 C#CCOCCOc1ccccc1Cc2ccccc2 34a_100000211249_100010402529 [0,0,0,0,0,0|2,0,1]=3 22 B21R2.24297 C#CCOCCOc1ccccc1Cc2ccccc2 7a_100000211249_100010402529 [0,0,0,0,0,0|2,0,1]=3 23 B21R2.24297 C#CCOCCOc1ccccc1Oc2ccccc2 34a_100000074787_100010402529 [0,0,0,0,0,0|3,0,1]=4 24 B21R2.24297 C#CCOCCOc1ccccc1Oc2ccccc2 7a_100000074787_100010402529 [0,0,0,0,0,0|3,0,1]=4 25 B21R2.24297 C#CCOCCSc1ccccc1Cc2ccccc2 62a_100010402529_200011216382 [0,0,0,0,0,0|2,1,1]=4 26 B21R2.24297 C#CCOCCSc1ccccc1Cc2ccccc2 62a_200011216382_100010402529 [0,0,0,0,0,0|2,1,1]=4 27 B21R2.24297 C/C=C/CCOCc1ccccc1Cc2ccccc2 34a_100016278192_100010254464 [0,0,0,0,0,0|3,0,1]=4 28 B21R2.24297 C=CCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100011215482 [0,0,0,0,0,0|3,0,1]=4 29 B21R2.24297 C=CCCCNCc1ccccc1Cc2ccccc2 2230a_100000700776_100010254464 [0,0,0,0,0,0|3,0,1]=4 30 B21R2.24297 C=CCCCNCc1ccccc1Cc2ccccc2 270004a_100000700776_100009842342 [0,0,0,0,0,0|3,0,1]=4 31 B21R2.24297 C=CCCCNCc1ccccc1Cc2ccccc2 34a_100000700776_100010254464 [0,0,0,0,0,0|3,0,1]=4 32 B21R2.24297 C=CCCCOCc1ccccc1Cc2ccccc2 34a_100000758997_100010254464 [0,0,0,0,0,0|3,0,1]=4 33 B21R2.24297 C=CCCCOCc1ccccc1Cc2ccccc2 7a_100000758997_100010254464 [0,0,0,0,0,0|3,0,1]=4 34 B21R2.24297 CC#CCCOCc1ccccc1Cc2ccccc2 34a_100000750427_100010254464 [0,0,0,0,0,0|3,0,1]=4 35 B21R2.24297 CCCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000210314 [0,0,0,0,0,0|3,0,0]=3 36 B21R2.24297 CCCCCNCc1ccccc1Cc2ccccc2 207a_100000209983_100009842342 [0,0,0,0,0,0|3,0,0]=3 37 B21R2.24297 CCCCCNCc1ccccc1Cc2ccccc2 2230a_100000209983_100010254464 [0,0,0,0,0,0|3,0,0]=3 38 B21R2.24297 CCCCCNCc1ccccc1Cc2ccccc2 270004a_100000209983_100009842342 [0,0,0,0,0,0|3,0,0]=3 39 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 207a_100000209983_100011234122 [0,0,0,0,0,0|4,0,0]=4 40 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 2230a_100000209983_100000199117 [0,0,0,0,0,0|4,0,0]=4 41 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 2230a_100016987831_100000210326 [0,0,0,0,0,0|4,0,0]=4 42 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 270004a_100000209983_100011234122 [0,0,0,0,0,0|4,0,0]=4 43 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 34a_100016987831_100000718602 [0,0,0,0,0,0|4,0,0]=4 44 B21R2.24297 CCCCCOCc1ccccc1Cc2ccccc2 34a_100000210253_100010254464 [0,0,0,0,0,0|3,0,0]=3 45 B21R2.24297 CCCCCOCc1ccccc1Cc2ccccc2 7a_100000210253_100010254464 [0,0,0,0,0,0|3,0,0]=3 46 B21R2.24297 CCCCNN=Cc1ccccc1Cc2ccccc2 4a_100025702795_100009842342 [0,0,0,0,0,0|4,0,0]=4 47 B21R2.24297 CCCCOCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011995733 [0,0,0,0,0,0|3,0,0]=3 48 B21R2.24297 CCCCOCNc1ccccc1Cc2ccccc2 34a_100000211252_100011995733 [0,0,0,0,0,0|3,0,0]=3 49 B21R2.24297 CCCCOCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011995733 [0,0,0,0,0,0|4,0,0]=4 50 B21R2.24297 CCCCOCNc1ccccc1Oc2ccccc2 34a_100000182328_100011995733 [0,0,0,0,0,0|4,0,0]=4 51 B21R2.24297 CCCCOCOc1ccccc1Cc2ccccc2 34a_100000211249_100011995733 [0,0,0,0,0,0|2,0,0]=2 52 B21R2.24297 CCCCOCOc1ccccc1Oc2ccccc2 34a_100000074787_100011995733 [0,0,0,0,0,0|3,0,0]=3 53 B21R2.24297 CCCCOCOc1ccccc1Oc2ccccn2 34a_100000748224_100011995733 [0,0,0,0,0,0|4,0,0]=4 54 B21R2.24297 CCCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011215938 [0,0,0,0,0,0|3,0,0]=3 55 B21R2.24297 CCCOCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011215938 [0,0,0,0,0,0|3,0,0]=3 56 B21R2.24297 CCCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215938 [0,0,0,0,0,0|3,0,0]=3 57 B21R2.24297 CCCOCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011215938 [0,0,0,0,0,0|4,0,0]=4 58 B21R2.24297 CCCOCCNc1ccccc1Oc2ccccc2 34a_100000182328_100011215938 [0,0,0,0,0,0|4,0,0]=4 59 B21R2.24297 CCCOCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100011215938 [0,0,0,0,0,0|4,0,0]=4 60 B21R2.24297 CCCOCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011215938 [0,0,0,0,0,0|2,0,0]=2 61 B21R2.24297 CCCOCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011215938 [0,0,0,0,0,0|2,0,0]=2 62 B21R2.24297 CCCOCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011215938 [0,0,0,0,0,0|3,0,0]=3 63 B21R2.24297 CCCOCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011215938 [0,0,0,0,0,0|3,0,0]=3 64 B21R2.24297 CCCOCCOc1ccccc1Oc2ccccn2 34a_100000748224_100011215938 [0,0,0,0,0,0|4,0,0]=4 65 B21R2.24297 CCCOCCSc1ccccc1Cc2ccccc2 62a_100011215938_200011216382 [0,0,0,0,0,0|2,1,0]=3 66 B21R2.24297 CCCOCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011215938 [0,0,0,0,0,0|2,1,0]=3 67 B21R2.24297 CCCOCCSc1ccccc1Nc2ccccc2 62a_100011215938_100009815782 [0,0,0,0,0,0|3,1,0]=4 68 B21R2.24297 CCOCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100012232248 [0,0,0,0,0,0|3,0,0]=3 69 B21R2.24297 CCOCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100012232248 [0,0,0,0,0,0|3,0,0]=3 70 B21R2.24297 CCOCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100012232248 [0,0,0,0,0,0|3,0,0]=3 71 B21R2.24297 CCOCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100012232248 [0,0,0,0,0,0|4,0,0]=4 72 B21R2.24297 CCOCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100012232248 [0,0,0,0,0,0|4,0,0]=4 73 B21R2.24297 CCOCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100012232248 [0,0,0,0,0,0|4,0,0]=4 74 B21R2.24297 CCOCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100012232248 [0,0,0,0,0,0|2,0,0]=2 75 B21R2.24297 CCOCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100012232248 [0,0,0,0,0,0|2,0,0]=2 76 B21R2.24297 CCOCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100012232248 [0,0,0,0,0,0|3,0,0]=3 77 B21R2.24297 CCOCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100012232248 [0,0,0,0,0,0|3,0,0]=3 78 B21R2.24297 CCOCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100012232248 [0,0,0,0,0,0|4,0,0]=4 79 B21R2.24297 CCOCCCSc1ccccc1Cc2ccccc2 62a_100012232248_200011216382 [0,0,0,0,0,0|2,1,0]=3 80 B21R2.24297 CCOCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100012232248 [0,0,0,0,0,0|2,1,0]=3 81 B21R2.24297 CCOCCCSc1ccccc1Nc2ccccc2 62a_100012232248_100009815782 [0,0,0,0,0,0|3,1,0]=4 82 B21R2.24297 CCOCCNCc1ccccc1Cc2ccccc2 207a_100011200944_100009842342 [0,0,0,0,0,0|4,0,0]=4 83 B21R2.24297 CCOCCNCc1ccccc1Cc2ccccc2 2230a_102516460346_100010254464 [0,0,0,0,0,0|4,0,0]=4 84 B21R2.24297 CCOCCNCc1ccccc1Cc2ccccc2 270004a_102516460346_100009842342 [0,0,0,0,0,0|4,0,0]=4 85 B21R2.24297 CCOCCNCc1ccccc1Cc2ccccc2 34a_102516460346_100010254464 [0,0,0,0,0,0|4,0,0]=4 86 B21R2.24297 CCOCCOCc1ccccc1Cc2ccccc2 34a_100000210136_100010254464 [0,0,0,0,0,0|4,0,0]=4 87 B21R2.24297 CCOCCOCc1ccccc1Cc2ccccc2 7a_100000210136_100010254464 [0,0,0,0,0,0|4,0,0]=4 88 B21R2.24297 CCOCCSCc1ccccc1Cc2ccccc2 62a_100000210147_100010254464 [0,0,0,0,0,0|4,0,0]=4 89 B21R2.24297 CCOCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100011215890 [0,0,0,0,0,0|4,0,0]=4 90 B21R2.24297 CCSCCNCc1ccccc1Cc2ccccc2 207a_100000106463_100009842342 [0,0,0,0,0,0|4,0,0]=4 91 B21R2.24297 CCSCCNCc1ccccc1Cc2ccccc2 2230a_100000106463_100010254464 [0,0,0,0,0,0|4,0,0]=4 92 B21R2.24297 CCSCCNCc1ccccc1Cc2ccccc2 270004a_100000106463_100009842342 [0,0,0,0,0,0|4,0,0]=4 93 B21R2.24297 CCSCCOCc1ccccc1Cc2ccccc2 34a_100000212035_100010254464 [0,0,0,0,0,0|4,0,0]=4 94 B21R2.24297 CCSCCOCc1ccccc1Cc2ccccc2 7a_100000212035_100010254464 [0,0,0,0,0,0|4,0,0]=4 95 B21R2.24297 CNCCCOCc1ccccc1Cc2ccccc2 34a_100000213112_100010254464 [0,0,0,0,0,0|2,0,0]=2 96 B21R2.24297 COCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000730899 [0,0,0,0,0,0|2,0,0]=2 97 B21R2.24297 COCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000755781 [0,0,0,0,0,0|2,0,0]=2 98 B21R2.24297 COCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000730899 [0,0,0,0,0,0|2,0,0]=2 99 B21R2.24297 COCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000730899 [0,0,0,0,0,0|3,0,0]=3 100 B21R2.24297 COCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000755781 [0,0,0,0,0,0|3,0,0]=3 101 B21R2.24297 COCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000730899 [0,0,0,0,0,0|3,0,0]=3 102 B21R2.24297 COCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000755781 [0,0,0,0,0,0|1,0,0]=1 103 B21R2.24297 COCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000730899 [0,0,0,0,0,0|1,0,0]=1 104 B21R2.24297 COCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000755781 [0,0,0,0,0,0|2,0,0]=2 105 B21R2.24297 COCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000730899 [0,0,0,0,0,0|2,0,0]=2 106 B21R2.24297 COCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000755781 [0,0,0,0,0,0|3,0,0]=3 107 B21R2.24297 COCCCCSc1ccccc1Cc2ccccc2 62a_100000730899_200011216382 [0,0,0,0,0,0|1,1,0]=2 108 B21R2.24297 COCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000730899 [0,0,0,0,0,0|1,1,0]=2 109 B21R2.24297 COCCCCSc1ccccc1Nc2ccccc2 62a_100000730899_100009815782 [0,0,0,0,0,0|2,1,0]=3 110 B21R2.24297 COCCCNCc1ccccc1Cc2ccccc2 207a_100150723488_100009842342 [0,0,0,0,0,0|3,0,0]=3 111 B21R2.24297 COCCCNCc1ccccc1Cc2ccccc2 270004a_100150723488_100009842342 [0,0,0,0,0,0|3,0,0]=3 112 B21R2.24297 COCCCNCc1ccccc1Cc2ccccc2 34a_100150723488_100010254464 [0,0,0,0,0,0|3,0,0]=3 113 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 207a_100150723488_100011234122 [0,0,0,0,0,0|4,0,0]=4 114 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 2230a_100016987831_100000740836 [0,0,0,0,0,0|4,0,0]=4 115 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 270004a_100150723488_100011234122 [0,0,0,0,0,0|4,0,0]=4 116 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 34a_100016987831_100000740836 [0,0,0,0,0,0|4,0,0]=4 117 B21R2.24297 COCCCOCc1ccccc1Cc2ccccc2 34a_100000740835_100010254464 [0,0,0,0,0,0|3,0,0]=3 118 B21R2.24297 COCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000740836 [0,0,0,0,0,0|4,0,0]=4 119 B21R2.24297 COCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000740836 [0,0,0,0,0,0|4,0,0]=4 120 B21R2.24297 COCCCSCc1ccccc1Cc2ccccc2 62a_100000709357_100010254464 [0,0,0,0,0,0|3,0,0]=3 121 B21R2.24297 COCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000709357 [0,0,0,0,0,0|3,0,0]=3 122 B21R2.24297 COCCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000709357 [0,0,0,0,0,0|4,0,0]=4 123 B21R2.24297 COCCCSCc1ccccc1Oc2ccccc2 62a_100000709357_100000199117 [0,0,0,0,0,0|4,0,0]=4 124 B21R2.24297 COCCOCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000231047 [0,0,0,0,0,0|3,0,0]=3 125 B21R2.24297 COCCOCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000231047 [0,0,0,0,0,0|4,0,0]=4 126 B21R2.24297 COCCOCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000231047 [0,0,0,0,0,0|4,0,0]=4 127 B21R2.24297 COCCOCSc1ccccc1Cc2ccccc2 62a_100000231047_200011216382 [0,0,0,0,0,0|2,1,0]=3 128 B21R2.24297 COCCOCSc1ccccc1Cc2ccccc2 62a_200011216382_100000231047 [0,0,0,0,0,0|2,1,0]=3 129 B21R2.24297 COCCOCSc1ccccc1Nc2ccccc2 62a_100000231047_100009815782 [0,0,0,0,0,0|3,1,0]=4 130 B21R2.24297 COCCOCSc1ccccc1Oc2ccccc2 62a_100000231047_100000049502 [0,0,0,0,0,0|3,1,0]=4 131 B21R2.24297 CSCCCNCc1ccccc1Cc2ccccc2 207a_100000749238_100009842342 [0,0,0,0,0,0|3,0,0]=3 132 B21R2.24297 CSCCCNCc1ccccc1Cc2ccccc2 2230a_100000749238_100010254464 [0,0,0,0,0,0|3,0,0]=3 133 B21R2.24297 CSCCCNCc1ccccc1Cc2ccccc2 270004a_100000749238_100009842342 [0,0,0,0,0,0|3,0,0]=3 134 B21R2.24297 CSCCCNCc1ccccc1Oc2ccccc2 207a_100000749238_100011234122 [0,0,0,0,0,0|4,0,0]=4 135 B21R2.24297 CSCCCNCc1ccccc1Oc2ccccc2 2230a_100000749238_100000199117 [0,0,0,0,0,0|4,0,0]=4 136 B21R2.24297 CSCCCNCc1ccccc1Oc2ccccc2 270004a_100000749238_100011234122 [0,0,0,0,0,0|4,0,0]=4 137 B21R2.24297 CSCCCOCc1ccccc1Cc2ccccc2 34a_100000690336_100010254464 [0,0,0,0,0,0|3,0,0]=3 138 B21R2.24297 CSCCCOCc1ccccc1Cc2ccccc2 7a_100000690336_100010254464 [0,0,0,0,0,0|3,0,0]=3 139 B21R2.24297 CSCCCOCc1ccccc1Oc2ccccc2 7a_100000690336_100000199117 [0,0,0,0,0,0|4,0,0]=4 140 B21R2.24297 ClCCCCOCc1ccccc1Cc2ccccc2 34a_100000210776_100010254464 [0,0,0,0,0,0|4,0,0]=4 141 B21R2.24297 ClCCCCOCc1ccccc1Cc2ccccc2 7a_100000210776_100010254464 [0,0,0,0,0,0|4,0,0]=4 142 B21R2.24297 FCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000729378 [0,0,0,0,0,0|3,0,0]=3 143 B21R2.24297 FCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000729378 [0,0,0,0,0,0|3,0,0]=3 144 B21R2.24297 FCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000729378 [0,0,0,0,0,0|3,0,0]=3 145 B21R2.24297 FCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000729378 [0,0,0,0,0,0|2,0,0]=2 146 B21R2.24297 FCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000729378 [0,0,0,0,0,0|2,0,0]=2 147 B21R2.24297 FCCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000729378 [0,0,0,0,0,0|4,0,0]=4 148 B21R2.24297 FCCCCOCc1ccccc1Cc2ccccc2 34a_100011995726_100010254464 [0,0,0,0,0,0|4,0,0]=4 149 B21R2.24297 FCCCCOCc1ccccc1Cc2ccccc2 7a_100011995726_100010254464 [0,0,0,0,0,0|4,0,0]=4 150 B21R2.24297 N#CCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000211819 [0,0,0,0,0,0|3,0,0]=3 151 B21R2.24297 N#CCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000211819 [0,0,0,0,0,0|3,0,0]=3 152 B21R2.24297 N#CCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000211819 [0,0,0,0,0,0|4,0,0]=4 153 B21R2.24297 N#CCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000211819 [0,0,0,0,0,0|4,0,0]=4 154 B21R2.24297 N#CCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000211819 [0,0,0,0,0,0|2,0,0]=2 155 B21R2.24297 N#CCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000211819 [0,0,0,0,0,0|3,0,0]=3 156 B21R2.24297 N#CCCCSCc1ccccc1Cc2ccccc2 62a_100000687738_100010254464 [0,0,0,0,0,0|4,0,0]=4 157 B21R2.24297 N#CCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000687738 [0,0,0,0,0,0|4,0,0]=4 158 B21R2.24297 N#CCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_200000047693 [0,0,0,0,0,0|4,0,0]=4 159 B21R2.24297 N#CCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_200000047693 [0,0,0,0,0,0|4,0,0]=4 160 B21R2.24297 N#CCOCCOc1ccccc1Cc2ccccc2 7a_100000211249_200000047693 [0,0,0,0,0,0|3,0,0]=3 161 B21R2.24297 N#CCOCCOc1ccccc1Oc2ccccc2 7a_100000074787_200000047693 [0,0,0,0,0,0|4,0,0]=4 162 B21R2.24297 N#CCOCCSc1ccccc1Cc2ccccc2 62a_200000047693_200011216382 [0,0,0,0,0,0|3,1,0]=4 163 B21R2.24297 N#CCOCCSc1ccccc1Cc2ccccc2 62a_200011216382_200000047693 [0,0,0,0,0,0|3,1,0]=4 164 B21R2.24297 NCCCCOCc1ccccc1Cc2ccccc2 34a_100000750430_100010254464 [0,0,0,0,0,0|4,0,0]=4 165 B21R2.24297 O=CCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000139335 [0,0,0,0,0,0|3,0,0]=3 166 B21R2.24297 O=CCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000139335 [0,0,0,0,0,0|3,0,0]=3 167 B21R2.24297 O=CCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000139335 [0,0,0,0,0,0|4,0,0]=4 168 B21R2.24297 O=CCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000139335 [0,0,0,0,0,0|4,0,0]=4 169 B21R2.24297 O=CCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000139335 [0,0,0,0,0,0|2,0,0]=2 170 B21R2.24297 O=CCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000139335 [0,0,0,0,0,0|3,0,0]=3 171 B21R2.24297 O=CCCCCSc1ccccc1Cc2ccccc2 62a_100000139335_200011216382 [0,0,0,0,0,0|2,1,0]=3 172 B21R2.24297 O=CCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000139335 [0,0,0,0,0,0|2,1,0]=3 173 B21R2.24297 O=CCCCCSc1ccccc1Nc2ccccc2 62a_100000139335_100009815782 [0,0,0,0,0,0|3,1,0]=4 174 B21R2.24297 O=CCCCCSc1ccccc1Oc2ccccc2 62a_100000139335_100000049502 [0,0,0,0,0,0|3,1,0]=4 175 B21R2.24297 O=CCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_200011292268 [0,0,0,0,0,0|4,0,0]=4 176 B21R2.24297 O=CCCCSCc1ccccc1Cc2ccccc2 62a_200011292268_100010254464 [0,0,0,0,0,0|4,0,0]=4 177 B21R2.24297 OCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000746330 [0,0,0,0,0,0|3,0,0]=3 178 B21R2.24297 OCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000746330 [0,0,0,0,0,0|3,0,0]=3 179 B21R2.24297 OCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000746330 [0,0,0,0,0,0|3,0,0]=3 180 B21R2.24297 OCCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000746330 [0,0,0,0,0,0|4,0,0]=4 181 B21R2.24297 OCCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000746330 [0,0,0,0,0,0|4,0,0]=4 182 B21R2.24297 OCCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000746330 [0,0,0,0,0,0|4,0,0]=4 183 B21R2.24297 OCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000746330 [0,0,0,0,0,0|2,0,0]=2 184 B21R2.24297 OCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000746330 [0,0,0,0,0,0|2,0,0]=2 185 B21R2.24297 OCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000746330 [0,0,0,0,0,0|3,0,0]=3 186 B21R2.24297 OCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000746330 [0,0,0,0,0,0|3,0,0]=3 187 B21R2.24297 OCCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000746330 [0,0,0,0,0,0|4,0,0]=4 188 B21R2.24297 OCCCCCSc1ccccc1Cc2ccccc2 62a_100000746330_200011216382 [0,0,0,0,0,0|2,1,0]=3 189 B21R2.24297 OCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000746330 [0,0,0,0,0,0|2,1,0]=3 190 B21R2.24297 OCCCCCSc1ccccc1Nc2ccccc2 62a_100000746330_100009815782 [0,0,0,0,0,0|3,1,0]=4 191 B21R2.24297 OCCCCCSc1ccccc1Oc2ccccc2 62a_100000746330_100000049502 [0,0,0,0,0,0|3,1,0]=4 192 B21R2.24297 OCCCCNCc1ccccc1Cc2ccccc2 207a_100000750430_100009842342 [0,0,0,0,0,0|4,0,0]=4 193 B21R2.24297 OCCCCNCc1ccccc1Cc2ccccc2 2230a_100000750430_100010254464 [0,0,0,0,0,0|4,0,0]=4 194 B21R2.24297 OCCCCNCc1ccccc1Cc2ccccc2 270004a_100000750430_100009842342 [0,0,0,0,0,0|4,0,0]=4 195 B21R2.24297 OCCCCNCc1ccccc1Cc2ccccc2 34a_100000750430_100010254464 [0,0,0,0,0,0|4,0,0]=4 196 B21R2.24297 OCCCCSCc1ccccc1Cc2ccccc2 62a_100000210776_100010254464 [0,0,0,0,0,0|4,0,0]=4 197 B21R2.24297 OCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000210776 [0,0,0,0,0,0|4,0,0]=4 198 B21R2.24297 OCCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011215305 [0,0,0,0,0,0|4,0,0]=4 199 B21R2.24297 OCCOCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000692535 [0,0,0,0,0,0|4,0,0]=4 200 B21R2.24297 OCCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215305 [0,0,0,0,0,0|4,0,0]=4 201 B21R2.24297 OCCOCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000692535 [0,0,0,0,0,0|3,0,0]=3 202 B21R2.24297 OCCOCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011215305 [0,0,0,0,0,0|3,0,0]=3 203 B21R2.24297 OCCOCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000692535 [0,0,0,0,0,0|4,0,0]=4 204 B21R2.24297 OCCOCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011215305 [0,0,0,0,0,0|4,0,0]=4 205 B21R2.24297 OCCOCCSc1ccccc1Cc2ccccc2 62a_100011215305_200011216382 [0,0,0,0,0,0|3,1,0]=4 206 B21R2.24297 OCCOCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011215305 [0,0,0,0,0,0|3,1,0]=4 207 B22R2.2102 CCCCCC(=O)Cc1ccccc1Cc2ccccc2 1458a_100000212188_100010254464 [0,1,0,0,0,0|2,0,1]=4 208 B22R2.2102 CCCCCC(=O)Nc1ccccc1Cc2ccccc2 11a_100000211252_100000212188 [0,1,0,0,0,0|2,0,1]=4 209 B22R2.2102 CCCCCC(=O)Nc1ccccc1Cc2ccccc2 1626a_100000211252_100000212188 [0,1,0,0,0,0|2,0,1]=4 210 B22R2.2102 CCCCCC(=O)Nc1ccccc1Cc2ccccc2 22a_100000211252_100000212188 [0,1,0,0,0,0|2,0,1]=4 211 B22R2.2102 CCCCCN(C)Cc1ccccc1Cc2ccccc2 2230a_100000223495_100010254464 [0,1,0,0,0,0|3,0,0]=4 212 B22R2.2102 CCCCCN(C)Cc1ccccc1Cc2ccccc2 269982a_100000223495_100010254464 [0,1,0,0,0,0|3,0,0]=4 213 B22R2.2102 CCCCCN(C)Cc1ccccc1Cc2ccccc2 26a_100000223495_100000211249 [0,1,0,0,0,0|3,0,0]=4 214 B22R2.2102 CCCCCN(C)Cc1ccccc1Cc2ccccc2 270004a_100000223495_100009842342 [0,1,0,0,0,0|3,0,0]=4 215 B22R2.2102 COCCCC(=O)Cc1ccccc1Cc2ccccc2 1458a_100000741012_100010254464 [0,1,0,0,0,0|2,0,1]=4 216 B22R2.2102 COCCCC(=O)Nc1ccccc1Cc2ccccc2 11a_100000211252_100000741012 [0,1,0,0,0,0|2,0,1]=4 217 B22R2.2102 COCCCC(=O)Nc1ccccc1Cc2ccccc2 1626a_100000211252_100000741012 [0,1,0,0,0,0|2,0,1]=4 218 B22R2.2102 COCCCC(=O)Nc1ccccc1Cc2ccccc2 22a_100000211252_100000741012 [0,1,0,0,0,0|2,0,1]=4 219 B22R2.2102 COCCCN(C)Cc1ccccc1Cc2ccccc2 2230a_100000224831_100010254464 [0,1,0,0,0,0|3,0,0]=4 220 B22R2.2102 COCCCN(C)Cc1ccccc1Cc2ccccc2 269982a_100000224831_100010254464 [0,1,0,0,0,0|3,0,0]=4 221 B22R2.2102 COCCCN(C)Cc1ccccc1Cc2ccccc2 26a_100000224831_100000211249 [0,1,0,0,0,0|3,0,0]=4 222 B22R2.2102 COCCCN(C)Cc1ccccc1Cc2ccccc2 270004a_100000224831_100009842342 [0,1,0,0,0,0|3,0,0]=4 223 B22R2.2102 CSCCCC(=O)Cc1ccccc1Cc2ccccc2 1458a_100000173376_100010254464 [0,1,0,0,0,0|2,0,1]=4 224 B22R2.2102 CSCCCC(=O)Nc1ccccc1Cc2ccccc2 11a_100000211252_100000173376 [0,1,0,0,0,0|2,0,1]=4 225 B22R2.2102 CSCCCC(=O)Nc1ccccc1Cc2ccccc2 1626a_100000211252_100000173376 [0,1,0,0,0,0|2,0,1]=4 226 B22R2.2102 CSCCCC(=O)Nc1ccccc1Cc2ccccc2 22a_100000211252_100000173376 [0,1,0,0,0,0|2,0,1]=4 227 B22R2.8322 BrCCOCCOCc1ccccc1Cc2ccccc2 34a_100000692535_100010254464 [0,1,0,0,0,0|3,0,0]=4 228 B22R2.8322 BrCCOCCOCc1ccccc1Cc2ccccc2 7a_100000692535_100010254464 [0,1,0,0,0,0|3,0,0]=4 229 B22R2.8322 C#CCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100012094781 [0,1,0,0,0,0|2,0,1]=4 230 B22R2.8322 C#CCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100012094781 [0,1,0,0,0,0|2,0,1]=4 231 B22R2.8322 C#CCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100012094781 [0,1,0,0,0,0|2,0,1]=4 232 B22R2.8322 C#CCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100012094781 [0,1,0,0,0,0|1,0,1]=3 233 B22R2.8322 C#CCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100012094781 [0,1,0,0,0,0|1,0,1]=3 234 B22R2.8322 C#CCCCCNCc1ccccc1Cc2ccccc2 207a_100000706060_100009842342 [0,1,0,0,0,0|2,0,1]=4 235 B22R2.8322 C#CCCCCNCc1ccccc1Cc2ccccc2 2230a_100000706060_100010254464 [0,1,0,0,0,0|2,0,1]=4 236 B22R2.8322 C#CCCCCNCc1ccccc1Cc2ccccc2 34a_100000706060_100010254464 [0,1,0,0,0,0|2,0,1]=4 237 B22R2.8322 C#CCCCCOCc1ccccc1Cc2ccccc2 34a_100000766709_100010254464 [0,1,0,0,0,0|1,0,1]=3 238 B22R2.8322 C#CCCCCOCc1ccccc1Cc2ccccc2 7a_100000766709_100010254464 [0,1,0,0,0,0|1,0,1]=3 239 B22R2.8322 C#CCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100010269958 [0,1,0,0,0,0|2,0,1]=4 240 B22R2.8322 C#CCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100010269958 [0,1,0,0,0,0|2,0,1]=4 241 B22R2.8322 C#CCCCCOCc1ccccc1Oc2ccccc2 7a_100000766709_100000199117 [0,1,0,0,0,0|2,0,1]=4 242 B22R2.8322 C#CCOCCOCc1ccccc1Cc2ccccc2 34a_100000054580_100010254464 [0,1,0,0,0,0|2,0,1]=4 243 B22R2.8322 C#CCOCCOCc1ccccc1Cc2ccccc2 7a_100000054580_100010254464 [0,1,0,0,0,0|2,0,1]=4 244 B22R2.8322 C=CCCCCNCc1ccccc1Cc2ccccc2 207a_100000703577_100009842342 [0,1,0,0,0,0|2,0,1]=4 245 B22R2.8322 C=CCCCCNCc1ccccc1Cc2ccccc2 2230a_100000703577_100010254464 [0,1,0,0,0,0|2,0,1]=4 246 B22R2.8322 C=CCCCCNCc1ccccc1Cc2ccccc2 270004a_100000703577_100009842342 [0,1,0,0,0,0|2,0,1]=4 247 B22R2.8322 C=CCCCCNCc1ccccc1Cc2ccccc2 34a_100000703577_100010254464 [0,1,0,0,0,0|2,0,1]=4 248 B22R2.8322 C=CCOCCOCc1ccccc1Cc2ccccc2 34a_100000037705_100010254464 [0,1,0,0,0,0|2,0,1]=4 249 B22R2.8322 C=CCOCCOCc1ccccc1Cc2ccccc2 7a_100000037705_100010254464 [0,1,0,0,0,0|2,0,1]=4 250 B22R2.8322 CC=C=CCCOCc1ccccc1Cc2ccccc2 34a_100011020354_100010254464 [0,1,0,0,0,0|1,0,2]=4 251 B22R2.8322 CCC#CCCOCc1ccccc1Cc2ccccc2 34a_100000036655_100010254464 [0,1,0,0,0,0|1,0,2]=4 252 B22R2.8322 CCC#CCCOCc1ccccc1Cc2ccccc2 7a_100000036655_100010254464 [0,1,0,0,0,0|1,0,2]=4 253 B22R2.8322 CCCC#CCOCc1ccccc1Cc2ccccc2 34a_100000034806_100010254464 [0,1,0,0,0,0|1,0,2]=4 254 B22R2.8322 CCCC#CCOCc1ccccc1Cc2ccccc2 7a_100000034806_100010254464 [0,1,0,0,0,0|1,0,2]=4 255 B22R2.8322 CCCCCCNCc1ccccc1Cc2ccccc2 207a_100000210581_100009842342 [0,1,0,0,0,0|2,0,0]=3 256 B22R2.8322 CCCCCCNCc1ccccc1Cc2ccccc2 2230a_100000210581_100010254464 [0,1,0,0,0,0|2,0,0]=3 257 B22R2.8322 CCCCCCNCc1ccccc1Cc2ccccc2 270004a_100000210581_100009842342 [0,1,0,0,0,0|2,0,0]=3 258 B22R2.8322 CCCCCNN=Cc1ccccc1Cc2ccccc2 4a_100000694160_100009842342 [0,1,0,0,0,0|3,0,0]=4 259 B22R2.8322 CCCCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000743108 [0,1,0,0,0,0|2,0,0]=3 260 B22R2.8322 CCCCOCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000743108 [0,1,0,0,0,0|2,0,0]=3 261 B22R2.8322 CCCCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000743108 [0,1,0,0,0,0|2,0,0]=3 262 B22R2.8322 CCCCOCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000743108 [0,1,0,0,0,0|3,0,0]=4 263 B22R2.8322 CCCCOCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000743108 [0,1,0,0,0,0|3,0,0]=4 264 B22R2.8322 CCCCOCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000743108 [0,1,0,0,0,0|1,0,0]=2 265 B22R2.8322 CCCCOCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000743108 [0,1,0,0,0,0|1,0,0]=2 266 B22R2.8322 CCCCOCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000743108 [0,1,0,0,0,0|2,0,0]=3 267 B22R2.8322 CCCCOCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000743108 [0,1,0,0,0,0|2,0,0]=3 268 B22R2.8322 CCCCOCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000743108 [0,1,0,0,0,0|3,0,0]=4 269 B22R2.8322 CCCCOCOCc1ccccc1Oc2ccccc2 34a_100000246416_100011995733 [0,1,0,0,0,0|3,0,0]=4 270 B22R2.8322 CCCOCCNCc1ccccc1Cc2ccccc2 207a_100161115042_100009842342 [0,1,0,0,0,0|3,0,0]=4 271 B22R2.8322 CCCOCCNCc1ccccc1Cc2ccccc2 2230a_100161115042_100010254464 [0,1,0,0,0,0|3,0,0]=4 272 B22R2.8322 CCCOCCNCc1ccccc1Cc2ccccc2 270004a_100161115042_100009842342 [0,1,0,0,0,0|3,0,0]=4 273 B22R2.8322 CCCOCCNCc1ccccc1Cc2ccccc2 34a_100161115042_100010254464 [0,1,0,0,0,0|3,0,0]=4 274 B22R2.8322 CCCOCCOCc1ccccc1Cc2ccccc2 34a_100000752267_100010254464 [0,1,0,0,0,0|2,0,0]=3 275 B22R2.8322 CCCOCCOCc1ccccc1Cc2ccccc2 7a_100000752267_100010254464 [0,1,0,0,0,0|2,0,0]=3 276 B22R2.8322 CCCOCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100011215938 [0,1,0,0,0,0|3,0,0]=4 277 B22R2.8322 CCCOCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100011215938 [0,1,0,0,0,0|3,0,0]=4 278 B22R2.8322 CCCOCCOCc1ccccc1Oc2ccccc2 7a_100000752267_100000199117 [0,1,0,0,0,0|3,0,0]=4 279 B22R2.8322 CCCOCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100011215938 [0,1,0,0,0,0|2,1,0]=4 280 B22R2.8322 CCCOCCSCc1ccccc1Cc2ccccc2 62a_100011215938_100010254464 [0,1,0,0,0,0|2,1,0]=4 281 B22R2.8322 CCCSCCNCc1ccccc1Cc2ccccc2 207a_100020603323_100009842342 [0,1,0,0,0,0|3,0,0]=4 282 B22R2.8322 CCCSCCNCc1ccccc1Cc2ccccc2 2230a_100020603323_100010254464 [0,1,0,0,0,0|3,0,0]=4 283 B22R2.8322 CCCSCCNCc1ccccc1Cc2ccccc2 270004a_100020603323_100009842342 [0,1,0,0,0,0|3,0,0]=4 284 B22R2.8322 CCCSCCOCc1ccccc1Cc2ccccc2 34a_200000230433_100010254464 [0,1,0,0,0,0|2,0,0]=3 285 B22R2.8322 CCCSCCOCc1ccccc1Cc2ccccc2 7a_200000230433_100010254464 [0,1,0,0,0,0|2,0,0]=3 286 B22R2.8322 CCOCCCNCc1ccccc1Cc2ccccc2 207a_100000210961_100009842342 [0,1,0,0,0,0|3,0,0]=4 287 B22R2.8322 CCOCCCNCc1ccccc1Cc2ccccc2 2230a_100000210961_100010254464 [0,1,0,0,0,0|3,0,0]=4 288 B22R2.8322 CCOCCCNCc1ccccc1Cc2ccccc2 270004a_100000210961_100009842342 [0,1,0,0,0,0|3,0,0]=4 289 B22R2.8322 CCOCCCNCc1ccccc1Cc2ccccc2 34a_100000210961_100010254464 [0,1,0,0,0,0|3,0,0]=4 290 B22R2.8322 CCOCCCOCc1ccccc1Cc2ccccc2 34a_100000757476_100010254464 [0,1,0,0,0,0|2,0,0]=3 291 B22R2.8322 CCOCCCOCc1ccccc1Cc2ccccc2 7a_100000757476_100010254464 [0,1,0,0,0,0|2,0,0]=3 292 B22R2.8322 CCOCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100012232248 [0,1,0,0,0,0|3,0,0]=4 293 B22R2.8322 CCOCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100012232248 [0,1,0,0,0,0|3,0,0]=4 294 B22R2.8322 CCOCCCOCc1ccccc1Oc2ccccc2 7a_100000757476_100000199117 [0,1,0,0,0,0|3,0,0]=4 295 B22R2.8322 CCOCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100012232248 [0,1,0,0,0,0|2,1,0]=4 296 B22R2.8322 CCOCCCSCc1ccccc1Cc2ccccc2 62a_100012232248_100010254464 [0,1,0,0,0,0|2,1,0]=4 297 B22R2.8322 CCSCCCOCc1ccccc1Cc2ccccc2 34a_100011216438_100010254464 [0,1,0,0,0,0|2,0,0]=3 298 B22R2.8322 CCSCCCOCc1ccccc1Cc2ccccc2 7a_100011216438_100010254464 [0,1,0,0,0,0|2,0,0]=3 299 B22R2.8322 COCCCCNCc1ccccc1Oc2ccccc2 2230a_100016987831_100000730899 [0,1,0,0,0,0|3,0,0]=4 300 B22R2.8322 COCCCCNCc1ccccc1Oc2ccccc2 34a_100016987831_100000755781 [0,1,0,0,0,0|3,0,0]=4 301 B22R2.8322 COCCCCOCc1ccccc1Cc2ccccc2 34a_100000740925_100010254464 [0,1,0,0,0,0|1,0,0]=2 302 B22R2.8322 COCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000755781 [0,1,0,0,0,0|2,0,0]=3 303 B22R2.8322 COCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000730899 [0,1,0,0,0,0|2,0,0]=3 304 B22R2.8322 COCCCCSCc1ccccc1Cc2ccccc2 62a_100000730899_100010254464 [0,1,0,0,0,0|1,1,0]=3 305 B22R2.8322 COCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000730899 [0,1,0,0,0,0|1,1,0]=3 306 B22R2.8322 COCCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000695917 [0,1,0,0,0,0|2,0,0]=3 307 B22R2.8322 COCCOCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000695917 [0,1,0,0,0,0|2,0,0]=3 308 B22R2.8322 COCCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000695917 [0,1,0,0,0,0|2,0,0]=3 309 B22R2.8322 COCCOCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000695917 [0,1,0,0,0,0|3,0,0]=4 310 B22R2.8322 COCCOCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000695917 [0,1,0,0,0,0|3,0,0]=4 311 B22R2.8322 COCCOCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000695917 [0,1,0,0,0,0|3,0,0]=4 312 B22R2.8322 COCCOCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000695917 [0,1,0,0,0,0|1,0,0]=2 313 B22R2.8322 COCCOCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000695917 [0,1,0,0,0,0|1,0,0]=2 314 B22R2.8322 COCCOCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000695917 [0,1,0,0,0,0|2,0,0]=3 315 B22R2.8322 COCCOCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000695917 [0,1,0,0,0,0|2,0,0]=3 316 B22R2.8322 COCCOCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000695917 [0,1,0,0,0,0|3,0,0]=4 317 B22R2.8322 COCCOCCSc1ccccc1Cc2ccccc2 62a_100000695917_200011216382 [0,1,0,0,0,0|1,1,0]=3 318 B22R2.8322 COCCOCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000695917 [0,1,0,0,0,0|1,1,0]=3 319 B22R2.8322 COCCOCCSc1ccccc1Nc2ccccc2 62a_100000695917_100009815782 [0,1,0,0,0,0|2,1,0]=4 320 B22R2.8322 COCCOCCSc1ccccc1Oc2ccccc2 62a_100000695917_100000049502 [0,1,0,0,0,0|2,1,0]=4 321 B22R2.8322 COCCOCSCc1ccccc1Cc2ccccc2 62a_100000231047_100010254464 [0,1,0,0,0,0|2,1,0]=4 322 B22R2.8322 COCCOCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000231047 [0,1,0,0,0,0|2,1,0]=4 323 B22R2.8322 CSCCCCOCc1ccccc1Cc2ccccc2 34a_100011217163_100010254464 [0,1,0,0,0,0|1,0,0]=2 324 B22R2.8322 CSCCCCOCc1ccccc1Cc2ccccc2 7a_100011217163_100010254464 [0,1,0,0,0,0|1,0,0]=2 325 B22R2.8322 ClCCOCCOCc1ccccc1Cc2ccccc2 34a_100011215305_100010254464 [0,1,0,0,0,0|3,0,0]=4 326 B22R2.8322 ClCCOCCOCc1ccccc1Cc2ccccc2 7a_100011215305_100010254464 [0,1,0,0,0,0|3,0,0]=4 327 B22R2.8322 FCCCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100015922095 [0,1,0,0,0,0|3,0,0]=4 328 B22R2.8322 FCCOCCOCc1ccccc1Cc2ccccc2 34a_200015357709_100010254464 [0,1,0,0,0,0|3,0,0]=4 329 B22R2.8322 FCCOCCOCc1ccccc1Cc2ccccc2 7a_200015357709_100010254464 [0,1,0,0,0,0|3,0,0]=4 330 B22R2.8322 ICCOCCOCc1ccccc1Cc2ccccc2 34a_100012149058_100010254464 [0,1,0,0,0,0|3,0,0]=4 331 B22R2.8322 ICCOCCOCc1ccccc1Cc2ccccc2 7a_100012149058_100010254464 [0,1,0,0,0,0|3,0,0]=4 332 B22R2.8322 N#CCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100009813376 [0,1,0,0,0,0|2,0,1]=4 333 B22R2.8322 N#CCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100009813376 [0,1,0,0,0,0|2,0,1]=4 334 B22R2.8322 N#CCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100009813376 [0,1,0,0,0,0|1,0,1]=3 335 B22R2.8322 N#CCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100009813376 [0,1,0,0,0,0|2,0,1]=4 336 B22R2.8322 N#CCCCCNCc1ccccc1Cc2ccccc2 270004a_100000751965_100009842342 [0,1,0,0,0,0|3,0,0]=4 337 B22R2.8322 N#CCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000211819 [0,1,0,0,0,0|3,0,0]=4 338 B22R2.8322 NCCCCCOCc1ccccc1Cc2ccccc2 34a_100000762737_100010254464 [0,1,0,0,0,0|2,0,0]=3 339 B22R2.8322 NCCOCCOCc1ccccc1Cc2ccccc2 34a_100000211614_100010254464 [0,1,0,0,0,0|3,0,0]=4 340 B22R2.8322 O=CCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000139337 [0,1,0,0,0,0|2,0,1]=4 341 B22R2.8322 O=CCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000139337 [0,1,0,0,0,0|2,0,1]=4 342 B22R2.8322 O=CCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000139337 [0,1,0,0,0,0|1,0,1]=3 343 B22R2.8322 O=CCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000139337 [0,1,0,0,0,0|2,0,1]=4 344 B22R2.8322 O=CCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000139335 [0,1,0,0,0,0|3,0,0]=4 345 B22R2.8322 O=CCCCCSCc1ccccc1Cc2ccccc2 62a_100000139335_100010254464 [0,1,0,0,0,0|2,1,0]=4 346 B22R2.8322 O=CCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000139335 [0,1,0,0,0,0|2,1,0]=4 347 B22R2.8322 OCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000766143 [0,1,0,0,0,0|2,0,0]=3 348 B22R2.8322 OCCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000766143 [0,1,0,0,0,0|2,0,0]=3 349 B22R2.8322 OCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000766143 [0,1,0,0,0,0|2,0,0]=3 350 B22R2.8322 OCCCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000766143 [0,1,0,0,0,0|3,0,0]=4 351 B22R2.8322 OCCCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000766143 [0,1,0,0,0,0|3,0,0]=4 352 B22R2.8322 OCCCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000766143 [0,1,0,0,0,0|3,0,0]=4 353 B22R2.8322 OCCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000766143 [0,1,0,0,0,0|1,0,0]=2 354 B22R2.8322 OCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000766143 [0,1,0,0,0,0|1,0,0]=2 355 B22R2.8322 OCCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000766143 [0,1,0,0,0,0|2,0,0]=3 356 B22R2.8322 OCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000766143 [0,1,0,0,0,0|2,0,0]=3 357 B22R2.8322 OCCCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000766143 [0,1,0,0,0,0|3,0,0]=4 358 B22R2.8322 OCCCCCCSc1ccccc1Cc2ccccc2 62a_100000766143_200011216382 [0,1,0,0,0,0|1,1,0]=3 359 B22R2.8322 OCCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000766143 [0,1,0,0,0,0|1,1,0]=3 360 B22R2.8322 OCCCCCNCc1ccccc1Cc2ccccc2 207a_100000762737_100009842342 [0,1,0,0,0,0|3,0,0]=4 361 B22R2.8322 OCCCCCNCc1ccccc1Cc2ccccc2 2230a_100000762737_100010254464 [0,1,0,0,0,0|3,0,0]=4 362 B22R2.8322 OCCCCCNCc1ccccc1Cc2ccccc2 270004a_100000762737_100009842342 [0,1,0,0,0,0|3,0,0]=4 363 B22R2.8322 OCCCCCNCc1ccccc1Cc2ccccc2 34a_100000762737_100010254464 [0,1,0,0,0,0|3,0,0]=4 364 B22R2.8322 OCCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000746330 [0,1,0,0,0,0|3,0,0]=4 365 B22R2.8322 OCCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000746330 [0,1,0,0,0,0|3,0,0]=4 366 B22R2.8322 OCCCCCSCc1ccccc1Cc2ccccc2 62a_100000746330_100010254464 [0,1,0,0,0,0|2,1,0]=4 367 B22R2.8322 OCCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000746330 [0,1,0,0,0,0|2,1,0]=4 368 B22R2.15248 CC(=O)CCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100009817362 [0,1,0,0,0,0|2,0,0]=3 369 B22R2.15248 CC(=O)CCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000735457 [0,1,0,0,0,0|2,0,0]=3 370 B22R2.15248 CC(=O)CCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100009817362 [0,1,0,0,0,0|3,0,0]=4 371 B22R2.15248 CC(=O)CCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100009817362 [0,1,0,0,0,0|1,0,0]=2 372 B22R2.15248 CC(=O)CCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000735457 [0,1,0,0,0,0|1,0,0]=2 373 B22R2.15248 CC(=O)CCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100009817362 [0,1,0,0,0,0|2,0,0]=3 374 B22R2.15248 CC(=O)CCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000735457 [0,1,0,0,0,0|2,0,0]=3 375 B22R2.15248 CC(=O)CCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100009817362 [0,1,0,0,0,0|3,0,0]=4 376 B22R2.15248 CC(=O)CCCOCc1ccccc1Cc2ccccc2 34a_100000759063_100010254464 [0,1,0,0,0,0|3,0,0]=4 377 B22R2.15248 CC(=O)CCCOCc1ccccc1Cc2ccccc2 7a_100000759063_100010254464 [0,1,0,0,0,0|3,0,0]=4 378 B22R2.15248 CC(=O)CCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100011215641 [0,1,0,0,0,0|3,0,0]=4 379 B22R2.15248 CC(=O)CCCSCc1ccccc1Cc2ccccc2 62a_100011215641_100010254464 [0,1,0,0,0,0|3,0,0]=4 380 B22R2.15248 CC(=O)OCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000042594 [0,1,0,0,0,0|3,0,0]=4 381 B22R2.15248 CC(=O)OCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000042594 [0,1,0,0,0,0|3,0,0]=4 382 B22R2.15248 CC(=O)OCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000042594 [0,1,0,0,0,0|2,0,0]=3 383 B22R2.15248 CC(=O)OCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000042594 [0,1,0,0,0,0|2,0,0]=3 384 B22R2.15248 CC(=O)OCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000042594 [0,1,0,0,0,0|3,0,0]=4 385 B22R2.15248 CC(=O)OCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000042594 [0,1,0,0,0,0|3,0,0]=4 386 B22R2.15248 CC(=O)OCCCSc1ccccc1Cc2ccccc2 62a_100000042594_200011216382 [0,1,0,0,0,0|2,1,0]=4 387 B22R2.15248 CC(=O)OCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000042594 [0,1,0,0,0,0|2,1,0]=4 388 B22R2.15248 CC(=O)SCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000038929 [0,1,0,0,0,0|3,0,0]=4 389 B22R2.15248 CC(=O)SCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000038929 [0,1,0,0,0,0|3,0,0]=4 390 B22R2.15248 CC(=O)SCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000038929 [0,1,0,0,0,0|3,0,0]=4 391 B22R2.15248 CC(=O)SCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000038929 [0,1,0,0,0,0|2,0,0]=3 392 B22R2.15248 CC(=O)SCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000038929 [0,1,0,0,0,0|2,0,0]=3 393 B22R2.15248 CC(=O)SCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000038929 [0,1,0,0,0,0|3,0,0]=4 394 B22R2.15248 CC(=O)SCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000038929 [0,1,0,0,0,0|3,0,0]=4 395 B22R2.15248 CC(=S)OCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_200135323944 [0,1,0,0,0,0|3,0,0]=4 396 B22R2.15248 CC(=S)OCCCNc1ccccc1Cc2ccccc2 34a_100000211252_200135323944 [0,1,0,0,0,0|3,0,0]=4 397 B22R2.15248 CC(=S)OCCCNc1ccccc1Cc2ccccc2 7a_100000211252_200135323944 [0,1,0,0,0,0|3,0,0]=4 398 B22R2.15248 CC(=S)OCCCOc1ccccc1Cc2ccccc2 34a_100000211249_200135323944 [0,1,0,0,0,0|2,0,0]=3 399 B22R2.15248 CC(=S)OCCCOc1ccccc1Cc2ccccc2 7a_100000211249_200135323944 [0,1,0,0,0,0|2,0,0]=3 400 B22R2.15248 CC(=S)OCCCOc1ccccc1Oc2ccccc2 34a_100000074787_200135323944 [0,1,0,0,0,0|3,0,0]=4 401 B22R2.15248 CC(=S)OCCCOc1ccccc1Oc2ccccc2 7a_100000074787_200135323944 [0,1,0,0,0,0|3,0,0]=4 402 B22R2.15248 CC(C)CCCNCc1ccccc1Cc2ccccc2 207a_200000737386_100009842342 [0,1,0,0,0,0|3,0,0]=4 403 B22R2.15248 CC(C)CCCNCc1ccccc1Cc2ccccc2 2230a_200000737386_100010254464 [0,1,0,0,0,0|3,0,0]=4 404 B22R2.15248 CC(C)CCCNCc1ccccc1Cc2ccccc2 270004a_200000737386_100009842342 [0,1,0,0,0,0|3,0,0]=4 405 B22R2.15248 CC(C)CCCNCc1ccccc1Cc2ccccc2 34a_200000737386_100010254464 [0,1,0,0,0,0|3,0,0]=4 406 B22R2.15248 CC(O)CCCSCc1ccccc1Cc2ccccc2 62a_100010254464_200000718107 [0,1,0,0,0,0|3,0,0]=4 407 B22R2.15248 CC(O)CCCSCc1ccccc1Cc2ccccc2 62a_200000718107_100010254464 [0,1,0,0,0,0|3,0,0]=4 408 B22R2.15248 CN(C)CCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000690147 [0,1,0,0,0,0|0,1,0]=2 409 B22R2.15248 CN(C)CCCNCc1ccccc1Cc2ccccc2 207a_102531767803_100009842342 [0,1,0,0,0,0|2,0,0]=3 410 B22R2.15248 CN(C)CCCNCc1ccccc1Cc2ccccc2 270004a_102531767803_100009842342 [0,1,0,0,0,0|2,0,0]=3 411 B22R2.15248 CN(C)CCCNCc1ccccc1Oc2ccccc2 207a_102531767803_100011234122 [0,1,0,0,0,0|3,0,0]=4 412 B22R2.15248 CN(C)CCCNCc1ccccc1Oc2ccccc2 270004a_102531767803_100011234122 [0,1,0,0,0,0|3,0,0]=4 413 B22R2.15248 CN(C)CCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000757444 [0,1,0,0,0,0|3,0,0]=4 414 B22R2.15248 CN(C)CCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000757444 [0,1,0,0,0,0|2,0,0]=3 415 B22R2.15248 CN(C)CCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000757444 [0,1,0,0,0,0|3,0,0]=4 416 B22R2.15248 CS(=O)CCCNCc1ccccc1Cc2ccccc2 207a_200000753449_100009842342 [0,1,0,0,0,0|3,0,0]=4 417 B22R2.15248 CS(=O)CCCNCc1ccccc1Cc2ccccc2 2230a_200000753449_100010254464 [0,1,0,0,0,0|3,0,0]=4 418 B22R2.15248 CS(=O)CCCNCc1ccccc1Cc2ccccc2 270004a_200000753449_100009842342 [0,1,0,0,0,0|3,0,0]=4 419 B22R2.15248 FC(F)COCCOc1ccccc1Cc2ccccc2 34a_100000211249_200012177212 [0,1,0,0,0,0|3,0,0]=4 420 B22R2.15248 FC(F)COCCOc1ccccc1Cc2ccccc2 7a_100000211249_200012177212 [0,1,0,0,0,0|3,0,0]=4 421 B22R2.15248 NC(=O)COCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000076697 [0,1,0,0,0,0|3,0,0]=4 422 B22R2.15248 NC(=O)COCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000076697 [0,1,0,0,0,0|3,0,0]=4 423 B22R2.15248 OB(O)CCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_200009817182 [0,1,0,0,0,0|3,0,0]=4 424 B22R2.15248 OB(O)CCCCNc1ccccc1Cc2ccccc2 34a_100000211252_200009817182 [0,1,0,0,0,0|3,0,0]=4 425 B22R2.15248 OB(O)CCCCNc1ccccc1Cc2ccccc2 7a_100000211252_200009817182 [0,1,0,0,0,0|3,0,0]=4 426 B22R2.15248 OB(O)CCCCOc1ccccc1Cc2ccccc2 34a_100000211249_200009817182 [0,1,0,0,0,0|2,0,0]=3 427 B22R2.15248 OB(O)CCCCOc1ccccc1Cc2ccccc2 7a_100000211249_200009817182 [0,1,0,0,0,0|2,0,0]=3 428 B22R2.15248 OB(O)CCCCOc1ccccc1Oc2ccccc2 34a_100000074787_200009817182 [0,1,0,0,0,0|3,0,0]=4 429 B22R2.15248 OB(O)CCCCOc1ccccc1Oc2ccccc2 7a_100000074787_200009817182 [0,1,0,0,0,0|3,0,0]=4 430 B22R2.15248 OB(O)CCCCSc1ccccc1Cc2ccccc2 62a_200009817182_200011216382 [0,1,0,0,0,0|2,1,0]=4 431 B22R2.15248 OB(O)CCCCSc1ccccc1Cc2ccccc2 62a_200011216382_200009817182 [0,1,0,0,0,0|2,1,0]=4 432 B22R2.26330 COCCCCNc1ccccc1Oc2cccc(c2)C 2230a_100000184146_100000730899 [0,1,0,0,0,0|3,0,0]=4 433 B22R2.26330 COCCCCNc1ccccc1Oc2cccc(c2)C 34a_100000184146_100000755781 [0,1,0,0,0,0|3,0,0]=4 434 B22R2.26330 COCCCCNc1ccccc1Oc2cccc(c2)C 7a_100000184146_100000730899 [0,1,0,0,0,0|3,0,0]=4 435 B22R2.26330 COCCCCNc1ccccc1Oc2cccc(c2)F 2230a_100000743720_100000730899 [0,1,0,0,0,0|3,0,0]=4 436 B22R2.26330 COCCCCNc1ccccc1Oc2cccc(c2)F 34a_100000743720_100000755781 [0,1,0,0,0,0|3,0,0]=4 437 B22R2.26330 COCCCCNc1ccccc1Oc2cccc(c2)F 7a_100000743720_100000730899 [0,1,0,0,0,0|3,0,0]=4 438 B22R2.27057 CCC(C)CCNCc1ccccc1Cc2ccccc2 207a_100020591266_100009842342 [0,1,0,0,0,0|3,0,0]=4 439 B22R2.27057 CCC(C)CCNCc1ccccc1Cc2ccccc2 2230a_100020591266_100010254464 [0,1,0,0,0,0|3,0,0]=4 440 B22R2.27057 CCC(C)CCNCc1ccccc1Cc2ccccc2 270004a_100020591266_100009842342 [0,1,0,0,0,0|3,0,0]=4 441 B22R2.27057 CCN(C)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100015186262 [0,1,0,0,0,0|3,0,0]=4 442 B22R2.27057 CCN(C)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100015186262 [0,1,0,0,0,0|3,0,0]=4 443 B22R2.27057 CCN(C)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100015186262 [0,1,0,0,0,0|2,0,0]=3 444 B22R2.27057 CCN(C)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100015186262 [0,1,0,0,0,0|3,0,0]=4 445 B22R2.27057 CCN(C)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100015186262 [0,1,0,0,0,0|2,1,0]=4 446 B22R2.27057 CNC(=O)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000741757 [0,1,0,0,0,0|1,0,1]=3 447 B22R2.27057 CNC(=O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000741757 [0,1,0,0,0,0|1,0,1]=3 448 B22R2.27057 CNC(=O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000741757 [0,1,0,0,0,0|1,0,1]=3 449 B22R2.27057 CNC(=O)CCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000741757 [0,1,0,0,0,0|2,0,1]=4 450 B22R2.27057 CNC(=O)CCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000741757 [0,1,0,0,0,0|2,0,1]=4 451 B22R2.27057 CNC(=O)CCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000741757 [0,1,0,0,0,0|2,0,1]=4 452 B22R2.27057 CNC(=O)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000741757 [0,1,0,0,0,0|0,0,1]=2 453 B22R2.27057 CNC(=O)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000741757 [0,1,0,0,0,0|0,0,1]=2 454 B22R2.27057 CNC(=O)CCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000741757 [0,1,0,0,0,0|1,0,1]=3 455 B22R2.27057 CNC(=O)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000741757 [0,1,0,0,0,0|1,0,1]=3 456 B22R2.27057 CNC(=O)CCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000741757 [0,1,0,0,0,0|2,0,1]=4 457 B22R2.27057 CNC(=O)CCCSc1ccccc1Cc2ccccc2 62a_100000741757_200011216382 [0,1,0,0,0,0|0,1,1]=3 458 B22R2.27057 CNC(=O)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000741757 [0,1,0,0,0,0|0,1,1]=3 459 B22R2.27057 CNC(=O)CCCSc1ccccc1Nc2ccccc2 62a_100000741757_100009815782 [0,1,0,0,0,0|1,1,1]=4 460 B22R2.27057 CNC(=O)CCCSc1ccccc1Oc2ccccc2 62a_100000741757_100000049502 [0,1,0,0,0,0|1,1,1]=4 461 B22R2.27057 CNC(=O)CCNCc1ccccc1Cc2ccccc2 207a_100000738227_100009842342 [0,1,0,0,0,0|2,0,1]=4 462 B22R2.27057 CNC(=O)CCNCc1ccccc1Cc2ccccc2 2230a_100000738227_100010254464 [0,1,0,0,0,0|2,0,1]=4 463 B22R2.27057 CNC(=O)CCNCc1ccccc1Cc2ccccc2 270004a_100000738227_100009842342 [0,1,0,0,0,0|2,0,1]=4 464 B22R2.27057 CNC(=O)CCNCc1ccccc1Cc2ccccc2 34a_100000738227_100010254464 [0,1,0,0,0,0|2,0,1]=4 465 B22R2.27057 CNC(=O)CCOCc1ccccc1Cc2ccccc2 34a_100000754576_100010254464 [0,1,0,0,0,0|2,0,1]=4 466 B22R2.27057 CNC(=O)CCSCc1ccccc1Cc2ccccc2 62a_100000737683_100010254464 [0,1,0,0,0,0|2,0,1]=4 467 B22R2.27057 CNC(=O)CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000737683 [0,1,0,0,0,0|2,0,1]=4 468 B22R2.27057 CNC(=O)OCCNc1ccccc1Cc2ccccc2 34a_100000211252_200011997002 [0,1,0,0,0,0|2,0,1]=4 469 B22R2.27057 CNC(=O)OCCNc1ccccc1Cc2ccccc2 7a_100000211252_200011997002 [0,1,0,0,0,0|2,0,1]=4 470 B22R2.27057 CNC(=O)OCCOc1ccccc1Cc2ccccc2 34a_100000211249_200011997002 [0,1,0,0,0,0|1,0,1]=3 471 B22R2.27057 CNC(=O)OCCOc1ccccc1Cc2ccccc2 7a_100000211249_200011997002 [0,1,0,0,0,0|1,0,1]=3 472 B22R2.27057 CNC(=O)OCCOc1ccccc1Oc2ccccc2 34a_100000074787_200011997002 [0,1,0,0,0,0|2,0,1]=4 473 B22R2.27057 CNC(=O)OCCOc1ccccc1Oc2ccccc2 7a_100000074787_200011997002 [0,1,0,0,0,0|2,0,1]=4 474 B22R2.27057 CNC(=O)OCCSc1ccccc1Cc2ccccc2 62a_200011216382_200011997002 [0,1,0,0,0,0|1,1,1]=4 475 B22R2.27057 CNC(=O)OCCSc1ccccc1Cc2ccccc2 62a_200011997002_200011216382 [0,1,0,0,0,0|1,1,1]=4 476 B22R2.27057 COC(=O)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011218270 [0,1,0,0,0,0|2,0,1]=4 477 B22R2.27057 COC(=O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000742333 [0,1,0,0,0,0|2,0,1]=4 478 B22R2.27057 COC(=O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011218270 [0,1,0,0,0,0|2,0,1]=4 479 B22R2.27057 COC(=O)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000742333 [0,1,0,0,0,0|1,0,1]=3 480 B22R2.27057 COC(=O)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011218270 [0,1,0,0,0,0|1,0,1]=3 481 B22R2.27057 COC(=O)CCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000742333 [0,1,0,0,0,0|2,0,1]=4 482 B22R2.27057 COC(=O)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011218270 [0,1,0,0,0,0|2,0,1]=4 483 B22R2.27057 COC(=O)CCCSc1ccccc1Cc2ccccc2 62a_100011218270_200011216382 [0,1,0,0,0,0|1,1,1]=4 484 B22R2.27057 COC(=O)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011218270 [0,1,0,0,0,0|1,1,1]=4 485 B22R2.27057 COC(C)CCOCc1ccccc1Cc2ccccc2 7a_100000764861_100010254464 [0,1,0,0,0,0|3,0,0]=4 486 B22R2.28715 COCCCCNc1ccccc1Oc2ccc(cc2)C 34a_100025771381_100000755781 [0,1,0,0,0,0|3,0,0]=4 487 B22R2.28715 COCCCCNc1ccccc1Oc2ccc(cc2)Cl 2230a_100000745279_100000730899 [0,1,0,0,0,0|3,0,0]=4 488 B22R2.28715 COCCCCNc1ccccc1Oc2ccc(cc2)Cl 34a_100000745279_100000755781 [0,1,0,0,0,0|3,0,0]=4 489 B22R2.28715 COCCCCNc1ccccc1Oc2ccc(cc2)F 2230a_100011202611_100000730899 [0,1,0,0,0,0|3,0,0]=4 490 B22R2.28715 COCCCCNc1ccccc1Oc2ccc(cc2)F 34a_100011202611_100000755781 [0,1,0,0,0,0|3,0,0]=4 491 B22R2.28715 COCCCCNc1ccccc1Sc2ccc(cc2)F 34a_100011228964_100000755781 [0,1,0,0,0,0|3,0,0]=4 492 B22R2.29090 C#CCOCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100010402529 [0,1,0,0,0,0|2,0,1]=4 493 B22R2.29090 C#CCOCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100010402529 [0,1,0,0,0,0|2,0,1]=4 494 B22R2.29090 CCCOCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100011215938 [0,1,0,0,0,0|2,0,0]=3 495 B22R2.29090 CCCOCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100011215938 [0,1,0,0,0,0|2,0,0]=3 496 B22R2.29090 CCOCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100012232248 [0,1,0,0,0,0|2,0,0]=3 497 B22R2.29090 CCOCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100012232248 [0,1,0,0,0,0|2,0,0]=3 498 B22R2.29090 COCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000755781 [0,1,0,0,0,0|1,0,0]=2 499 B22R2.29090 COCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000730899 [0,1,0,0,0,0|1,0,0]=2 500 B22R2.29090 N#CCOCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_200000047693 [0,1,0,0,0,0|3,0,0]=4 501 B22R2.29090 O=CCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000139335 [0,1,0,0,0,0|2,0,0]=3 502 B22R2.29090 OCCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000746330 [0,1,0,0,0,0|2,0,0]=3 503 B22R2.29090 OCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000746330 [0,1,0,0,0,0|2,0,0]=3 504 B22R2.29090 OCCOCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000692535 [0,1,0,0,0,0|3,0,0]=4 505 B22R2.29090 OCCOCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100011215305 [0,1,0,0,0,0|3,0,0]=4 506 B22R2.29741 C=C(COc1ccccc1Cc2ccccc2)OCOC 34a_100000211249_100000042856 [0,1,0,0,0,0|2,0,1]=4 507 B22R2.29741 CCCCC(C)NCc1ccccc1Cc2ccccc2 207a_100000126638_100009842342 [0,1,0,0,0,0|3,0,0]=4 508 B22R2.29741 CCCCC(C)NCc1ccccc1Cc2ccccc2 2230a_100000126638_100010254464 [0,1,0,0,0,0|3,0,0]=4 509 B22R2.29741 CCCCC(C)NCc1ccccc1Cc2ccccc2 270004a_100000126638_100009842342 [0,1,0,0,0,0|3,0,0]=4 510 B22R2.29741 CCCNC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000183358 [0,1,0,0,0,0|2,0,1]=4 511 B22R2.29741 CCCNC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000183358 [0,1,0,0,0,0|2,0,1]=4 512 B22R2.29741 CCCOC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_200011215008 [0,1,0,0,0,0|2,0,1]=4 513 B22R2.29741 CCCOC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_200011215008 [0,1,0,0,0,0|2,0,1]=4 514 B22R2.30740 CCCC(=O)OCOc1ccccc1Cc2ccccc2 34a_100000211249_100000034017 [0,1,0,0,0,0|2,0,1]=4 515 B22R2.30740 CCC[C@H](N)COCc1ccccc1Cc2ccccc2 34a_100000732646_100010254464 [0,1,0,0,0,0|3,0,0]=4 516 B22R2.30740 CCNC(=O)CCOc1ccccc1Cc2ccccc2 7a_100000211249_100000737597 [0,1,0,0,0,0|2,0,1]=4 517 B22R2.30740 CCOC(=O)CCOc1ccccc1Cc2ccccc2 34a_100000211249_100000765890 [0,1,0,0,0,0|2,0,1]=4 518 B22R2.30740 CCOC(=O)CCOc1ccccc1Cc2ccccc2 7a_100000211249_100011206558 [0,1,0,0,0,0|2,0,1]=4 519 B22R2.30740 COCC(N)COCc1ccccc1Cc2ccccc2 34a_100000724102_100010254464 [0,1,0,0,0,0|3,0,0]=4 520 B22R2.30740 COCC(O)CNCc1ccccc1Cc2ccccc2 207a_100000756049_100009842342 [0,1,0,0,0,0|3,0,0]=4 521 B22R2.30740 COCC(O)CNCc1ccccc1Cc2ccccc2 2230a_100000756049_100010254464 [0,1,0,0,0,0|3,0,0]=4 522 B22R2.30740 COCC(O)CNCc1ccccc1Cc2ccccc2 270004a_100000756049_100009842342 [0,1,0,0,0,0|3,0,0]=4 523 B22R2.30740 COCC(O)CNCc1ccccc1Cc2ccccc2 34a_100000756049_100010254464 [0,1,0,0,0,0|3,0,0]=4 524 B22R2.30740 COCC(O)CSCc1ccccc1Cc2ccccc2 62a_100010254464_100011215053 [0,1,0,0,0,0|3,0,0]=4 525 B22R2.30740 COCC(O)CSCc1ccccc1Cc2ccccc2 62a_100011215053_100010254464 [0,1,0,0,0,0|3,0,0]=4 526 B22R2.51608 C#CCCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100010269958 [0,1,0,0,0,0|2,0,1]=4 527 B22R2.51608 CCCCCCC(=O)c1ccccc1[I+]c2ccccc2 1458a_100015188722_100000210757 [0,1,0,0,0,0|3,0,0]=4 528 B22R2.51608 CCCCCNC(=O)c1ccccc1Cc2ccccc2 11a_100000209983_100000211042 [0,1,0,0,0,0|3,0,0]=4 529 B22R2.51608 CCCCCNC(=O)c1ccccc1Cc2ccccc2 1626a_100000209983_100000211042 [0,1,0,0,0,0|3,0,0]=4 530 B22R2.51608 CCCCCNC(=O)c1ccccc1Cc2ccccc2 240690a_100000209983_100000211042 [0,1,0,0,0,0|3,0,0]=4 531 B22R2.51608 CCCCCNC(=O)c1ccccc1Cc2ccccc2 527a_100000209983_100000211042 [0,1,0,0,0,0|3,0,0]=4 532 B22R2.51608 CCCCOCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100011995733 [0,1,0,0,0,0|3,0,0]=4 533 B22R2.51608 CCCOCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100011215938 [0,1,0,0,0,0|3,0,0]=4 534 B22R2.51608 CCOCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100012232248 [0,1,0,0,0,0|3,0,0]=4 535 B22R2.51608 COCCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000755781 [0,1,0,0,0,0|2,0,0]=3 536 B22R2.51608 COCCCCC(=O)c1ccccc1Oc2ccccc2 1458a_100000185727_100000755781 [0,1,0,0,0,0|3,0,0]=4 537 B22R2.51608 COCCCCC(=O)c1ccccc1Sc2ccccc2 1458a_100000187566_100000755781 [0,1,0,0,0,0|3,0,0]=4 538 B22R2.51608 COCCCCC(=O)c1ccccc1[I+]c2ccccc2 1458a_100015188722_100000755781 [0,1,0,0,0,0|3,0,0]=4 539 B22R2.51608 COCCCNC(=O)c1ccccc1Cc2ccccc2 1626a_100150723488_100000211042 [0,1,0,0,0,0|3,0,0]=4 540 B22R2.51608 COCCCNC(=O)c1ccccc1Cc2ccccc2 240690a_100150723488_100000211042 [0,1,0,0,0,0|3,0,0]=4 541 B22R2.51608 COCCCNC(=O)c1ccccc1Cc2ccccc2 527a_100150723488_100000211042 [0,1,0,0,0,0|3,0,0]=4 542 B22R2.51608 CSCCCNC(=O)c1ccccc1Cc2ccccc2 11a_100000749238_100000211042 [0,1,0,0,0,0|3,0,0]=4 543 B22R2.51608 CSCCCNC(=O)c1ccccc1Cc2ccccc2 1626a_100000749238_100000211042 [0,1,0,0,0,0|3,0,0]=4 544 B22R2.51608 CSCCCNC(=O)c1ccccc1Cc2ccccc2 240690a_100000749238_100000211042 [0,1,0,0,0,0|3,0,0]=4 545 B22R2.51608 CSCCCNC(=O)c1ccccc1Cc2ccccc2 527a_100000749238_100000211042 [0,1,0,0,0,0|3,0,0]=4 546 B22R2.51608 N#CCCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000211819 [0,1,0,0,0,0|3,0,0]=4 547 B22R2.51608 O=C(CCCCCF)c1ccccc1Cc2ccccc2 1458a_100000211042_100000729378 [0,1,0,0,0,0|3,0,0]=4 548 B22R2.51608 O=C(CCCCCO)c1ccccc1Cc2ccccc2 1458a_100000211042_100000746330 [0,1,0,0,0,0|3,0,0]=4 549 B22R2.572292 COCCCCNc1cc(ccc1Oc2ccccc2)Cl 2230a_100000185534_100000730899 [0,1,0,0,0,0|3,0,0]=4 550 B22R2.572292 COCCCCNc1cc(ccc1Oc2ccccc2)Cl 34a_100000185534_100000755781 [0,1,0,0,0,0|3,0,0]=4 551 B22R2.572292 COCCCCNc1cc(ccc1Oc2ccccc2)Cl 7a_100000185534_100000730899 [0,1,0,0,0,0|3,0,0]=4 552 B22R2.572292 COCCCCNc1cc(ccc1Oc2ccccc2)F 2230a_100000750978_100000730899 [0,1,0,0,0,0|3,0,0]=4 553 B22R2.572292 COCCCCNc1cc(ccc1Oc2ccccc2)F 34a_100000750978_100000755781 [0,1,0,0,0,0|3,0,0]=4 554 B22R2.572292 COCCCCNc1cc(ccc1Oc2ccccc2)F 7a_100000750978_100000730899 [0,1,0,0,0,0|3,0,0]=4 555 B22R2.572334 C#CCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100010269958 [0,1,0,0,0,0|2,0,1]=4 556 B22R2.572334 C#CCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100010269958 [0,1,0,0,0,0|2,0,1]=4 557 B22R2.572334 C#CCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100010269958 [0,1,0,0,0,0|2,0,1]=4 558 B22R2.572334 C#CCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100010269958 [0,1,0,0,0,0|1,0,2]=4 559 B22R2.572334 C#CCCCCSc1ccccc1C(N)c2ccccc2 62a_100010269958_100011211563 [0,1,0,0,0,0|1,1,1]=4 560 B22R2.572334 C#CCCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100010269958 [0,1,0,0,0,0|1,1,1]=4 561 B22R2.572334 C=CCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100011215482 [0,1,0,0,0,0|2,0,1]=4 562 B22R2.572334 C=CCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100011215482 [0,1,0,0,0,0|2,0,1]=4 563 B22R2.572334 C=CCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100011215482 [0,1,0,0,0,0|2,0,1]=4 564 B22R2.572334 C=CCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100011215482 [0,1,0,0,0,0|1,0,2]=4 565 B22R2.572334 CCCCCCNc1ccccc1C(=O)c2ccccc2 27a_100000210581_100000198044 [0,1,0,0,0,0|2,0,1]=4 566 B22R2.572334 CCCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000210314 [0,1,0,0,0,0|2,0,0]=3 567 B22R2.572334 CCCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000210314 [0,1,0,0,0,0|2,0,0]=3 568 B22R2.572334 CCCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000210314 [0,1,0,0,0,0|2,0,0]=3 569 B22R2.572334 CCCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000210314 [0,1,0,0,0,0|1,0,1]=3 570 B22R2.572334 CCCCOCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100011995733 [0,1,0,0,0,0|3,0,0]=4 571 B22R2.572334 CCCCOCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100011995733 [0,1,0,0,0,0|3,0,0]=4 572 B22R2.572334 CCCCOCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100011995733 [0,1,0,0,0,0|2,1,0]=4 573 B22R2.572334 CCCCOCSc1ccccc1C(N)c2ccccc2 62a_100011995733_100011211563 [0,1,0,0,0,0|2,1,0]=4 574 B22R2.572334 CCCOCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100011215938 [0,1,0,0,0,0|3,0,0]=4 575 B22R2.572334 CCCOCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100011215938 [0,1,0,0,0,0|3,0,0]=4 576 B22R2.572334 CCCOCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100011215938 [0,1,0,0,0,0|3,0,0]=4 577 B22R2.572334 CCCOCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100011215938 [0,1,0,0,0,0|2,0,1]=4 578 B22R2.572334 CCCOCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100011215938 [0,1,0,0,0,0|2,1,0]=4 579 B22R2.572334 CCCOCCSc1ccccc1C(N)c2ccccc2 62a_100011215938_100011211563 [0,1,0,0,0,0|2,1,0]=4 580 B22R2.572334 CCOCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100012232248 [0,1,0,0,0,0|3,0,0]=4 581 B22R2.572334 CCOCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100012232248 [0,1,0,0,0,0|3,0,0]=4 582 B22R2.572334 CCOCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100012232248 [0,1,0,0,0,0|3,0,0]=4 583 B22R2.572334 CCOCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100012232248 [0,1,0,0,0,0|2,0,1]=4 584 B22R2.572334 CCOCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100012232248 [0,1,0,0,0,0|2,1,0]=4 585 B22R2.572334 CCOCCCSc1ccccc1C(N)c2ccccc2 62a_100012232248_100011211563 [0,1,0,0,0,0|2,1,0]=4 586 B22R2.572334 COCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000730899 [0,1,0,0,0,0|2,0,0]=3 587 B22R2.572334 COCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000755781 [0,1,0,0,0,0|2,0,0]=3 588 B22R2.572334 COCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000730899 [0,1,0,0,0,0|2,0,0]=3 589 B22R2.572334 COCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000730899 [0,1,0,0,0,0|1,0,1]=3 590 B22R2.572334 COCCCCSc1ccccc1C(=O)c2ccccc2 62a_100000198044_100000730899 [0,1,0,0,0,0|1,1,1]=4 591 B22R2.572334 COCCCCSc1ccccc1C(N)c2ccccc2 62a_100000730899_100011211563 [0,1,0,0,0,0|1,1,0]=3 592 B22R2.572334 COCCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000730899 [0,1,0,0,0,0|1,1,0]=3 593 B22R2.572334 COCCOCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000231047 [0,1,0,0,0,0|3,0,0]=4 594 B22R2.572334 COCCOCSc1ccccc1C(N)c2ccccc2 62a_100000231047_100011211563 [0,1,0,0,0,0|2,1,0]=4 595 B22R2.572334 COCCOCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000231047 [0,1,0,0,0,0|2,1,0]=4 596 B22R2.572334 N#CCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000211819 [0,1,0,0,0,0|3,0,0]=4 597 B22R2.572334 N#CCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000211819 [0,1,0,0,0,0|3,0,0]=4 598 B22R2.572334 N#CCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000211819 [0,1,0,0,0,0|2,0,1]=4 599 B22R2.572334 N#CCCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000211819 [0,1,0,0,0,0|2,1,0]=4 600 B22R2.572334 N#CCCCCSc1ccccc1C(N)c2ccccc2 62a_100011219923_100011211563 [0,1,0,0,0,0|2,1,0]=4 601 B22R2.572334 NC(c1ccccc1)c2ccccc2SCCCCC=O 62a_100000139335_100011211563 [0,1,0,0,0,0|2,1,0]=4 602 B22R2.572334 NC(c1ccccc1)c2ccccc2SCCCCC=O 62a_100011211563_100000139335 [0,1,0,0,0,0|2,1,0]=4 603 B22R2.572334 NC(c1ccccc1)c2ccccc2SCCCCCF 62a_100000729378_100011211563 [0,1,0,0,0,0|2,1,0]=4 604 B22R2.572334 NC(c1ccccc1)c2ccccc2SCCCCCF 62a_100011211563_100000729378 [0,1,0,0,0,0|2,1,0]=4 605 B22R2.572334 NC(c1ccccc1)c2ccccc2SCCCCCO 62a_100000746330_100011211563 [0,1,0,0,0,0|2,1,0]=4 606 B22R2.572334 NC(c1ccccc1)c2ccccc2SCCCCCO 62a_100011211563_100000746330 [0,1,0,0,0,0|2,1,0]=4 607 B22R2.572334 O=C(c1ccccc1)c2ccccc2OCCCCCF 7a_100011215220_100000729378 [0,1,0,0,0,0|2,0,1]=4 608 B22R2.572334 O=C(c1ccccc1)c2ccccc2OCCCCCO 7a_100011215220_100000746330 [0,1,0,0,0,0|2,0,1]=4 609 B22R2.572334 O=CCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000139335 [0,1,0,0,0,0|3,0,0]=4 610 B22R2.572334 O=CCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000139335 [0,1,0,0,0,0|3,0,0]=4 611 B22R2.572334 O=CCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000139335 [0,1,0,0,0,0|2,0,1]=4 612 B22R2.572334 OC(c1ccccc1)c2ccccc2NCCCCCF 2230a_100000246470_100000729378 [0,1,0,0,0,0|3,0,0]=4 613 B22R2.572334 OC(c1ccccc1)c2ccccc2NCCCCCF 34a_100000246470_100000729378 [0,1,0,0,0,0|3,0,0]=4 614 B22R2.572334 OC(c1ccccc1)c2ccccc2NCCCCCF 7a_100000246470_100000729378 [0,1,0,0,0,0|3,0,0]=4 615 B22R2.572334 OCCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000746330 [0,1,0,0,0,0|3,0,0]=4 616 B22R2.572334 OCCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000746330 [0,1,0,0,0,0|3,0,0]=4 617 B22R2.572334 OCCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000746330 [0,1,0,0,0,0|3,0,0]=4 618 B22R2.572670 COCCCCNc1ccccc1Oc2ccccc2C 2230a_100000188859_100000730899 [0,1,0,0,0,0|3,0,0]=4 619 B22R2.572670 COCCCCNc1ccccc1Oc2ccccc2C 34a_100000188859_100000755781 [0,1,0,0,0,0|3,0,0]=4 620 B22R2.572670 COCCCCNc1ccccc1Oc2ccccc2C 7a_100000188859_100000730899 [0,1,0,0,0,0|3,0,0]=4 621 B22R3.3729 C1=CC(CCC1)Nc2ccccc2Cc3ccccc3 2230a_100000211252_100000751183 [0,0,0,1,0,0|2,0,1]=4 622 B22R3.3729 C1=CC(CCC1)Nc2ccccc2Cc3ccccc3 7a_100000211252_100000751183 [0,0,0,1,0,0|2,0,1]=4 623 B22R3.3729 C1=CC(CCC1)Oc2ccccc2Cc3ccccc3 7a_100000211249_100000751183 [0,0,0,1,0,0|1,0,1]=3 624 B22R3.3729 C1=CC(CCC1)Oc2ccccc2Oc3ccccc3 7a_100000074787_100000751183 [0,0,0,1,0,0|2,0,1]=4 625 B22R3.3729 c1ccc(c(c1)OC2CCCCC2)Sc3ccncc3 62a_100000728582_200011235867 [0,0,0,1,0,0|3,0,0]=4 626 B22R3.3729 c1ccc(c(c1)OC2CCCCC2)Sc3ccncc3 62a_200011235867_100000728582 [0,0,0,1,0,0|3,0,0]=4 627 B22R3.3729 c1ccc(cc1)Cc2ccccc2CN3CCCOC3 2230a_100000131196_100010254464 [0,0,0,1,0,0|3,0,0]=4 628 B22R3.3729 c1ccc(cc1)Cc2ccccc2CN3CCCOC3 269982a_100000131196_100010254464 [0,0,0,1,0,0|3,0,0]=4 629 B22R3.3729 c1ccc(cc1)Cc2ccccc2CN3CCCOC3 26a_100000131196_100000211249 [0,0,0,1,0,0|3,0,0]=4 630 B22R3.3729 c1ccc(cc1)Cc2ccccc2CN3CCCOC3 270004a_100000131196_100009842342 [0,0,0,1,0,0|3,0,0]=4 631 B22R3.3729 c1ccc(cc1)Cc2ccccc2CN3CCCOC3 34a_100000131196_100010254464 [0,0,0,1,0,0|3,0,0]=4 632 B22R3.3729 c1ccc(cc1)Cc2ccccc2NC3CCCOC3 34a_100000211252_100000693364 [0,0,0,1,0,0|2,0,0]=3 633 B22R3.3729 c1ccc(cc1)Cc2ccccc2NC3CCCOC3 7a_100000211252_100000693364 [0,0,0,1,0,0|2,0,0]=3 634 B22R3.3729 c1ccc(cc1)Cc2ccccc2NC3CCOCC3 7a_100000211252_100000686592 [0,0,0,1,0,0|3,0,0]=4 635 B22R3.3729 c1ccc(cc1)Cc2ccccc2NC3CCSCC3 34a_100000211252_100000069128 [0,0,0,1,0,0|3,0,0]=4 636 B22R3.3729 c1ccc(cc1)Cc2ccccc2NC3CCSCC3 7a_100000211252_100011500858 [0,0,0,1,0,0|3,0,0]=4 637 B22R3.3729 c1ccc(cc1)Cc2ccccc2OC3CCCCC3 34a_100000211249_100000210327 [0,0,0,1,0,0|1,0,0]=2 638 B22R3.3729 c1ccc(cc1)Cc2ccccc2OC3CCCCC3 7a_100000211249_100000210327 [0,0,0,1,0,0|1,0,0]=2 639 B22R3.3729 c1ccc(cc1)Cc2ccccc2OC3CCCOC3 34a_100000211249_100000693364 [0,0,0,1,0,0|1,0,0]=2 640 B22R3.3729 c1ccc(cc1)Cc2ccccc2OC3CCCOC3 7a_100000211249_100000693364 [0,0,0,1,0,0|1,0,0]=2 641 B22R3.3729 c1ccc(cc1)Cc2ccccc2OC3CCOCC3 7a_100000211249_100000686592 [0,0,0,1,0,0|2,0,0]=3 642 B22R3.3729 c1ccc(cc1)Cc2ccccc2OC3CCSCC3 34a_100000211249_100000069128 [0,0,0,1,0,0|2,0,0]=3 643 B22R3.3729 c1ccc(cc1)Cc2ccccc2OC3CCSCC3 7a_100000211249_100011500858 [0,0,0,1,0,0|2,0,0]=3 644 B22R3.3729 c1ccc(cc1)Cc2ccccc2SC3CCCOC3 62a_200011216382_100000693364 [0,0,0,1,0,0|1,1,0]=3 645 B22R3.3729 c1ccc(cc1)Cc2ccccc2SC3CCOCC3 62a_200011216382_100011324220 [0,0,0,1,0,0|2,1,0]=4 646 B22R3.3729 c1ccc(cc1)Oc2ccccc2NC3CCCOC3 34a_100000182328_100000693364 [0,0,0,1,0,0|3,0,0]=4 647 B22R3.3729 c1ccc(cc1)Oc2ccccc2OC3CCCOC3 34a_100000074787_100000693364 [0,0,0,1,0,0|2,0,0]=3 648 B22R3.3729 c1ccc(cc1)Oc2ccccc2OC3CCCOC3 7a_100000074787_100000693364 [0,0,0,1,0,0|2,0,0]=3 649 B22R3.3729 c1ccc(cc1)Oc2ccccc2OC3CCOCC3 7a_100000074787_100000686592 [0,0,0,1,0,0|3,0,0]=4 650 B22R3.3729 c1ccc(cc1)Oc2ccccc2OC3CCSCC3 34a_100000074787_100000069128 [0,0,0,1,0,0|3,0,0]=4 651 B22R3.3729 c1ccc(cc1)Oc2ccccc2OC3CCSCC3 7a_100000074787_100011500858 [0,0,0,1,0,0|3,0,0]=4 652 B22R3.3729 c1ccc(nc1)Oc2ccccc2OC3CCCCC3 34a_100000748224_100000210327 [0,0,0,1,0,0|3,0,0]=4 653 B22R3.3729 c1ccc(nc1)Oc2ccccc2OC3CCCOC3 34a_100000748224_100000693364 [0,0,0,1,0,0|3,0,0]=4 654 B22R3.3729 c1ccc(nc1)Sc2ccccc2OC3CCCCC3 62a_100011216584_200011235867 [0,0,0,1,0,0|3,0,0]=4 655 B22R3.3729 c1ccc(nc1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100011216584 [0,0,0,1,0,0|3,0,0]=4 656 B22R3.3729 c1cncc(c1)Sc2ccccc2OC3CCCCC3 62a_100000210063_200011235867 [0,0,0,1,0,0|3,0,0]=4 657 B22R3.3729 c1cncc(c1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000210063 [0,0,0,1,0,0|3,0,0]=4 658 B22R3.3730 c1ccc(cc1)Cc2ccccc2CNC3CCCC3 207a_100000211070_100009842342 [0,0,0,1,0,0|3,0,0]=4 659 B22R3.3730 c1ccc(cc1)Cc2ccccc2CNC3CCCC3 2230a_100000211070_100010254464 [0,0,0,1,0,0|3,0,0]=4 660 B22R3.3730 c1ccc(cc1)Cc2ccccc2CNC3CCCC3 270004a_100000211070_100009842342 [0,0,0,1,0,0|3,0,0]=4 661 B22R3.3730 c1ccc(cc1)Cc2ccccc2CNC3CCCC3 34a_100000211070_100010254464 [0,0,0,1,0,0|3,0,0]=4 662 B22R3.3730 c1ccc(cc1)Cc2ccccc2CN[C@@H]3CCOC3 207a_200015188469_100009842342 [0,0,0,1,0,0|3,0,0]=4 663 B22R3.3730 c1ccc(cc1)Cc2ccccc2CN[C@@H]3CCOC3 2230a_200015188469_100010254464 [0,0,0,1,0,0|3,0,0]=4 664 B22R3.3730 c1ccc(cc1)Cc2ccccc2CN[C@@H]3CCOC3 270004a_200015188469_100009842342 [0,0,0,1,0,0|3,0,0]=4 665 B22R3.3730 c1ccc(cc1)Cc2ccccc2CN[C@H]3CCOC3 207a_100015188467_100009842342 [0,0,0,1,0,0|3,0,0]=4 666 B22R3.3730 c1ccc(cc1)Cc2ccccc2CN[C@H]3CCOC3 2230a_100015188467_100010254464 [0,0,0,1,0,0|3,0,0]=4 667 B22R3.3730 c1ccc(cc1)Cc2ccccc2CN[C@H]3CCOC3 270004a_100015188467_100009842342 [0,0,0,1,0,0|3,0,0]=4 668 B22R3.3730 c1ccc(cc1)Cc2ccccc2CN[C@H]3CCOC3 34a_100015188467_100010254464 [0,0,0,1,0,0|3,0,0]=4 669 B22R3.3730 c1ccc(cc1)Cc2ccccc2COC3CCCC3 34a_100000210269_100010254464 [0,0,0,1,0,0|3,0,0]=4 670 B22R3.3730 c1ccc(cc1)Cc2ccccc2COC3CCCC3 7a_100000210269_100010254464 [0,0,0,1,0,0|3,0,0]=4 671 B22R3.3730 c1ccc(cc1)Cc2ccccc2COC3CCSC3 7a_100011232664_100010254464 [0,0,0,1,0,0|3,0,0]=4 672 B22R3.3730 c1ccc(cc1)Cc2ccccc2CO[C@H]3CCOC3 34a_100000717292_100010254464 [0,0,0,1,0,0|3,0,0]=4 673 B22R3.3730 c1ccc(cc1)Cc2ccccc2CSC3CCOC3 62a_100010254464_100000690089 [0,0,0,1,0,0|3,0,0]=4 674 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCCC3 2230a_100000211252_100000740388 [0,0,0,1,0,0|2,0,0]=3 675 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCCC3 34a_100000211252_100000740388 [0,0,0,1,0,0|2,0,0]=3 676 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCCC3 7a_100000211252_100000740388 [0,0,0,1,0,0|2,0,0]=3 677 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCCO3 2230a_100000211252_100000203698 [0,0,0,1,0,0|3,0,0]=4 678 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCCO3 7a_100000211252_100000203698 [0,0,0,1,0,0|3,0,0]=4 679 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCOC3 2230a_100000211252_100000702531 [0,0,0,1,0,0|2,0,0]=3 680 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCOC3 34a_100000211252_100011261433 [0,0,0,1,0,0|2,0,0]=3 681 B22R3.3730 c1ccc(cc1)Cc2ccccc2NCC3CCOC3 7a_100000211252_100000702531 [0,0,0,1,0,0|2,0,0]=3 682 B22R3.3730 c1ccc(cc1)Cc2ccccc2OCC3CCCC3 34a_100000211249_100000740388 [0,0,0,1,0,0|1,0,0]=2 683 B22R3.3730 c1ccc(cc1)Cc2ccccc2OCC3CCCC3 7a_100000211249_100000740388 [0,0,0,1,0,0|1,0,0]=2 684 B22R3.3730 c1ccc(cc1)Cc2ccccc2OCC3CCCO3 7a_100000211249_100000203698 [0,0,0,1,0,0|2,0,0]=3 685 B22R3.3730 c1ccc(cc1)Cc2ccccc2OCC3CCOC3 34a_100000211249_100011261433 [0,0,0,1,0,0|1,0,0]=2 686 B22R3.3730 c1ccc(cc1)Cc2ccccc2OCC3CCOC3 7a_100000211249_100000702531 [0,0,0,1,0,0|1,0,0]=2 687 B22R3.3730 c1ccc(cc1)Cc2ccccc2OCC3OCCO3 34a_100000211249_100000755774 [0,0,0,1,0,0|3,0,0]=4 688 B22R3.3730 c1ccc(cc1)Cc2ccccc2OCC3OCCO3 7a_100000211249_100000755774 [0,0,0,1,0,0|3,0,0]=4 689 B22R3.3730 c1ccc(cc1)Cc2ccccc2SCC3CCCO3 62a_100000203698_200011216382 [0,0,0,1,0,0|2,1,0]=4 690 B22R3.3730 c1ccc(cc1)Cc2ccccc2SCC3CCCO3 62a_200011216382_100000203698 [0,0,0,1,0,0|2,1,0]=4 691 B22R3.3730 c1ccc(cc1)Cc2ccccc2SCC3CCOC3 62a_100000702531_200011216382 [0,0,0,1,0,0|1,1,0]=3 692 B22R3.3730 c1ccc(cc1)Cc2ccccc2SCC3CCOC3 62a_200011216382_100000702531 [0,0,0,1,0,0|1,1,0]=3 693 B22R3.3730 c1ccc(cc1)Nc2ccccc2SCC3CCOC3 62a_100000702531_100009815782 [0,0,0,1,0,0|2,1,0]=4 694 B22R3.3730 c1ccc(cc1)Oc2ccccc2NCC3CCOC3 2230a_100000182328_100000702531 [0,0,0,1,0,0|3,0,0]=4 695 B22R3.3730 c1ccc(cc1)Oc2ccccc2NCC3CCOC3 34a_100000182328_100011261433 [0,0,0,1,0,0|3,0,0]=4 696 B22R3.3730 c1ccc(cc1)Oc2ccccc2OCC3CCCO3 7a_100000074787_100000203698 [0,0,0,1,0,0|3,0,0]=4 697 B22R3.3730 c1ccc(cc1)Oc2ccccc2OCC3CCOC3 34a_100000074787_100011261433 [0,0,0,1,0,0|2,0,0]=3 698 B22R3.3730 c1ccc(cc1)Oc2ccccc2OCC3CCOC3 7a_100000074787_100000702531 [0,0,0,1,0,0|2,0,0]=3 699 B22R3.3730 c1ccc(cc1)Oc2ccccc2SCC3CCOC3 62a_100000702531_100000049502 [0,0,0,1,0,0|2,1,0]=4 700 B22R3.3730 c1ccc(cc1)Sc2ccccc2NCC3CCOC3 2230a_100000210917_100000702531 [0,0,0,1,0,0|3,0,0]=4 701 B22R3.3730 c1ccc(nc1)Oc2ccccc2OCC3CCCC3 34a_100000748224_100000740388 [0,0,0,1,0,0|3,0,0]=4 702 B22R3.3730 c1ccc(nc1)Oc2ccccc2OCC3CCOC3 34a_100000748224_100011261433 [0,0,0,1,0,0|3,0,0]=4 703 B22R3.11940 CCCCN1CCc2ccccc2[C@@H]1c3ccccc3 2230a_100010197342_100000210211 [0,0,0,1,0,0|3,0,0]=4 704 B22R3.11940 CCCCN1CCc2ccccc2[C@@H]1c3ccccc3 269982a_100010197342_100000210211 [0,0,0,1,0,0|3,0,0]=4 705 B22R3.11940 CCCCN1CCc2ccccc2[C@@H]1c3ccccc3 34a_100010197342_100000210210 [0,0,0,1,0,0|3,0,0]=4 706 B22R3.11940 COCCN1CCc2ccccc2[C@@H]1c3ccccc3 2230a_100010197342_100011201679 [0,0,0,1,0,0|3,0,0]=4 707 B22R3.11940 COCCN1CCc2ccccc2[C@@H]1c3ccccc3 269982a_100010197342_100000233755 [0,0,0,1,0,0|3,0,0]=4 708 B22R3.11940 COCCN1CCc2ccccc2[C@@H]1c3ccccc3 34a_100010197342_100011201679 [0,0,0,1,0,0|3,0,0]=4 709 B22R3.11940 CSCCN1CCc2ccccc2[C@@H]1c3ccccc3 2230a_100010197342_100000751147 [0,0,0,1,0,0|3,0,0]=4 710 B22R3.11940 CSCCN1CCc2ccccc2[C@@H]1c3ccccc3 269982a_100010197342_100000212216 [0,0,0,1,0,0|3,0,0]=4 711 B22R3.11940 CSCCN1CCc2ccccc2[C@@H]1c3ccccc3 34a_100010197342_100000212216 [0,0,0,1,0,0|3,0,0]=4 712 B22R3.29276 C[C@@H]1CCCN1Cc2ccccc2Cc3ccccc3 2230a_100015189458_100010254464 [0,0,0,1,0,0|3,0,0]=4 713 B22R3.29276 C[C@@H]1CCCN1Cc2ccccc2Cc3ccccc3 269982a_100015189458_100010254464 [0,0,0,1,0,0|3,0,0]=4 714 B22R3.29276 C[C@@H]1CCCN1Cc2ccccc2Cc3ccccc3 26a_100015189458_100000211249 [0,0,0,1,0,0|3,0,0]=4 715 B22R3.29276 C[C@@H]1CCCN1Cc2ccccc2Cc3ccccc3 270004a_100015189458_100009842342 [0,0,0,1,0,0|3,0,0]=4 716 B22R3.29276 C[C@@H]1CCCN1Cc2ccccc2Cc3ccccc3 34a_100015189458_100010254464 [0,0,0,1,0,0|3,0,0]=4 717 B22R3.29276 C[C@H]1CCCN1Cc2ccccc2Cc3ccccc3 2230a_100020605311_100010254464 [0,0,0,1,0,0|3,0,0]=4 718 B22R3.29276 C[C@H]1CCCN1Cc2ccccc2Cc3ccccc3 269982a_100020605311_100010254464 [0,0,0,1,0,0|3,0,0]=4 719 B22R3.29276 C[C@H]1CCCN1Cc2ccccc2Cc3ccccc3 26a_100020605311_100000211249 [0,0,0,1,0,0|3,0,0]=4 720 B22R3.29276 C[C@H]1CCCN1Cc2ccccc2Cc3ccccc3 270004a_100020605311_100009842342 [0,0,0,1,0,0|3,0,0]=4 721 B22R3.29276 O=C1CCCC1Nc2ccccc2Cc3ccccc3 2230a_100000211252_100000211823 [0,0,0,1,0,0|3,0,0]=4 722 B22R3.29276 O=C1CCCC1Nc2ccccc2Cc3ccccc3 34a_100000211252_100000709159 [0,0,0,1,0,0|3,0,0]=4 723 B22R3.29276 O=C1CCCC1Nc2ccccc2Cc3ccccc3 7a_100000211252_100000211823 [0,0,0,1,0,0|3,0,0]=4 724 B22R3.29276 O=C1CCCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_100000709159 [0,0,0,1,0,0|2,0,0]=3 725 B22R3.29276 O=C1CCCC1Oc2ccccc2Cc3ccccc3 7a_100000211249_100000211823 [0,0,0,1,0,0|2,0,0]=3 726 B22R3.29276 O=C1CCCC1Oc2ccccc2Oc3ccccc3 34a_100000074787_100000709159 [0,0,0,1,0,0|3,0,0]=4 727 B22R3.29276 O=C1CCCC1Oc2ccccc2Oc3ccccc3 7a_100000074787_100000211823 [0,0,0,1,0,0|3,0,0]=4 728 B22R3.29276 O=C1CCCC1Sc2ccccc2Cc3ccccc3 62a_100000211823_200011216382 [0,0,0,1,0,0|2,1,0]=4 729 B22R3.29276 O=C1CCCC1Sc2ccccc2Cc3ccccc3 62a_200011216382_100000211823 [0,0,0,1,0,0|2,1,0]=4 730 B22R3.29276 O=C1OCCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_100000211211 [0,0,0,1,0,0|3,0,0]=4 731 B22R3.29276 O=C1OCCC1Oc2ccccc2Cc3ccccc3 7a_100000211249_100000211211 [0,0,0,1,0,0|3,0,0]=4 732 B22R3.29276 OC1COCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_200000725654 [0,0,0,1,0,0|3,0,0]=4 733 B22R3.29276 OC1COCC1Oc2ccccc2Cc3ccccc3 7a_100000211249_200000725654 [0,0,0,1,0,0|3,0,0]=4 734 B22R3.29276 O[C@@H]1CCC[C@H]1Sc2ccccc2Cc3ccccc3 62a_200011216382_200016002552 [0,0,0,1,0,0|2,1,0]=4 735 B22R3.29276 O[C@@H]1CCC[C@H]1Sc2ccccc2Cc3ccccc3 62a_200016002552_200011216382 [0,0,0,1,0,0|2,1,0]=4 736 B22R3.29999 CC1CC1COCc2ccccc2Cc3ccccc3 34a_100000744939_100010254464 [0,0,0,1,0,0|3,0,0]=4 737 B22R3.29999 CC1CC1COCc2ccccc2Cc3ccccc3 7a_100000744939_100010254464 [0,0,0,1,0,0|3,0,0]=4 738 B22R3.74329 C(#CC1CC1)COc2ccccc2Cc3ccccc3 34a_100000211249_100009895102 [0,0,0,1,0,0|1,0,2]=4 739 B22R3.74329 C(#CC1CC1)COc2ccccc2Cc3ccccc3 7a_100000211249_100009895102 [0,0,0,1,0,0|1,0,2]=4 740 B22R3.74329 c1ccc(cc1)Cc2ccccc2CNCCC3CC3 207a_100000764129_100009842342 [0,0,0,1,0,0|3,0,0]=4 741 B22R3.74329 c1ccc(cc1)Cc2ccccc2CNCCC3CC3 270004a_100000764129_100009842342 [0,0,0,1,0,0|3,0,0]=4 742 B22R3.74329 c1ccc(cc1)Cc2ccccc2CNCCC3CC3 34a_100000764129_100010254464 [0,0,0,1,0,0|3,0,0]=4 743 B22R3.74329 c1ccc(cc1)Cc2ccccc2COCCC3CC3 34a_100000754188_100010254464 [0,0,0,1,0,0|3,0,0]=4 744 B22R3.74329 c1ccc(cc1)Cc2ccccc2COCCC3CC3 7a_100000754188_100010254464 [0,0,0,1,0,0|3,0,0]=4 745 B22R3.74329 c1ccc(cc1)Cc2ccccc2COCC[C@@H]3CO3 34a_100009820653_100010254464 [0,0,0,1,0,0|3,0,0]=4 746 B22R3.74329 c1ccc(cc1)Cc2ccccc2CSCCC3CO3 62a_100000732470_100010254464 [0,0,0,1,0,0|3,0,0]=4 747 B22R3.74329 c1ccc(cc1)Cc2ccccc2CSCCC3CO3 62a_100010254464_100000732470 [0,0,0,1,0,0|3,0,0]=4 748 B22R3.74329 c1ccc(cc1)Cc2ccccc2NCCCC3CO3 2230a_100000211252_100000733510 [0,0,0,1,0,0|2,0,0]=3 749 B22R3.74329 c1ccc(cc1)Cc2ccccc2NCCCC3CO3 34a_100000211252_100000733510 [0,0,0,1,0,0|2,0,0]=3 750 B22R3.74329 c1ccc(cc1)Cc2ccccc2NCCCC3CO3 7a_100000211252_100000733510 [0,0,0,1,0,0|2,0,0]=3 751 B22R3.74329 c1ccc(cc1)Cc2ccccc2OCCCC3CO3 34a_100000211249_100000733510 [0,0,0,1,0,0|1,0,0]=2 752 B22R3.74329 c1ccc(cc1)Cc2ccccc2OCCCC3CO3 7a_100000211249_100000733510 [0,0,0,1,0,0|1,0,0]=2 753 B22R3.74329 c1ccc(cc1)Cc2ccccc2SCCCC3CO3 62a_100000733510_200011216382 [0,0,0,1,0,0|1,1,0]=3 754 B22R3.74329 c1ccc(cc1)Cc2ccccc2SCCCC3CO3 62a_200011216382_100000733510 [0,0,0,1,0,0|1,1,0]=3 755 B22R3.74329 c1ccc(cc1)Nc2ccccc2SCCCC3CO3 62a_100000733510_100009815782 [0,0,0,1,0,0|2,1,0]=4 756 B22R3.74329 c1ccc(cc1)Oc2ccccc2NCCCC3CO3 2230a_100000182328_100000733510 [0,0,0,1,0,0|3,0,0]=4 757 B22R3.74329 c1ccc(cc1)Oc2ccccc2NCCCC3CO3 34a_100000182328_100000733510 [0,0,0,1,0,0|3,0,0]=4 758 B22R3.74329 c1ccc(cc1)Oc2ccccc2OCCCC3CO3 34a_100000074787_100000733510 [0,0,0,1,0,0|2,0,0]=3 759 B22R3.74329 c1ccc(cc1)Oc2ccccc2OCCCC3CO3 7a_100000074787_100000733510 [0,0,0,1,0,0|2,0,0]=3 760 B22R3.74329 c1ccc(cc1)Oc2ccccc2SCCCC3CO3 62a_100000733510_100000049502 [0,0,0,1,0,0|2,1,0]=4 761 B22R3.74329 c1ccc(cc1)Sc2ccccc2NCCCC3CO3 2230a_100000210917_100000733510 [0,0,0,1,0,0|3,0,0]=4 762 B22R3.74329 c1ccc(nc1)Oc2ccccc2OCCCC3CO3 34a_100000748224_100000733510 [0,0,0,1,0,0|3,0,0]=4 763 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3CCC3 207a_100000738700_100009842342 [0,0,0,1,0,0|3,0,0]=4 764 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3CCC3 2230a_100000738700_100010254464 [0,0,0,1,0,0|3,0,0]=4 765 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3CCC3 270004a_100000738700_100009842342 [0,0,0,1,0,0|3,0,0]=4 766 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3CCC3 34a_100000738700_100010254464 [0,0,0,1,0,0|3,0,0]=4 767 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3COC3 207a_100015281925_100009842342 [0,0,0,1,0,0|3,0,0]=4 768 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3COC3 2230a_100015281925_100010254464 [0,0,0,1,0,0|3,0,0]=4 769 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3COC3 270004a_100015281925_100009842342 [0,0,0,1,0,0|3,0,0]=4 770 B22R3.74330 c1ccc(cc1)Cc2ccccc2CNCC3COC3 34a_100015281925_100010254464 [0,0,0,1,0,0|3,0,0]=4 771 B22R3.74330 c1ccc(cc1)Cc2ccccc2COCC3CCC3 34a_100000760304_100010254464 [0,0,0,1,0,0|3,0,0]=4 772 B22R3.74330 c1ccc(cc1)Cc2ccccc2COCC3CNC3 34a_100016987283_100010254464 [0,0,0,1,0,0|2,0,0]=3 773 B22R3.74330 c1ccc(cc1)Cc2ccccc2COCC3COC3 34a_100000060846_100010254464 [0,0,0,1,0,0|3,0,0]=4 774 B22R3.74330 c1ccc(cc1)Cc2ccccc2CSCC3COC3 62a_100010254464_100010264016 [0,0,0,1,0,0|3,0,0]=4 775 B22R3.74330 c1ccc(cc1)Cc2ccccc2CSCC3COC3 62a_100010264016_100010254464 [0,0,0,1,0,0|3,0,0]=4 776 B22R3.98916 C#CCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100010269958 [0,0,0,1,0,0|2,0,1]=4 777 B22R3.98916 C#CCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100010269958 [0,0,0,1,0,0|2,0,1]=4 778 B22R3.98916 CCCCOCOc1cccc2c1oc3c2cccc3 34a_100010256078_100011995733 [0,0,0,1,0,0|3,0,0]=4 779 B22R3.98916 CCCOCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100011215938 [0,0,0,1,0,0|3,0,0]=4 780 B22R3.98916 CCCOCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100011215938 [0,0,0,1,0,0|3,0,0]=4 781 B22R3.98916 CCOCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100012232248 [0,0,0,1,0,0|3,0,0]=4 782 B22R3.98916 CCOCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100012232248 [0,0,0,1,0,0|3,0,0]=4 783 B22R3.98916 COCCCCNc1cccc2c1oc3c2cccc3 34a_200000102501_100000755781 [0,0,0,1,0,0|3,0,0]=4 784 B22R3.98916 COCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000755781 [0,0,0,1,0,0|2,0,0]=3 785 B22R3.98916 COCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000730899 [0,0,0,1,0,0|2,0,0]=3 786 B22R3.98916 N#CCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000211819 [0,0,0,1,0,0|3,0,0]=4 787 B22R3.98916 O=CCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000139335 [0,0,0,1,0,0|3,0,0]=4 788 B22R3.98916 OCCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000746330 [0,0,0,1,0,0|3,0,0]=4 789 B22R3.98916 OCCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000746330 [0,0,0,1,0,0|3,0,0]=4 790 B22R2.26331 C#CCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100010269958 [0,0,0,0,0,1|2,0,1]=4 791 B22R2.26331 C#CCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100010269958 [0,0,0,0,0,1|2,0,1]=4 792 B22R2.26331 C#CCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100010269958 [0,0,0,0,0,1|2,0,1]=4 793 B22R2.26331 C#CCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100010269958 [0,0,0,0,0,1|2,0,1]=4 794 B22R2.26331 C#CCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100010269958 [0,0,0,0,0,1|2,0,1]=4 795 B22R2.26331 C#CCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100010269958 [0,0,0,0,0,1|1,0,1]=3 796 B22R2.26331 C#CCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100010269958 [0,0,0,0,0,1|1,0,1]=3 797 B22R2.26331 C#CCOCCOc1ccccc1OCc2ccccc2 34a_100000187230_100010402529 [0,0,0,0,0,1|2,0,1]=4 798 B22R2.26331 C#CCOCCOc1ccccc1OCc2ccccc2 7a_100000187230_100010402529 [0,0,0,0,0,1|2,0,1]=4 799 B22R2.26331 C=CCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100011215482 [0,0,0,0,0,1|2,0,1]=4 800 B22R2.26331 CCCCCCNc1ccccc1CCc2ccccn2 34a_200000071813_100000210314 [0,0,0,0,0,1|3,0,0]=4 801 B22R2.26331 CCCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000210314 [0,0,0,0,0,1|2,0,0]=3 802 B22R2.26331 CCCCCNCc1ccccc1COc2ccccc2 34a_100000737599_100000718602 [0,0,0,0,0,1|3,0,0]=4 803 B22R2.26331 CCCCCNCc1ccccc1OCc2ccccc2 207a_100000209983_100000151772 [0,0,0,0,0,1|3,0,0]=4 804 B22R2.26331 CCCCCNCc1ccccc1OCc2ccccc2 270004a_100000209983_100000151772 [0,0,0,0,0,1|3,0,0]=4 805 B22R2.26331 CCCCCNCc1ccccc1OCc2ccccc2 34a_100000741334_100000718602 [0,0,0,0,0,1|3,0,0]=4 806 B22R2.26331 CCCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100000718602 [0,0,0,0,0,1|3,0,0]=4 807 B22R2.26331 CCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000210326 [0,0,0,0,0,1|3,0,0]=4 808 B22R2.26331 CCCCOCCc1ccccc1OCc2ccccc2 34a_100000721452_100000210210 [0,0,0,0,0,1|3,0,0]=4 809 B22R2.26331 CCCCOCCc1ccccc1OCc2ccccc2 7a_100000721452_100000210211 [0,0,0,0,0,1|3,0,0]=4 810 B22R2.26331 CCCCOCNc1ccccc1COc2ccccc2 2230a_100000742786_100011995733 [0,0,0,0,0,1|3,0,0]=4 811 B22R2.26331 CCCCOCNc1ccccc1COc2ccccc2 34a_100000742786_100011995733 [0,0,0,0,0,1|3,0,0]=4 812 B22R2.26331 CCCCOCNc1ccccc1OCc2ccccc2 34a_100011193923_100011995733 [0,0,0,0,0,1|3,0,0]=4 813 B22R2.26331 CCCCOCOc1ccccc1CNc2cccnc2 34a_200000712809_100011995733 [0,0,0,0,0,1|3,0,0]=4 814 B22R2.26331 CCCCOCOc1ccccc1OCc2ccccc2 34a_100000187230_100011995733 [0,0,0,0,0,1|2,0,0]=3 815 B22R2.26331 CCCOCCNc1ccccc1COc2ccccc2 2230a_100000742786_100011215938 [0,0,0,0,0,1|3,0,0]=4 816 B22R2.26331 CCCOCCNc1ccccc1COc2ccccc2 34a_100000742786_100011215938 [0,0,0,0,0,1|3,0,0]=4 817 B22R2.26331 CCCOCCNc1ccccc1COc2ccccc2 7a_100000742786_100011215938 [0,0,0,0,0,1|3,0,0]=4 818 B22R2.26331 CCCOCCNc1ccccc1OCc2ccccc2 34a_100011193923_100011215938 [0,0,0,0,0,1|3,0,0]=4 819 B22R2.26331 CCCOCCNc1ccccc1SCc2ccccc2 34a_100000198535_100011215938 [0,0,0,0,0,1|3,0,0]=4 820 B22R2.26331 CCCOCCNc1ccccc1SCc2ccccc2 7a_100000198535_100011215938 [0,0,0,0,0,1|3,0,0]=4 821 B22R2.26331 CCCOCCOc1ccccc1CNc2cccnc2 34a_200000712809_100011215938 [0,0,0,0,0,1|3,0,0]=4 822 B22R2.26331 CCCOCCOc1ccccc1OCc2ccccc2 34a_100000187230_100011215938 [0,0,0,0,0,1|2,0,0]=3 823 B22R2.26331 CCCOCCOc1ccccc1OCc2ccccc2 7a_100000187230_100011215938 [0,0,0,0,0,1|2,0,0]=3 824 B22R2.26331 CCCOCCSc1ccccc1OCc2ccccc2 62a_100000151716_100011215938 [0,0,0,0,0,1|2,1,0]=4 825 B22R2.26331 CCCOCCSc1ccccc1OCc2ccccc2 62a_100011215938_100000151716 [0,0,0,0,0,1|2,1,0]=4 826 B22R2.26331 CCOCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100012232248 [0,0,0,0,0,1|3,0,0]=4 827 B22R2.26331 CCOCCCNc1ccccc1COc2ccccc2 34a_100000742786_100012232248 [0,0,0,0,0,1|3,0,0]=4 828 B22R2.26331 CCOCCCNc1ccccc1COc2ccccc2 7a_100000742786_100012232248 [0,0,0,0,0,1|3,0,0]=4 829 B22R2.26331 CCOCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100012232248 [0,0,0,0,0,1|3,0,0]=4 830 B22R2.26331 CCOCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100012232248 [0,0,0,0,0,1|3,0,0]=4 831 B22R2.26331 CCOCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100012232248 [0,0,0,0,0,1|3,0,0]=4 832 B22R2.26331 CCOCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100012232248 [0,0,0,0,0,1|3,0,0]=4 833 B22R2.26331 CCOCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100012232248 [0,0,0,0,0,1|2,0,0]=3 834 B22R2.26331 CCOCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100012232248 [0,0,0,0,0,1|2,0,0]=3 835 B22R2.26331 CCOCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100012232248 [0,0,0,0,0,1|2,1,0]=4 836 B22R2.26331 CCOCCCSc1ccccc1OCc2ccccc2 62a_100012232248_100000151716 [0,0,0,0,0,1|2,1,0]=4 837 B22R2.26331 COCCCCNc1ccccc1C#Cc2ccccc2 2230a_100000044502_100000730899 [0,0,0,0,0,1|2,0,1]=4 838 B22R2.26331 COCCCCNc1ccccc1C#Cc2ccccc2 34a_100000044502_100000755781 [0,0,0,0,0,1|2,0,1]=4 839 B22R2.26331 COCCCCNc1ccccc1CCc2ccccn2 34a_200000071813_100000755781 [0,0,0,0,0,1|3,0,0]=4 840 B22R2.26331 COCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000730899 [0,0,0,0,0,1|2,0,0]=3 841 B22R2.26331 COCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000755781 [0,0,0,0,0,1|2,0,0]=3 842 B22R2.26331 COCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000730899 [0,0,0,0,0,1|2,0,0]=3 843 B22R2.26331 COCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000755781 [0,0,0,0,0,1|2,0,0]=3 844 B22R2.26331 COCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000755781 [0,0,0,0,0,1|2,0,0]=3 845 B22R2.26331 COCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000730899 [0,0,0,0,0,1|2,0,0]=3 846 B22R2.26331 COCCCCOc1ccccc1C=Cc2ccccn2 34a_200021180701_100000755781 [0,0,0,0,0,1|2,0,1]=4 847 B22R2.26331 COCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000755781 [0,0,0,0,0,1|2,0,0]=3 848 B22R2.26331 COCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000755781 [0,0,0,0,0,1|1,0,0]=2 849 B22R2.26331 COCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000730899 [0,0,0,0,0,1|1,0,0]=2 850 B22R2.26331 COCCCCSc1ccccc1C#Cc2ccccc2 62a_100000730899_100010200916 [0,0,0,0,0,1|1,1,1]=4 851 B22R2.26331 COCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000730899 [0,0,0,0,0,1|1,1,0]=3 852 B22R2.26331 COCCCCSc1ccccc1OCc2ccccc2 62a_100000730899_100000151716 [0,0,0,0,0,1|1,1,0]=3 853 B22R2.26331 COCCCCSc1cccnc1OCc2ccccc2 62a_100000730899_200011465151 [0,0,0,0,0,1|2,1,0]=4 854 B22R2.26331 COCCCCSc1cccnc1OCc2ccccc2 62a_200011465151_100000730899 [0,0,0,0,0,1|2,1,0]=4 855 B22R2.26331 COCCCCSc1ncccc1OCc2ccccc2 62a_100000730899_100011501402 [0,0,0,0,0,1|2,1,0]=4 856 B22R2.26331 COCCCCSc1ncccc1OCc2ccccc2 62a_100011501402_100000730899 [0,0,0,0,0,1|2,1,0]=4 857 B22R2.26331 COCCCNCc1ccccc1COc2ccccc2 34a_100000737599_100000740836 [0,0,0,0,0,1|3,0,0]=4 858 B22R2.26331 COCCCNCc1ccccc1OCc2ccccc2 207a_100150723488_100000151772 [0,0,0,0,0,1|3,0,0]=4 859 B22R2.26331 COCCCNCc1ccccc1OCc2ccccc2 270004a_100150723488_100000151772 [0,0,0,0,0,1|3,0,0]=4 860 B22R2.26331 COCCCNCc1ccccc1OCc2ccccc2 34a_100000741334_100000740836 [0,0,0,0,0,1|3,0,0]=4 861 B22R2.26331 COCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100000740836 [0,0,0,0,0,1|3,0,0]=4 862 B22R2.26331 COCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000740836 [0,0,0,0,0,1|3,0,0]=4 863 B22R2.26331 COCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100000740836 [0,0,0,0,0,1|3,0,0]=4 864 B22R2.26331 COCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000740836 [0,0,0,0,0,1|3,0,0]=4 865 B22R2.26331 COCCOCCc1ccccc1OCc2ccccc2 34a_100000721452_100011201679 [0,0,0,0,0,1|3,0,0]=4 866 B22R2.26331 COCCOCCc1ccccc1OCc2ccccc2 7a_100000721452_100000233755 [0,0,0,0,0,1|3,0,0]=4 867 B22R2.26331 COCCOCNc1ccccc1COc2ccccc2 2230a_100000742786_100000231047 [0,0,0,0,0,1|3,0,0]=4 868 B22R2.26331 COCCOCSc1ccccc1OCc2ccccc2 62a_100000151716_100000231047 [0,0,0,0,0,1|2,1,0]=4 869 B22R2.26331 COCCOCSc1ccccc1OCc2ccccc2 62a_100000231047_100000151716 [0,0,0,0,0,1|2,1,0]=4 870 B22R2.26331 CSCCCNCc1ccccc1OCc2ccccc2 207a_100000749238_100000151772 [0,0,0,0,0,1|3,0,0]=4 871 B22R2.26331 CSCCCNCc1ccccc1OCc2ccccc2 270004a_100000749238_100000151772 [0,0,0,0,0,1|3,0,0]=4 872 B22R2.26331 CSCCOCCc1ccccc1OCc2ccccc2 34a_100000721452_100000212216 [0,0,0,0,0,1|3,0,0]=4 873 B22R2.26331 CSCCOCCc1ccccc1OCc2ccccc2 7a_100000721452_100000212216 [0,0,0,0,0,1|3,0,0]=4 874 B22R2.26331 FCCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000729378 [0,0,0,0,0,1|3,0,0]=4 875 B22R2.26331 FCCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000729378 [0,0,0,0,0,1|3,0,0]=4 876 B22R2.26331 FCCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000729378 [0,0,0,0,0,1|3,0,0]=4 877 B22R2.26331 FCCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000729378 [0,0,0,0,0,1|3,0,0]=4 878 B22R2.26331 FCCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000729378 [0,0,0,0,0,1|3,0,0]=4 879 B22R2.26331 FCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000729378 [0,0,0,0,0,1|2,0,0]=3 880 B22R2.26331 FCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000729378 [0,0,0,0,0,1|2,0,0]=3 881 B22R2.26331 N#CCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000211819 [0,0,0,0,0,1|3,0,0]=4 882 B22R2.26331 N#CCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000211819 [0,0,0,0,0,1|3,0,0]=4 883 B22R2.26331 N#CCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000211819 [0,0,0,0,0,1|2,0,0]=3 884 B22R2.26331 N#CCOCCOc1ccccc1OCc2ccccc2 7a_100000187230_200000047693 [0,0,0,0,0,1|3,0,0]=4 885 B22R2.26331 O=CCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000139335 [0,0,0,0,0,1|3,0,0]=4 886 B22R2.26331 O=CCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000139335 [0,0,0,0,0,1|3,0,0]=4 887 B22R2.26331 O=CCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000139335 [0,0,0,0,0,1|3,0,0]=4 888 B22R2.26331 O=CCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000139335 [0,0,0,0,0,1|2,0,0]=3 889 B22R2.26331 O=CCCCCSc1ccccc1OCc2ccccc2 62a_100000139335_100000151716 [0,0,0,0,0,1|2,1,0]=4 890 B22R2.26331 O=CCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000139335 [0,0,0,0,0,1|2,1,0]=4 891 B22R2.26331 OCCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000746330 [0,0,0,0,0,1|3,0,0]=4 892 B22R2.26331 OCCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000746330 [0,0,0,0,0,1|3,0,0]=4 893 B22R2.26331 OCCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000746330 [0,0,0,0,0,1|3,0,0]=4 894 B22R2.26331 OCCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000746330 [0,0,0,0,0,1|3,0,0]=4 895 B22R2.26331 OCCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000746330 [0,0,0,0,0,1|3,0,0]=4 896 B22R2.26331 OCCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000746330 [0,0,0,0,0,1|3,0,0]=4 897 B22R2.26331 OCCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000746330 [0,0,0,0,0,1|3,0,0]=4 898 B22R2.26331 OCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000746330 [0,0,0,0,0,1|2,0,0]=3 899 B22R2.26331 OCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000746330 [0,0,0,0,0,1|2,0,0]=3 900 B22R2.26331 OCCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000746330 [0,0,0,0,0,1|2,1,0]=4 901 B22R2.26331 OCCCCCSc1ccccc1OCc2ccccc2 62a_100000746330_100000151716 [0,0,0,0,0,1|2,1,0]=4 902 B22R2.26331 OCCOCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000692535 [0,0,0,0,0,1|3,0,0]=4 903 B22R2.26331 OCCOCCOc1ccccc1OCc2ccccc2 7a_100000187230_100011215305 [0,0,0,0,0,1|3,0,0]=4 904 B21R2.1935 CCCCCC(=O)c1ccccc1[I+]c2ccccc2 1458a_100015188722_100000210326 [1,1,0,0,0,0|2,0,0]=4 905 B21R2.1935 CCCCNC(=O)c1ccccc1Cc2ccccc2 11a_100000102301_100000211042 [1,1,0,0,0,0|2,0,0]=4 906 B21R2.1935 CCCCNC(=O)c1ccccc1Cc2ccccc2 1626a_100000102301_100000211042 [1,1,0,0,0,0|2,0,0]=4 907 B21R2.1935 CCCCNC(=O)c1ccccc1Cc2ccccc2 240690a_100000102301_100000211042 [1,1,0,0,0,0|2,0,0]=4 908 B21R2.1935 CCCCNC(=O)c1ccccc1Cc2ccccc2 527a_100000102301_100000211042 [1,1,0,0,0,0|2,0,0]=4 909 B21R2.1935 CCOCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100011215890 [1,1,0,0,0,0|2,0,0]=4 910 B21R2.1935 CCSCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000757381 [1,1,0,0,0,0|2,0,0]=4 911 B21R2.1935 COCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000740836 [1,1,0,0,0,0|1,0,1]=4 912 B21R2.1935 O=C(CCCCF)c1ccccc1Cc2ccccc2 1458a_100000211042_100000729493 [1,1,0,0,0,0|2,0,0]=4 913 B21R2.1935 O=C(CCCCO)c1ccccc1Cc2ccccc2 1458a_100000211042_100000210776 [1,1,0,0,0,0|2,0,0]=4 914 B21R2.7570 C=C(c1ccccc1)c2ccccc2OCCCNC 271570a_100000068269_100015186278 [1,1,0,0,0,0|0,0,1]=3 915 B21R2.7570 CCCCC=Cc1ccccc1C(N)c2ccccc2 271570a_100016275911_100011211563 [1,1,0,0,0,0|1,0,1]=4 916 B21R2.7570 CCCCCNc1ccccc1C(=O)c2ccccc2 27a_100000209983_100000198044 [1,1,0,0,0,0|1,0,1]=4 917 B21R2.7570 CCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000210326 [1,1,0,0,0,0|1,0,0]=3 918 B21R2.7570 CCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000718602 [1,1,0,0,0,0|1,0,0]=3 919 B21R2.7570 CCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000210326 [1,1,0,0,0,0|1,0,0]=3 920 B21R2.7570 CCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000210326 [1,1,0,0,0,0|0,0,1]=3 921 B21R2.7570 CCOCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100011215890 [1,1,0,0,0,0|2,0,0]=4 922 B21R2.7570 CCOCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000210147 [1,1,0,0,0,0|2,0,0]=4 923 B21R2.7570 CCOCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100011215890 [1,1,0,0,0,0|2,0,0]=4 924 B21R2.7570 CCOCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100011215890 [1,1,0,0,0,0|1,0,1]=4 925 B21R2.7570 CCOCCSc1ccccc1C(N)c2ccccc2 62a_100000210147_100011211563 [1,1,0,0,0,0|1,1,0]=4 926 B21R2.7570 CCOCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100011215890 [1,1,0,0,0,0|1,1,0]=4 927 B21R2.7570 CCSCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000757381 [1,1,0,0,0,0|2,0,0]=4 928 B21R2.7570 CCSCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000757381 [1,1,0,0,0,0|2,0,0]=4 929 B21R2.7570 CCSCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000757381 [1,1,0,0,0,0|2,0,0]=4 930 B21R2.7570 CCSCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000757381 [1,1,0,0,0,0|1,0,1]=4 931 B21R2.7570 CCSCCSc1ccccc1C(N)c2ccccc2 62a_100000757381_100011211563 [1,1,0,0,0,0|1,1,0]=4 932 B21R2.7570 CCSCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000757381 [1,1,0,0,0,0|1,1,0]=4 933 B21R2.7570 COCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000740836 [1,1,0,0,0,0|2,0,0]=4 934 B21R2.7570 COCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000740836 [1,1,0,0,0,0|2,0,0]=4 935 B21R2.7570 COCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000740836 [1,1,0,0,0,0|2,0,0]=4 936 B21R2.7570 COCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000740836 [1,1,0,0,0,0|1,0,1]=4 937 B21R2.7570 COCCCSc1ccccc1C(N)c2ccccc2 62a_100000709357_100011211563 [1,1,0,0,0,0|1,1,0]=4 938 B21R2.7570 COCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000709357 [1,1,0,0,0,0|1,1,0]=4 939 B21R2.7570 NC(c1ccccc1)c2ccccc2SCCCCF 62a_100000729493_100011211563 [1,1,0,0,0,0|1,1,0]=4 940 B21R2.7570 NC(c1ccccc1)c2ccccc2SCCCCF 62a_100011211563_100000729493 [1,1,0,0,0,0|1,1,0]=4 941 B21R2.7570 NC(c1ccccc1)c2ccccc2SCCCCO 62a_100000210776_100011211563 [1,1,0,0,0,0|1,1,0]=4 942 B21R2.7570 NC(c1ccccc1)c2ccccc2SCCCCO 62a_100011211563_100000210776 [1,1,0,0,0,0|1,1,0]=4 943 B21R2.7570 O=C(c1ccccc1)c2ccccc2OCCCCF 7a_100011215220_100000729493 [1,1,0,0,0,0|1,0,1]=4 944 B21R2.7570 O=C(c1ccccc1)c2ccccc2OCCCCO 7a_100011215220_100000210776 [1,1,0,0,0,0|1,0,1]=4 945 B21R2.7570 OC(c1ccccc1)c2ccccc2NCCCCF 2230a_100000246470_100000729493 [1,1,0,0,0,0|2,0,0]=4 946 B21R2.7570 OC(c1ccccc1)c2ccccc2NCCCCF 34a_100000246470_100000729493 [1,1,0,0,0,0|2,0,0]=4 947 B21R2.7570 OC(c1ccccc1)c2ccccc2NCCCCF 7a_100000246470_100000729493 [1,1,0,0,0,0|2,0,0]=4 948 B21R2.7570 OCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000210776 [1,1,0,0,0,0|2,0,0]=4 949 B21R2.7570 OCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100011216708 [1,1,0,0,0,0|2,0,0]=4 950 B21R2.7570 OCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000210776 [1,1,0,0,0,0|2,0,0]=4 951 B21R2.12800 C=C(C)CCOCc1ccccc1Cc2ccccc2 34a_100000764851_100010254464 [1,1,0,0,0,0|2,0,0]=4 952 B21R2.12800 CC(=O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000685027 [1,1,0,0,0,0|1,0,1]=4 953 B21R2.12800 CC(=O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215641 [1,1,0,0,0,0|1,0,1]=4 954 B21R2.12800 CC(=O)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000685027 [1,1,0,0,0,0|0,0,1]=3 955 B21R2.12800 CC(=O)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011215641 [1,1,0,0,0,0|0,0,1]=3 956 B21R2.12800 CC(=O)CCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000685027 [1,1,0,0,0,0|1,0,1]=4 957 B21R2.12800 CC(=O)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011215641 [1,1,0,0,0,0|1,0,1]=4 958 B21R2.12800 CC(=O)CCCSc1ccccc1Cc2ccccc2 62a_100011215641_200011216382 [1,1,0,0,0,0|0,1,1]=4 959 B21R2.12800 CC(=O)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011215641 [1,1,0,0,0,0|0,1,1]=4 960 B21R2.12800 CC(=O)CCOCc1ccccc1Cc2ccccc2 34a_100000759926_100010254464 [1,1,0,0,0,0|2,0,0]=4 961 B21R2.12800 CC(=O)CCOCc1ccccc1Cc2ccccc2 7a_100000759926_100010254464 [1,1,0,0,0,0|2,0,0]=4 962 B21R2.12800 CC(=O)CCSCc1ccccc1Cc2ccccc2 62a_100000053229_100010254464 [1,1,0,0,0,0|2,0,0]=4 963 B21R2.12800 CC(=O)CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000053229 [1,1,0,0,0,0|2,0,0]=4 964 B21R2.12800 CC(=O)NCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000189650 [1,1,0,0,0,0|1,0,1]=4 965 B21R2.12800 CC(=O)OCCOc1ccccc1Cc2ccccc2 34a_100000211249_100009814007 [1,1,0,0,0,0|1,0,1]=4 966 B21R2.12800 CC(=O)OCCOc1ccccc1Cc2ccccc2 7a_100000211249_100009814007 [1,1,0,0,0,0|1,0,1]=4 967 B21R2.12800 CC(Br)CCOCc1ccccc1Cc2ccccc2 34a_100009893172_100010254464 [1,1,0,0,0,0|2,0,0]=4 968 B21R2.12800 CC(C)CCCOc1ccccc1Oc2ccccn2 34a_100000748224_100011214892 [1,1,0,0,0,0|2,0,0]=4 969 B21R2.12800 CC(C)CCNCc1ccccc1Cc2ccccc2 207a_100000210545_100009842342 [1,1,0,0,0,0|2,0,0]=4 970 B21R2.12800 CC(C)CCNCc1ccccc1Cc2ccccc2 26a_100000210545_100000211249 [1,1,0,0,0,0|2,0,0]=4 971 B21R2.12800 CC(C)CCNCc1ccccc1Cc2ccccc2 270004a_100000210545_100009842342 [1,1,0,0,0,0|2,0,0]=4 972 B21R2.12800 CC(C)CCOCc1ccccc1Cc2ccccc2 34a_100000210254_100010254464 [1,1,0,0,0,0|2,0,0]=4 973 B21R2.12800 CC(C)CCOCc1ccccc1Cc2ccccc2 7a_100000210254_100010254464 [1,1,0,0,0,0|2,0,0]=4 974 B21R2.12800 CC(C)OCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000211751 [1,1,0,0,0,0|2,0,0]=4 975 B21R2.12800 CC(C)OCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000211751 [1,1,0,0,0,0|2,0,0]=4 976 B21R2.12800 CC(C)OCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000211751 [1,1,0,0,0,0|2,0,0]=4 977 B21R2.12800 CC(C)OCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000211751 [1,1,0,0,0,0|1,0,0]=3 978 B21R2.12800 CC(C)OCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000211751 [1,1,0,0,0,0|1,0,0]=3 979 B21R2.12800 CC(C)OCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000211751 [1,1,0,0,0,0|2,0,0]=4 980 B21R2.12800 CC(C)OCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000211751 [1,1,0,0,0,0|2,0,0]=4 981 B21R2.12800 CC(C)OCCSc1ccccc1Cc2ccccc2 62a_100000211751_200011216382 [1,1,0,0,0,0|1,1,0]=4 982 B21R2.12800 CC(C)OCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000211751 [1,1,0,0,0,0|1,1,0]=4 983 B21R2.12800 CC(C)SCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000730970 [1,1,0,0,0,0|2,0,0]=4 984 B21R2.12800 CC(C)SCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000730970 [1,1,0,0,0,0|2,0,0]=4 985 B21R2.12800 CC(C)SCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000730970 [1,1,0,0,0,0|2,0,0]=4 986 B21R2.12800 CC(C)SCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000730970 [1,1,0,0,0,0|1,0,0]=3 987 B21R2.12800 CC(C)SCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000730970 [1,1,0,0,0,0|1,0,0]=3 988 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_200000718107 [1,1,0,0,0,0|1,0,0]=3 989 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_200000718107 [1,1,0,0,0,0|1,0,0]=3 990 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_200000718107 [1,1,0,0,0,0|1,0,0]=3 991 B21R2.12800 CC(O)CCCNc1ccccc1Oc2ccccc2 2230a_100000182328_200000718107 [1,1,0,0,0,0|2,0,0]=4 992 B21R2.12800 CC(O)CCCNc1ccccc1Oc2ccccc2 34a_100000182328_200000718107 [1,1,0,0,0,0|2,0,0]=4 993 B21R2.12800 CC(O)CCCNc1ccccc1Sc2ccccc2 2230a_100000210917_200000718107 [1,1,0,0,0,0|2,0,0]=4 994 B21R2.12800 CC(O)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_200000718107 [1,1,0,0,0,0|0,0,0]=2 995 B21R2.12800 CC(O)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_200000718107 [1,1,0,0,0,0|0,0,0]=2 996 B21R2.12800 CC(O)CCCOc1ccccc1Oc2ccccc2 34a_100000074787_200000718107 [1,1,0,0,0,0|1,0,0]=3 997 B21R2.12800 CC(O)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_200000718107 [1,1,0,0,0,0|1,0,0]=3 998 B21R2.12800 CC(O)CCCOc1ccccc1Oc2ccccn2 34a_100000748224_200000718107 [1,1,0,0,0,0|2,0,0]=4 999 B21R2.12800 CC(O)CCCSc1ccccc1Cc2ccccc2 62a_200000718107_200011216382 [1,1,0,0,0,0|0,1,0]=3 1000 B21R2.12800 CC(O)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_200000718107 [1,1,0,0,0,0|0,1,0]=3 1001 B21R2.12800 CC(O)CCCSc1ccccc1Nc2ccccc2 62a_200000718107_100009815782 [1,1,0,0,0,0|1,1,0]=4 1002 B21R2.12800 CC(O)CCCSc1ccccc1Oc2ccccc2 62a_200000718107_100000049502 [1,1,0,0,0,0|1,1,0]=4 1003 B21R2.12800 CC(O)CCNCc1ccccc1Cc2ccccc2 207a_200000755665_100009842342 [1,1,0,0,0,0|2,0,0]=4 1004 B21R2.12800 CC(O)CCNCc1ccccc1Cc2ccccc2 2230a_200000755665_100010254464 [1,1,0,0,0,0|2,0,0]=4 1005 B21R2.12800 CC(O)CCNCc1ccccc1Cc2ccccc2 270004a_200000755665_100009842342 [1,1,0,0,0,0|2,0,0]=4 1006 B21R2.12800 CC(O)CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100012276601 [1,1,0,0,0,0|2,0,0]=4 1007 B21R2.12800 CC(O)CCSCc1ccccc1Cc2ccccc2 62a_100012276601_100010254464 [1,1,0,0,0,0|2,0,0]=4 1008 B21R2.12800 CN(C)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000757444 [1,1,0,0,0,0|1,0,0]=3 1009 B21R2.12800 CN(C)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000757444 [1,1,0,0,0,0|0,0,0]=2 1010 B21R2.12800 CN(C)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000757444 [1,1,0,0,0,0|1,0,0]=3 1011 B21R2.12800 CN(C)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000757444 [1,1,0,0,0,0|0,1,0]=3 1012 B21R2.12800 CN(C)CCNCc1ccccc1Cc2ccccc2 207a_100000210585_100009842342 [1,1,0,0,0,0|1,0,0]=3 1013 B21R2.12800 CN(C)CCNCc1ccccc1Cc2ccccc2 270004a_100000210585_100009842342 [1,1,0,0,0,0|1,0,0]=3 1014 B21R2.12800 CN(C)CCNCc1ccccc1Oc2ccccc2 207a_100000210585_100011234122 [1,1,0,0,0,0|2,0,0]=4 1015 B21R2.12800 CN(C)CCNCc1ccccc1Oc2ccccc2 270004a_100000210585_100011234122 [1,1,0,0,0,0|2,0,0]=4 1016 B21R2.12800 CN(C)CCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000755713 [1,1,0,0,0,0|2,0,0]=4 1017 B21R2.12800 CN(C)CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000755713 [1,1,0,0,0,0|1,0,0]=3 1018 B21R2.12800 CN(C)CCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000755713 [1,1,0,0,0,0|2,0,0]=4 1019 B21R2.12800 C[C@@H](N)CCOCc1ccccc1Cc2ccccc2 34a_100000706166_100010254464 [1,1,0,0,0,0|2,0,0]=4 1020 B21R2.12800 NC(=O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100102525003 [1,1,0,0,0,0|1,0,1]=4 1021 B21R2.12800 NC(=O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100102525003 [1,1,0,0,0,0|1,0,1]=4 1022 B21R2.12800 NC(=O)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100102525003 [1,1,0,0,0,0|0,0,1]=3 1023 B21R2.12800 NC(=O)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100102525003 [1,1,0,0,0,0|0,0,1]=3 1024 B21R2.12800 NC(=O)CCCOc1ccccc1Oc2ccccc2 34a_100000074787_100102525003 [1,1,0,0,0,0|1,0,1]=4 1025 B21R2.12800 NC(=O)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100102525003 [1,1,0,0,0,0|1,0,1]=4 1026 B21R2.12800 NC(=O)CCCSc1ccccc1Cc2ccccc2 62a_100102525003_200011216382 [1,1,0,0,0,0|0,1,1]=4 1027 B21R2.12800 NC(=O)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100102525003 [1,1,0,0,0,0|0,1,1]=4 1028 B21R2.12800 NC(=O)NCCOc1ccccc1Cc2ccccc2 7a_100000211249_200000034859 [1,1,0,0,0,0|1,0,1]=4 1029 B21R2.12800 NC(=O)OCCOc1ccccc1Cc2ccccc2 34a_100000211249_200011214921 [1,1,0,0,0,0|1,0,1]=4 1030 B21R2.12800 NC(=O)OCCOc1ccccc1Cc2ccccc2 7a_100000211249_200011214921 [1,1,0,0,0,0|1,0,1]=4 1031 B21R2.14086 CNCCCOc1ccccc1Sc2cc(=O)cc[nH]2 62a_100009817434_100015186278 [1,1,0,0,0,0|2,0,0]=4 1032 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)C 62a_100000750283_100015186278 [1,1,0,0,0,0|2,0,0]=4 1033 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)C 62a_100015186278_100000750283 [1,1,0,0,0,0|2,0,0]=4 1034 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)Cl 62a_100010167805_100015186278 [1,1,0,0,0,0|2,0,0]=4 1035 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)Cl 62a_100015186278_100010167805 [1,1,0,0,0,0|2,0,0]=4 1036 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)F 62a_100000764206_100015186278 [1,1,0,0,0,0|2,0,0]=4 1037 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)F 62a_100015186278_100000764206 [1,1,0,0,0,0|2,0,0]=4 1038 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)N 62a_100009814236_100015186278 [1,1,0,0,0,0|2,0,0]=4 1039 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)N 62a_100015186278_100009814236 [1,1,0,0,0,0|2,0,0]=4 1040 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)O 62a_100015186278_100000762945 [1,1,0,0,0,0|2,0,0]=4 1041 B21R2.14086 CNCCCOc1ccccc1Sc2cc[nH]c(=O)c2 62a_100009816521_100015186278 [1,1,0,0,0,0|2,0,0]=4 1042 B21R2.14086 CNCCCOc1ccccc1Sc2cc[nH]c(=O)c2 62a_100015186278_100009816521 [1,1,0,0,0,0|2,0,0]=4 1043 B21R2.14086 CNCCCOc1ccccc1Sc2ccc[n+](c2)C 62a_100009996589_100015186278 [1,1,0,0,0,0|2,0,0]=4 1044 B21R2.14086 CNCCCOc1ccccc1Sc2ccc[n+](c2)C 62a_100015186278_100009996589 [1,1,0,0,0,0|2,0,0]=4 1045 B21R2.14086 CNCCCOc1ccccc1Sc2ccc[n+](c2)[O-] 62a_100015186278_100009815978 [1,1,0,0,0,0|2,0,0]=4 1046 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(=O)[nH]2 62a_100015186278_100000752884 [1,1,0,0,0,0|2,0,0]=4 1047 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Br 62a_100000691529_100015186278 [1,1,0,0,0,0|1,0,0]=3 1048 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Br 62a_100015186278_100000691529 [1,1,0,0,0,0|1,0,0]=3 1049 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)C 62a_100011215228_100015186278 [1,1,0,0,0,0|1,0,0]=3 1050 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)C 62a_100015186278_100011215228 [1,1,0,0,0,0|1,0,0]=3 1051 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Cl 62a_100000699651_100015186278 [1,1,0,0,0,0|1,0,0]=3 1052 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Cl 62a_100015186278_100000699651 [1,1,0,0,0,0|1,0,0]=3 1053 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)F 62a_100000685547_100015186278 [1,1,0,0,0,0|1,0,0]=3 1054 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)F 62a_100015186278_100000685547 [1,1,0,0,0,0|1,0,0]=3 1055 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)N 62a_100000210019_100015186278 [1,1,0,0,0,0|1,0,0]=3 1056 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)N 62a_100015186278_100000210019 [1,1,0,0,0,0|1,0,0]=3 1057 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)O 62a_100015186278_100000211634 [1,1,0,0,0,0|1,0,0]=3 1058 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)[S] 62a_100015186278_114929384022 [1,1,0,0,0,0|1,0,0]=3 1059 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)[S] 62a_114929384022_100015186278 [1,1,0,0,0,0|1,0,0]=3 1060 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Br 62a_100000684672_100015186278 [1,1,0,0,0,0|2,0,0]=4 1061 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Br 62a_100015186278_100000684672 [1,1,0,0,0,0|2,0,0]=4 1062 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)C 62a_100000742759_100015186278 [1,1,0,0,0,0|2,0,0]=4 1063 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)C 62a_100015186278_100000742759 [1,1,0,0,0,0|2,0,0]=4 1064 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Cl 62a_100000051397_100015186278 [1,1,0,0,0,0|2,0,0]=4 1065 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Cl 62a_100015186278_100000051397 [1,1,0,0,0,0|2,0,0]=4 1066 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)F 62a_100009815982_100015186278 [1,1,0,0,0,0|2,0,0]=4 1067 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)F 62a_100015186278_100009815982 [1,1,0,0,0,0|2,0,0]=4 1068 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)N 62a_100000740741_100015186278 [1,1,0,0,0,0|2,0,0]=4 1069 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)N 62a_100015186278_100000740741 [1,1,0,0,0,0|2,0,0]=4 1070 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Br 62a_100009814637_100015186278 [1,1,0,0,0,0|2,0,0]=4 1071 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Br 62a_100015186278_100009814637 [1,1,0,0,0,0|2,0,0]=4 1072 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)C 62a_100000758586_100015186278 [1,1,0,0,0,0|2,0,0]=4 1073 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)C 62a_100015186278_100000758586 [1,1,0,0,0,0|2,0,0]=4 1074 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Cl 62a_100000035001_100015186278 [1,1,0,0,0,0|2,0,0]=4 1075 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Cl 62a_100015186278_100000035001 [1,1,0,0,0,0|2,0,0]=4 1076 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)F 62a_100009816116_100015186278 [1,1,0,0,0,0|2,0,0]=4 1077 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)F 62a_100015186278_100009816116 [1,1,0,0,0,0|2,0,0]=4 1078 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)N 62a_100000049665_100015186278 [1,1,0,0,0,0|2,0,0]=4 1079 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)N 62a_100015186278_100000049665 [1,1,0,0,0,0|2,0,0]=4 1080 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Br 62a_100000728054_100015186278 [1,1,0,0,0,0|2,0,0]=4 1081 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Br 62a_100015186278_100000728054 [1,1,0,0,0,0|2,0,0]=4 1082 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)C 62a_100000760492_100015186278 [1,1,0,0,0,0|2,0,0]=4 1083 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)C 62a_100015186278_100000760492 [1,1,0,0,0,0|2,0,0]=4 1084 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Cl 62a_100000049639_100015186278 [1,1,0,0,0,0|2,0,0]=4 1085 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Cl 62a_100015186278_100000049639 [1,1,0,0,0,0|2,0,0]=4 1086 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)F 62a_100000744099_100015186278 [1,1,0,0,0,0|2,0,0]=4 1087 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)F 62a_100015186278_100000744099 [1,1,0,0,0,0|2,0,0]=4 1088 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)N 62a_100000687067_100015186278 [1,1,0,0,0,0|2,0,0]=4 1089 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)N 62a_100015186278_100000687067 [1,1,0,0,0,0|2,0,0]=4 1090 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)O 62a_100000754920_100015186278 [1,1,0,0,0,0|2,0,0]=4 1091 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)O 62a_100015186278_100000754920 [1,1,0,0,0,0|2,0,0]=4 1092 B21R2.16951 CCCC(=O)CNc1ccccc1Cc2ccccc2 2230a_100000211252_100000747444 [1,1,0,0,0,0|1,0,1]=4 1093 B21R2.16951 CCCC(=O)CNc1ccccc1Cc2ccccc2 7a_100000211252_100000747444 [1,1,0,0,0,0|1,0,1]=4 1094 B21R2.16951 CCCC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000747444 [1,1,0,0,0,0|0,0,1]=3 1095 B21R2.16951 CCCC(=O)COc1ccccc1Oc2ccccc2 7a_100000074787_100000747444 [1,1,0,0,0,0|1,0,1]=4 1096 B21R2.16951 CCCC(=O)CSc1ccccc1Cc2ccccc2 62a_100000747444_200011216382 [1,1,0,0,0,0|0,1,1]=4 1097 B21R2.16951 CCCC(=O)CSc1ccccc1Cc2ccccc2 62a_200011216382_100000747444 [1,1,0,0,0,0|0,1,1]=4 1098 B21R2.16951 CCCC(C)COc1ccccc1Oc2ccccn2 34a_100000748224_100011216630 [1,1,0,0,0,0|2,0,0]=4 1099 B21R2.16951 CCCC(C)NCc1ccccc1Cc2ccccc2 207a_100000741246_100009842342 [1,1,0,0,0,0|2,0,0]=4 1100 B21R2.16951 CCCC(C)NCc1ccccc1Cc2ccccc2 2230a_100000741246_100010254464 [1,1,0,0,0,0|2,0,0]=4 1101 B21R2.16951 CCCC(C)NCc1ccccc1Cc2ccccc2 270004a_100000741246_100009842342 [1,1,0,0,0,0|2,0,0]=4 1102 B21R2.16951 CCCC(C)OCc1ccccc1Cc2ccccc2 34a_100000764384_100010254464 [1,1,0,0,0,0|2,0,0]=4 1103 B21R2.16951 CCCC(C)OCc1ccccc1Cc2ccccc2 7a_100000764384_100010254464 [1,1,0,0,0,0|2,0,0]=4 1104 B21R2.16951 CCNC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000183381 [1,1,0,0,0,0|1,0,1]=4 1105 B21R2.16951 CCNC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000183381 [1,1,0,0,0,0|1,0,1]=4 1106 B21R2.16951 CCOC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000188475 [1,1,0,0,0,0|1,0,1]=4 1107 B21R2.16951 CCOC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000188475 [1,1,0,0,0,0|1,0,1]=4 1108 B21R2.16951 COCC(C)SCc1ccccc1Cc2ccccc2 62a_100000765312_100010254464 [1,1,0,0,0,0|2,0,0]=4 1109 B21R2.16951 COCC(C)SCc1ccccc1Cc2ccccc2 62a_100010254464_100000765312 [1,1,0,0,0,0|2,0,0]=4 1110 B21R2.16951 COCC(O)CNc1ccccc1Cc2ccccc2 34a_100000211252_100011215053 [1,1,0,0,0,0|2,0,0]=4 1111 B21R2.16951 COCC(O)CNc1ccccc1Cc2ccccc2 7a_100000211252_100011215053 [1,1,0,0,0,0|2,0,0]=4 1112 B21R2.16951 COCC(O)COc1ccccc1Cc2ccccc2 34a_100000211249_100011215053 [1,1,0,0,0,0|1,0,0]=3 1113 B21R2.16951 COCC(O)COc1ccccc1Cc2ccccc2 7a_100000211249_100011215053 [1,1,0,0,0,0|1,0,0]=3 1114 B21R2.16951 COCC(O)COc1ccccc1Oc2ccccc2 34a_100000074787_100011215053 [1,1,0,0,0,0|2,0,0]=4 1115 B21R2.16951 COCC(O)COc1ccccc1Oc2ccccc2 7a_100000074787_100011215053 [1,1,0,0,0,0|2,0,0]=4 1116 B21R2.16951 COCC(O)CSc1ccccc1Cc2ccccc2 62a_100011215053_200011216382 [1,1,0,0,0,0|1,1,0]=4 1117 B21R2.16951 COCC(O)CSc1ccccc1Cc2ccccc2 62a_200011216382_100011215053 [1,1,0,0,0,0|1,1,0]=4 1118 B21R2.16951 COC[C@@H](C)NCc1ccccc1Cc2ccccc2 207a_100000764878_100009842342 [1,1,0,0,0,0|2,0,0]=4 1119 B21R2.16951 COC[C@@H](C)NCc1ccccc1Cc2ccccc2 2230a_100000764878_100010254464 [1,1,0,0,0,0|2,0,0]=4 1120 B21R2.16951 COC[C@@H](C)NCc1ccccc1Cc2ccccc2 270004a_100000764878_100009842342 [1,1,0,0,0,0|2,0,0]=4 1121 B21R2.16951 COC[C@@H](C)OCc1ccccc1Cc2ccccc2 34a_100011934205_100010254464 [1,1,0,0,0,0|2,0,0]=4 1122 B21R2.16951 N#CC[C@H](O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000001066 [1,1,0,0,0,0|0,0,2]=4 1123 B21R2.21331 CNCCCOc1ccccc1Sc2cc[n+](cc2)[O-] 62a_100015186278_100000039755 [1,1,0,0,0,0|2,0,0]=4 1124 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(=O)[nH]c2 62a_100000212171_100015186278 [1,1,0,0,0,0|2,0,0]=4 1125 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(=O)[nH]c2 62a_100015186278_100000212171 [1,1,0,0,0,0|2,0,0]=4 1126 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100015186278 [1,1,0,0,0,0|1,0,0]=3 1127 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Br 62a_100015186278_100000752885 [1,1,0,0,0,0|1,0,0]=3 1128 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)C 62a_100000186775_100015186278 [1,1,0,0,0,0|1,0,0]=3 1129 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)C 62a_100015186278_100000186775 [1,1,0,0,0,0|1,0,0]=3 1130 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_100015186278 [1,1,0,0,0,0|1,0,0]=3 1131 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Cl 62a_100015186278_100000755918 [1,1,0,0,0,0|1,0,0]=3 1132 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)F 62a_100000211213_100015186278 [1,1,0,0,0,0|1,0,0]=3 1133 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)F 62a_100015186278_100000211213 [1,1,0,0,0,0|1,0,0]=3 1134 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)N 62a_100000185761_100015186278 [1,1,0,0,0,0|1,0,0]=3 1135 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)N 62a_100015186278_100000185761 [1,1,0,0,0,0|1,0,0]=3 1136 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)O 62a_100015186278_100000185759 [1,1,0,0,0,0|1,0,0]=3 1137 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Br 62a_100000686858_100015186278 [1,1,0,0,0,0|2,0,0]=4 1138 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Br 62a_100015186278_100000686858 [1,1,0,0,0,0|2,0,0]=4 1139 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)C 62a_100011192072_100015186278 [1,1,0,0,0,0|2,0,0]=4 1140 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)C 62a_100015186278_100000754016 [1,1,0,0,0,0|2,0,0]=4 1141 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Cl 62a_100011356976_100015186278 [1,1,0,0,0,0|2,0,0]=4 1142 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Cl 62a_100015186278_100011356976 [1,1,0,0,0,0|2,0,0]=4 1143 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)F 62a_100000744514_100015186278 [1,1,0,0,0,0|2,0,0]=4 1144 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)F 62a_100015186278_100000744514 [1,1,0,0,0,0|2,0,0]=4 1145 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)N 62a_100000737798_100015186278 [1,1,0,0,0,0|2,0,0]=4 1146 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)N 62a_100015186278_100000737798 [1,1,0,0,0,0|2,0,0]=4 1147 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)O 62a_100000685995_100015186278 [1,1,0,0,0,0|2,0,0]=4 1148 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)O 62a_100015186278_100000744096 [1,1,0,0,0,0|2,0,0]=4 1149 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Br 62a_100009814638_100015186278 [1,1,0,0,0,0|2,0,0]=4 1150 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Br 62a_100015186278_100009814638 [1,1,0,0,0,0|2,0,0]=4 1151 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)C 62a_100000751577_100015186278 [1,1,0,0,0,0|2,0,0]=4 1152 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)C 62a_100015186278_100000751577 [1,1,0,0,0,0|2,0,0]=4 1153 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Cl 62a_100000034144_100015186278 [1,1,0,0,0,0|2,0,0]=4 1154 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Cl 62a_100015186278_100000034144 [1,1,0,0,0,0|2,0,0]=4 1155 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)F 62a_100000042367_100015186278 [1,1,0,0,0,0|2,0,0]=4 1156 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)F 62a_100015186278_100000042367 [1,1,0,0,0,0|2,0,0]=4 1157 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)N 62a_100000187370_100015186278 [1,1,0,0,0,0|2,0,0]=4 1158 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)N 62a_100015186278_100000187370 [1,1,0,0,0,0|2,0,0]=4 1159 B21R2.21690 C#CCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000695029 [1,1,0,0,0,0|0,0,2]=4 1160 B21R2.21690 C#CCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100011215417 [1,1,0,0,0,0|0,0,2]=4 1161 B21R2.21690 CCC#CCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100009813939 [1,1,0,0,0,0|0,0,2]=4 1162 B21R2.21690 CCC#CCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100009813939 [1,1,0,0,0,0|0,0,2]=4 1163 B21R2.21690 CCOCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000210147 [1,1,0,0,0,0|1,0,0]=3 1164 B21R2.21690 CCOCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100011215890 [1,1,0,0,0,0|1,0,0]=3 1165 B21R2.21690 COCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000740836 [1,1,0,0,0,0|1,0,0]=3 1166 B21R2.21690 COCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000740836 [1,1,0,0,0,0|1,0,0]=3 1167 B21R2.21690 N#CCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000687738 [1,1,0,0,0,0|0,0,2]=4 1168 B21R2.21690 O=CCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_200011292268 [1,1,0,0,0,0|1,0,1]=4 1169 B21R2.21690 OCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100011216708 [1,1,0,0,0,0|1,0,0]=3 1170 B21R2.21690 OCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000210776 [1,1,0,0,0,0|1,0,0]=3 1171 B21R2.23057 CC(CN)COCc1ccccc1Cc2ccccc2 34a_100000744482_100010254464 [1,1,0,0,0,0|2,0,0]=4 1172 B21R2.23057 CCC(C)CNCc1ccccc1Cc2ccccc2 207a_100020588543_100009842342 [1,1,0,0,0,0|2,0,0]=4 1173 B21R2.23057 CCC(C)CNCc1ccccc1Cc2ccccc2 2230a_100020588543_100010254464 [1,1,0,0,0,0|2,0,0]=4 1174 B21R2.23057 CCC(C)CNCc1ccccc1Cc2ccccc2 26a_100020588543_100000211249 [1,1,0,0,0,0|2,0,0]=4 1175 B21R2.23057 CCC(C)CNCc1ccccc1Cc2ccccc2 270004a_100020588543_100009842342 [1,1,0,0,0,0|2,0,0]=4 1176 B21R2.23057 CCC(O)CNCc1ccccc1Cc2ccccc2 207a_100011218483_100009842342 [1,1,0,0,0,0|2,0,0]=4 1177 B21R2.23057 CCC(O)CNCc1ccccc1Cc2ccccc2 2230a_100011218483_100010254464 [1,1,0,0,0,0|2,0,0]=4 1178 B21R2.23057 CCC(O)CNCc1ccccc1Cc2ccccc2 270004a_100011218483_100009842342 [1,1,0,0,0,0|2,0,0]=4 1179 B21R2.23057 CCC(O)CSCc1ccccc1Cc2ccccc2 62a_100010254464_100011218378 [1,1,0,0,0,0|2,0,0]=4 1180 B21R2.23057 CCC(O)CSCc1ccccc1Cc2ccccc2 62a_100011218378_100010254464 [1,1,0,0,0,0|2,0,0]=4 1181 B21R2.23057 CC[C@H](C)COCc1ccccc1Cc2ccccc2 7a_100009816381_100010254464 [1,1,0,0,0,0|2,0,0]=4 1182 B21R2.23057 CNC(=O)CCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000737683 [1,1,0,0,0,0|1,0,1]=4 1183 B21R2.23057 CNC(=O)CCNc1ccccc1Cc2ccccc2 34a_100000211252_100012179268 [1,1,0,0,0,0|1,0,1]=4 1184 B21R2.23057 CNC(=O)CCNc1ccccc1Cc2ccccc2 7a_100000211252_100000737683 [1,1,0,0,0,0|1,0,1]=4 1185 B21R2.23057 CNC(=O)CCOc1ccccc1Cc2ccccc2 34a_100000211249_100012179268 [1,1,0,0,0,0|0,0,1]=3 1186 B21R2.23057 CNC(=O)CCOc1ccccc1Cc2ccccc2 7a_100000211249_100000737683 [1,1,0,0,0,0|0,0,1]=3 1187 B21R2.23057 CNC(=O)CCOc1ccccc1Oc2ccccc2 34a_100000074787_100012179268 [1,1,0,0,0,0|1,0,1]=4 1188 B21R2.23057 CNC(=O)CCOc1ccccc1Oc2ccccc2 7a_100000074787_100000737683 [1,1,0,0,0,0|1,0,1]=4 1189 B21R2.23057 CNC(=O)CCSc1ccccc1Cc2ccccc2 62a_100000737683_200011216382 [1,1,0,0,0,0|0,1,1]=4 1190 B21R2.23057 CNC(=O)CCSc1ccccc1Cc2ccccc2 62a_200011216382_100000737683 [1,1,0,0,0,0|0,1,1]=4 1191 B21R2.23057 CNC(=O)CNCc1ccccc1Cc2ccccc2 207a_100000693194_100009842342 [1,1,0,0,0,0|1,0,1]=4 1192 B21R2.23057 CNC(=O)CNCc1ccccc1Cc2ccccc2 2230a_100000693194_100010254464 [1,1,0,0,0,0|1,0,1]=4 1193 B21R2.23057 CNC(=O)CNCc1ccccc1Cc2ccccc2 270004a_100000693194_100009842342 [1,1,0,0,0,0|1,0,1]=4 1194 B21R2.23057 CNC(=O)COCc1ccccc1Cc2ccccc2 34a_100000750040_100010254464 [1,1,0,0,0,0|1,0,1]=4 1195 B21R2.23057 CNC(=O)CSCc1ccccc1Cc2ccccc2 62a_100000183359_100010254464 [1,1,0,0,0,0|1,0,1]=4 1196 B21R2.23057 CNC(=O)CSCc1ccccc1Cc2ccccc2 62a_100010254464_100000183359 [1,1,0,0,0,0|1,0,1]=4 1197 B21R2.23057 COC(=O)CCOc1ccccc1Cc2ccccc2 34a_100000211249_100000742370 [1,1,0,0,0,0|1,0,1]=4 1198 B21R2.23057 COC(=O)CCOc1ccccc1Cc2ccccc2 7a_100000211249_100000204255 [1,1,0,0,0,0|1,0,1]=4 1199 B21R2.23057 COC(C)COCc1ccccc1Cc2ccccc2 34a_100000690652_100010254464 [1,1,0,0,0,0|2,0,0]=4 1200 B21R2.23057 CO[C@H](C)CNCc1ccccc1Cc2ccccc2 207a_100020591295_100009842342 [1,1,0,0,0,0|2,0,0]=4 1201 B21R2.23057 CO[C@H](C)CNCc1ccccc1Cc2ccccc2 2230a_100020591295_100010254464 [1,1,0,0,0,0|2,0,0]=4 1202 B21R2.23057 CO[C@H](C)CNCc1ccccc1Cc2ccccc2 270004a_100020591295_100009842342 [1,1,0,0,0,0|2,0,0]=4 1203 B21R2.23057 NC[C@@H](F)COCc1ccccc1Cc2ccccc2 34a_100015665980_100010254464 [1,1,0,0,0,0|2,0,0]=4 1204 B21R2.25774 CCCCC(=O)Cc1ccccc1Cc2ccccc2 1458a_100000210183_100010254464 [1,1,0,0,0,0|1,0,1]=4 1205 B21R2.25774 CCCCC(=O)Nc1ccccc1Cc2ccccc2 11a_100000211252_100000210183 [1,1,0,0,0,0|1,0,1]=4 1206 B21R2.25774 CCCCC(=O)Nc1ccccc1Cc2ccccc2 1626a_100000211252_100000210183 [1,1,0,0,0,0|1,0,1]=4 1207 B21R2.25774 CCCCC(=O)Nc1ccccc1Cc2ccccc2 22a_100000211252_100000210183 [1,1,0,0,0,0|1,0,1]=4 1208 B21R2.25774 CCCCC(C)Oc1ccccc1Oc2ccccn2 34a_100000748224_200011215066 [1,1,0,0,0,0|2,0,0]=4 1209 B21R2.25774 CCCCN(C)Cc1ccccc1Cc2ccccc2 2230a_100000207549_100010254464 [1,1,0,0,0,0|2,0,0]=4 1210 B21R2.25774 CCCCN(C)Cc1ccccc1Cc2ccccc2 269982a_100000207549_100010254464 [1,1,0,0,0,0|2,0,0]=4 1211 B21R2.25774 CCCCN(C)Cc1ccccc1Cc2ccccc2 26a_100000207549_100000211249 [1,1,0,0,0,0|2,0,0]=4 1212 B21R2.25774 CCCCN(C)Cc1ccccc1Cc2ccccc2 270004a_100000207549_100009842342 [1,1,0,0,0,0|2,0,0]=4 1213 B21R2.25774 COCCC(=O)Cc1ccccc1Cc2ccccc2 1458a_100000749529_100010254464 [1,1,0,0,0,0|1,0,1]=4 1214 B21R2.25774 COCCN(C)Cc1ccccc1Cc2ccccc2 2230a_100000743101_100010254464 [1,1,0,0,0,0|2,0,0]=4 1215 B21R2.25774 COCCN(C)Cc1ccccc1Cc2ccccc2 269982a_100000743101_100010254464 [1,1,0,0,0,0|2,0,0]=4 1216 B21R2.25774 COCCN(C)Cc1ccccc1Cc2ccccc2 26a_100000743101_100000211249 [1,1,0,0,0,0|2,0,0]=4 1217 B21R2.25774 COCCN(C)Cc1ccccc1Cc2ccccc2 270004a_100000743101_100009842342 [1,1,0,0,0,0|2,0,0]=4 1218 B21R2.25774 CSCCC(=O)Cc1ccccc1Cc2ccccc2 1458a_100000174002_100010254464 [1,1,0,0,0,0|1,0,1]=4 1219 B21R2.25774 CSCCN(C)Cc1ccccc1Cc2ccccc2 2230a_100000686725_100010254464 [1,1,0,0,0,0|2,0,0]=4 1220 B21R2.25774 CSCCN(C)Cc1ccccc1Cc2ccccc2 269982a_100000686725_100010254464 [1,1,0,0,0,0|2,0,0]=4 1221 B21R2.25774 CSCCN(C)Cc1ccccc1Cc2ccccc2 26a_100000686725_100000211249 [1,1,0,0,0,0|2,0,0]=4 1222 B21R2.25774 CSCCN(C)Cc1ccccc1Cc2ccccc2 270004a_100000686725_100009842342 [1,1,0,0,0,0|2,0,0]=4 1223 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=O 62a_100009998708_100015186278 [1,1,0,0,0,0|2,0,0]=4 1224 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=O 62a_100015186278_100009998708 [1,1,0,0,0,0|2,0,0]=4 1225 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=S 62a_100015186278_200012280681 [1,1,0,0,0,0|2,0,0]=4 1226 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=S 62a_200012280681_100015186278 [1,1,0,0,0,0|2,0,0]=4 1227 B21R2.273552 CNCCCOc1ccccc1Sc2cccc[n+]2C 62a_100015186278_100000212160 [1,1,0,0,0,0|2,0,0]=4 1228 B21R2.273552 CNCCCOc1ccccc1Sc2cccc[n+]2[O-] 62a_100015186278_200000042595 [1,1,0,0,0,0|2,0,0]=4 1229 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Br 62a_100000695589_100015186278 [1,1,0,0,0,0|1,0,0]=3 1230 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Br 62a_100015186278_100000695589 [1,1,0,0,0,0|1,0,0]=3 1231 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2C 62a_100000210755_100015186278 [1,1,0,0,0,0|1,0,0]=3 1232 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2C 62a_100015186278_100000210755 [1,1,0,0,0,0|1,0,0]=3 1233 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Cl 62a_100000764095_100015186278 [1,1,0,0,0,0|1,0,0]=3 1234 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Cl 62a_100015186278_100000764095 [1,1,0,0,0,0|1,0,0]=3 1235 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2F 62a_100011215700_100015186278 [1,1,0,0,0,0|1,0,0]=3 1236 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2F 62a_100015186278_100011215700 [1,1,0,0,0,0|1,0,0]=3 1237 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2N 62a_100000210017_100015186278 [1,1,0,0,0,0|1,0,0]=3 1238 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2N 62a_100015186278_100000210017 [1,1,0,0,0,0|1,0,0]=3 1239 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2O 62a_100000739446_100015186278 [1,1,0,0,0,0|1,0,0]=3 1240 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2O 62a_100015186278_100000739446 [1,1,0,0,0,0|1,0,0]=3 1241 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Br 62a_100010202626_100015186278 [1,1,0,0,0,0|2,0,0]=4 1242 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Br 62a_100015186278_100010202626 [1,1,0,0,0,0|2,0,0]=4 1243 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2C 62a_100000751574_100015186278 [1,1,0,0,0,0|2,0,0]=4 1244 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2C 62a_100015186278_100000751574 [1,1,0,0,0,0|2,0,0]=4 1245 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Cl 62a_100000036424_100015186278 [1,1,0,0,0,0|2,0,0]=4 1246 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Cl 62a_100015186278_100000036424 [1,1,0,0,0,0|2,0,0]=4 1247 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2F 62a_100009816115_100015186278 [1,1,0,0,0,0|2,0,0]=4 1248 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2F 62a_100015186278_100009816115 [1,1,0,0,0,0|2,0,0]=4 1249 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2N 62a_100000045569_100015186278 [1,1,0,0,0,0|2,0,0]=4 1250 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2N 62a_100015186278_100000045569 [1,1,0,0,0,0|2,0,0]=4 1251 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2O 62a_100000760158_100015186278 [1,1,0,0,0,0|2,0,0]=4 1252 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2O 62a_100015186278_100000760158 [1,1,0,0,0,0|2,0,0]=4 1253 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Br 62a_100000726257_100015186278 [1,1,0,0,0,0|2,0,0]=4 1254 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Br 62a_100015186278_100000726257 [1,1,0,0,0,0|2,0,0]=4 1255 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2C 62a_100000765111_100015186278 [1,1,0,0,0,0|2,0,0]=4 1256 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2C 62a_100015186278_100000765111 [1,1,0,0,0,0|2,0,0]=4 1257 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Cl 62a_100000708259_100015186278 [1,1,0,0,0,0|2,0,0]=4 1258 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Cl 62a_100015186278_100000708259 [1,1,0,0,0,0|2,0,0]=4 1259 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2F 62a_100000047030_100015186278 [1,1,0,0,0,0|2,0,0]=4 1260 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2F 62a_100015186278_100000047030 [1,1,0,0,0,0|2,0,0]=4 1261 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2N 62a_100000756074_100015186278 [1,1,0,0,0,0|2,0,0]=4 1262 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2N 62a_100015186278_100000756074 [1,1,0,0,0,0|2,0,0]=4 1263 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2O 62a_100009817591_100015186278 [1,1,0,0,0,0|2,0,0]=4 1264 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2O 62a_100015186278_100009817591 [1,1,0,0,0,0|2,0,0]=4 1265 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Br 62a_100010138639_100015186278 [1,1,0,0,0,0|2,0,0]=4 1266 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Br 62a_100015186278_100010138639 [1,1,0,0,0,0|2,0,0]=4 1267 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2C 62a_100000761580_100015186278 [1,1,0,0,0,0|2,0,0]=4 1268 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2C 62a_100015186278_100000761580 [1,1,0,0,0,0|2,0,0]=4 1269 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Cl 62a_100009995489_100015186278 [1,1,0,0,0,0|2,0,0]=4 1270 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Cl 62a_100015186278_100009995489 [1,1,0,0,0,0|2,0,0]=4 1271 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2F 62a_100009820683_100015186278 [1,1,0,0,0,0|2,0,0]=4 1272 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2F 62a_100015186278_100009820683 [1,1,0,0,0,0|2,0,0]=4 1273 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2N 62a_100000047001_100015186278 [1,1,0,0,0,0|2,0,0]=4 1274 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2N 62a_100015186278_100000047001 [1,1,0,0,0,0|2,0,0]=4 1275 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Br 62a_100000696092_100015186278 [1,1,0,0,0,0|2,0,0]=4 1276 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Br 62a_100015186278_100000696092 [1,1,0,0,0,0|2,0,0]=4 1277 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2C 62a_100000751373_100015186278 [1,1,0,0,0,0|2,0,0]=4 1278 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2C 62a_100015186278_100000751373 [1,1,0,0,0,0|2,0,0]=4 1279 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Cl 62a_100011356963_100015186278 [1,1,0,0,0,0|2,0,0]=4 1280 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Cl 62a_100015186278_100011356963 [1,1,0,0,0,0|2,0,0]=4 1281 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2F 62a_100000685392_100015186278 [1,1,0,0,0,0|2,0,0]=4 1282 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2F 62a_100015186278_100000685392 [1,1,0,0,0,0|2,0,0]=4 1283 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2N 62a_100000688686_100015186278 [1,1,0,0,0,0|2,0,0]=4 1284 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2N 62a_100015186278_100000688686 [1,1,0,0,0,0|2,0,0]=4 1285 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2O 62a_100000034122_100015186278 [1,1,0,0,0,0|2,0,0]=4 1286 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2O 62a_100015186278_100000034122 [1,1,0,0,0,0|2,0,0]=4 1287 B21R2.2584 COCCCCNc1cc(ccc1c2ccccc2)C 34a_100012281694_100000755781 [0,1,0,0,1,0|2,0,0]=4 1288 B21R2.2584 COCCCCNc1cc(ccc1c2ccccc2)C 7a_100012281694_100000730899 [0,1,0,0,1,0|2,0,0]=4 1289 B21R2.2596 CCCCCCOc1cccnc1c2ccc(cc2)N 34a_200015183928_100000210314 [0,1,0,0,1,0|2,0,0]=4 1290 B21R2.2596 CCCOCCOc1ccccc1c2ccc(cc2)Br 271570a_200012350181_100000752885 [0,1,0,0,1,0|2,0,0]=4 1291 B21R2.2596 CCCOCCOc1ccccc1c2ccc(cc2)C 271570a_200012350181_100000186775 [0,1,0,0,1,0|2,0,0]=4 1292 B21R2.2596 CCCOCCOc1ccccc1c2ccc(cc2)Cl 271570a_200012350181_100000755918 [0,1,0,0,1,0|2,0,0]=4 1293 B21R2.2596 CCCOCCOc1ccccc1c2ccc(cc2)F 271570a_200012350181_100000211213 [0,1,0,0,1,0|2,0,0]=4 1294 B21R2.2596 CCCOCCOc1ccccc1c2ccc(cc2)N 271570a_200012350181_100000185761 [0,1,0,0,1,0|2,0,0]=4 1295 B21R2.2596 CCCOCCOc1ccccc1c2ccc(cc2)O 271570a_200012350181_100000185759 [0,1,0,0,1,0|2,0,0]=4 1296 B21R2.2596 COCCCCNc1ccccc1c2ccc(cc2)C 34a_200020605178_100000755781 [0,1,0,0,1,0|2,0,0]=4 1297 B21R2.2596 COCCCCNc1ccccc1c2ccc(cc2)Cl 34a_100011219812_100000755781 [0,1,0,0,1,0|2,0,0]=4 1298 B21R2.2596 COCCCCNc1ccccc1c2ccc(cc2)F 34a_100011217704_100000755781 [0,1,0,0,1,0|2,0,0]=4 1299 B21R2.2596 COCCCCOc1cccnc1c2ccc(cc2)N 34a_200015183928_100000755781 [0,1,0,0,1,0|2,0,0]=4 1300 B21R2.2888 COCCCCC(=O)c1ccccc1c2ccccc2 1458a_100000211553_100000755781 [0,1,0,0,1,0|2,0,0]=4 1301 B21R2.2888 COCCCCN(C)c1ccccc1c2ccccc2 2230a_100000745565_100000730899 [0,1,0,0,1,0|2,0,0]=4 1302 B21R2.2888 COCCCCN(C)c1ccccc1c2ccccc2 269982a_100000745565_100000730899 [0,1,0,0,1,0|2,0,0]=4 1303 B21R2.2888 COCCCCN(C)c1ccccc1c2ccccc2 34a_100000745565_100000755781 [0,1,0,0,1,0|2,0,0]=4 1304 B21R2.4286 C#CCCCCCOc1ccccc1c2ccccc2 34a_100000210297_100012094781 [0,1,0,0,1,0|1,0,1]=4 1305 B21R2.4286 C#CCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100012094781 [0,1,0,0,1,0|1,0,1]=4 1306 B21R2.4286 C#CCCCCOCc1ccccc1c2ccccc2 34a_100000032370_100010269958 [0,1,0,0,1,0|1,0,1]=4 1307 B21R2.4286 C#CCCCCOCc1ccccc1c2ccccc2 34a_100000766709_100009813379 [0,1,0,0,1,0|1,0,1]=4 1308 B21R2.4286 C#CCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100010269958 [0,1,0,0,1,0|1,0,1]=4 1309 B21R2.4286 C#CCCCCOCc1ccccc1c2ccccc2 7a_100000766709_100009813379 [0,1,0,0,1,0|1,0,1]=4 1310 B21R2.4286 C#CCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000688953 [0,1,0,0,1,0|1,0,1]=4 1311 B21R2.4286 C#CCCNCCOc1ccccc1c2ccccc2 34a_100000746045_100000688953 [0,1,0,0,1,0|1,0,1]=4 1312 B21R2.4286 C#CCCOCCOc1ccccc1c2ccccc2 34a_200000345248_100000688953 [0,1,0,0,1,0|1,0,1]=4 1313 B21R2.4286 C#CCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000688953 [0,1,0,0,1,0|1,0,1]=4 1314 B21R2.4286 C/C=C/CNCCOc1ccccc1c2ccccc2 34a_100000746045_100102629194 [0,1,0,0,1,0|1,0,1]=4 1315 B21R2.4286 C/C=C/COCCOc1ccccc1c2ccccc2 34a_200000345248_100102629194 [0,1,0,0,1,0|1,0,1]=4 1316 B21R2.4286 C/C=C/COCCOc1ccccc1c2ccccc2 7a_200000345248_100102629194 [0,1,0,0,1,0|1,0,1]=4 1317 B21R2.4286 C=CCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000754431 [0,1,0,0,1,0|1,0,1]=4 1318 B21R2.4286 C=CCCNCCOc1ccccc1c2ccccc2 34a_100000746045_100000754431 [0,1,0,0,1,0|1,0,1]=4 1319 B21R2.4286 C=CCCOCCOc1ccccc1c2ccccc2 34a_200000345248_100000754431 [0,1,0,0,1,0|1,0,1]=4 1320 B21R2.4286 C=CCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000754431 [0,1,0,0,1,0|1,0,1]=4 1321 B21R2.4286 CC#CCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000748600 [0,1,0,0,1,0|1,0,1]=4 1322 B21R2.4286 CC#CCNCCOc1ccccc1c2ccccc2 34a_100000746045_100000748600 [0,1,0,0,1,0|1,0,1]=4 1323 B21R2.4286 CC#CCOCCOc1ccccc1c2ccccc2 34a_200000345248_100000748600 [0,1,0,0,1,0|1,0,1]=4 1324 B21R2.4286 CC#CCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000748600 [0,1,0,0,1,0|1,0,1]=4 1325 B21R2.4286 CC=CCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000070051 [0,1,0,0,1,0|1,0,1]=4 1326 B21R2.4286 CC=CCNCCOc1ccccc1c2ccccc2 34a_100000746045_100000070051 [0,1,0,0,1,0|1,0,1]=4 1327 B21R2.4286 CC=CCOCCOc1ccccc1c2ccccc2 34a_200000345248_100000070051 [0,1,0,0,1,0|1,0,1]=4 1328 B21R2.4286 CC=CCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000070051 [0,1,0,0,1,0|1,0,1]=4 1329 B21R2.4286 CCCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000210211 [0,1,0,0,1,0|1,0,0]=3 1330 B21R2.4286 CCCCNCCOc1ccccc1c2ccccc2 34a_100000746045_100000210210 [0,1,0,0,1,0|1,0,0]=3 1331 B21R2.4286 CCCCOCCNc1ccccc1c2ccccc2 34a_100000210918_100000743108 [0,1,0,0,1,0|2,0,0]=4 1332 B21R2.4286 CCCCOCCOc1ccccc1c2ccccc2 34a_100000210297_100000743108 [0,1,0,0,1,0|1,0,0]=3 1333 B21R2.4286 CCCCOCCOc1ccccc1c2ccccc2 34a_200000345248_100000210210 [0,1,0,0,1,0|1,0,0]=3 1334 B21R2.4286 CCCCOCCOc1ccccc1c2ccccc2 7a_100000210297_100000743108 [0,1,0,0,1,0|1,0,0]=3 1335 B21R2.4286 CCCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000210211 [0,1,0,0,1,0|1,0,0]=3 1336 B21R2.4286 CCCCOCCOc1ccccc1c2ccccn2 34a_100012186605_100000743108 [0,1,0,0,1,0|2,0,0]=4 1337 B21R2.4286 CCCCOCCOc1ccccc1c2ccccn2 7a_100012186605_100000743108 [0,1,0,0,1,0|2,0,0]=4 1338 B21R2.4286 CCCCOCCOc1cccnc1c2ccccc2 34a_100011996219_100000743108 [0,1,0,0,1,0|2,0,0]=4 1339 B21R2.4286 CCCCOCCOc1cccnc1c2ccccc2 7a_100011996219_100000743108 [0,1,0,0,1,0|2,0,0]=4 1340 B21R2.4286 CCCCOCOCc1ccccc1c2ccccc2 34a_100000032370_100011995733 [0,1,0,0,1,0|2,0,0]=4 1341 B21R2.4286 CCCOCCOCc1ccccc1c2ccccc2 34a_100000032370_100011215938 [0,1,0,0,1,0|2,0,0]=4 1342 B21R2.4286 CCCOCCOCc1ccccc1c2ccccc2 34a_100000752267_100009813379 [0,1,0,0,1,0|2,0,0]=4 1343 B21R2.4286 CCCOCCOCc1ccccc1c2ccccc2 7a_100000032370_100011215938 [0,1,0,0,1,0|2,0,0]=4 1344 B21R2.4286 CCCOCCOCc1ccccc1c2ccccc2 7a_100000752267_100009813379 [0,1,0,0,1,0|2,0,0]=4 1345 B21R2.4286 CCOCCCOCc1ccccc1c2ccccc2 34a_100000032370_100012232248 [0,1,0,0,1,0|2,0,0]=4 1346 B21R2.4286 CCOCCCOCc1ccccc1c2ccccc2 34a_100000757476_100009813379 [0,1,0,0,1,0|2,0,0]=4 1347 B21R2.4286 CCOCCCOCc1ccccc1c2ccccc2 7a_100000032370_100012232248 [0,1,0,0,1,0|2,0,0]=4 1348 B21R2.4286 CCOCCCOCc1ccccc1c2ccccc2 7a_100000757476_100009813379 [0,1,0,0,1,0|2,0,0]=4 1349 B21R2.4286 COCCCCNCc1ccccc1c2ccccc2 34a_100000071662_100000755781 [0,1,0,0,1,0|2,0,0]=4 1350 B21R2.4286 COCCCCOCc1ccccc1c2ccccc2 34a_100000032370_100000755781 [0,1,0,0,1,0|1,0,0]=3 1351 B21R2.4286 COCCCCOCc1ccccc1c2ccccc2 34a_100000740925_100009813379 [0,1,0,0,1,0|1,0,0]=3 1352 B21R2.4286 COCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100000730899 [0,1,0,0,1,0|1,0,0]=3 1353 B21R2.4286 COCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100011201679 [0,1,0,0,1,0|1,0,0]=3 1354 B21R2.4286 COCCNCCOc1ccccc1c2ccccc2 34a_100000746045_100011201679 [0,1,0,0,1,0|1,0,0]=3 1355 B21R2.4286 COCCOCCNc1ccccc1c2ccccc2 34a_100000210918_100000695917 [0,1,0,0,1,0|2,0,0]=4 1356 B21R2.4286 COCCOCCOc1ccccc1c2ccccc2 34a_100000210297_100000695917 [0,1,0,0,1,0|1,0,0]=3 1357 B21R2.4286 COCCOCCOc1ccccc1c2ccccc2 34a_200000345248_100011201679 [0,1,0,0,1,0|1,0,0]=3 1358 B21R2.4286 COCCOCCOc1ccccc1c2ccccc2 7a_100000210297_100000695917 [0,1,0,0,1,0|1,0,0]=3 1359 B21R2.4286 COCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000233755 [0,1,0,0,1,0|1,0,0]=3 1360 B21R2.4286 COCCOCCOc1ccccc1c2ccccn2 34a_100012186605_100000695917 [0,1,0,0,1,0|2,0,0]=4 1361 B21R2.4286 COCCOCCOc1ccccc1c2ccccn2 7a_100012186605_100000695917 [0,1,0,0,1,0|2,0,0]=4 1362 B21R2.4286 COCCOCCOc1cccnc1c2ccccc2 34a_100011996219_100000695917 [0,1,0,0,1,0|2,0,0]=4 1363 B21R2.4286 COCCOCCOc1cccnc1c2ccccc2 7a_100011996219_100000695917 [0,1,0,0,1,0|2,0,0]=4 1364 B21R2.4286 COCCOCCSc1ccccc1c2ccccc2 62a_100000033479_100000695917 [0,1,0,0,1,0|1,1,0]=4 1365 B21R2.4286 COCCOCCSc1ccccc1c2ccccc2 62a_100000695917_100000033479 [0,1,0,0,1,0|1,1,0]=4 1366 B21R2.4286 CSCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000751147 [0,1,0,0,1,0|1,0,0]=3 1367 B21R2.4286 CSCCNCCOc1ccccc1c2ccccc2 34a_100000746045_100000212216 [0,1,0,0,1,0|1,0,0]=3 1368 B21R2.4286 CSCCOCCOc1ccccc1c2ccccc2 34a_200000345248_100000212216 [0,1,0,0,1,0|1,0,0]=3 1369 B21R2.4286 CSCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000212216 [0,1,0,0,1,0|1,0,0]=3 1370 B21R2.4286 FCCCCCCOc1ccccc1c2ccccn2 34a_100012186605_100015922095 [0,1,0,0,1,0|2,0,0]=4 1371 B21R2.4286 FCCCCCCOc1ccccc1c2ccccn2 7a_100012186605_100015922095 [0,1,0,0,1,0|2,0,0]=4 1372 B21R2.4286 FCCCCCCOc1cccnc1c2ccccc2 34a_100011996219_100015922095 [0,1,0,0,1,0|2,0,0]=4 1373 B21R2.4286 FCCCCCCOc1cccnc1c2ccccc2 7a_100011996219_100015922095 [0,1,0,0,1,0|2,0,0]=4 1374 B21R2.4286 FCCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100011934791 [0,1,0,0,1,0|2,0,0]=4 1375 B21R2.4286 FCCCNCCOc1ccccc1c2ccccc2 34a_100000746045_100011934791 [0,1,0,0,1,0|2,0,0]=4 1376 B21R2.4286 FCCCOCCOc1ccccc1c2ccccc2 34a_200000345248_100011934791 [0,1,0,0,1,0|2,0,0]=4 1377 B21R2.4286 FCCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100011934791 [0,1,0,0,1,0|2,0,0]=4 1378 B21R2.4286 N#CCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100009813376 [0,1,0,0,1,0|1,0,1]=4 1379 B21R2.4286 N#CCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100000211819 [0,1,0,0,1,0|2,0,0]=4 1380 B21R2.4286 N#CCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100011215226 [0,1,0,0,1,0|2,0,0]=4 1381 B21R2.4286 N#CCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100000184422 [0,1,0,0,1,0|2,0,0]=4 1382 B21R2.4286 NCCCCCOCc1ccccc1c2ccccc2 34a_100000762737_100009813379 [0,1,0,0,1,0|2,0,0]=4 1383 B21R2.4286 O=CCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100000139337 [0,1,0,0,1,0|1,0,1]=4 1384 B21R2.4286 O=CCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100000139335 [0,1,0,0,1,0|2,0,0]=4 1385 B21R2.4286 OCCCCCCNc1ccccc1c2ccccc2 34a_100000210918_100000766143 [0,1,0,0,1,0|2,0,0]=4 1386 B21R2.4286 OCCCCCCOc1ccccc1c2ccccc2 34a_100000210297_100000766143 [0,1,0,0,1,0|1,0,0]=3 1387 B21R2.4286 OCCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100000766143 [0,1,0,0,1,0|1,0,0]=3 1388 B21R2.4286 OCCCCCCOc1ccccc1c2ccccn2 34a_100012186605_100000766143 [0,1,0,0,1,0|2,0,0]=4 1389 B21R2.4286 OCCCCCCOc1ccccc1c2ccccn2 7a_100012186605_100000766143 [0,1,0,0,1,0|2,0,0]=4 1390 B21R2.4286 OCCCCCCOc1cccnc1c2ccccc2 34a_100011996219_100000766143 [0,1,0,0,1,0|2,0,0]=4 1391 B21R2.4286 OCCCCCCOc1cccnc1c2ccccc2 7a_100011996219_100000766143 [0,1,0,0,1,0|2,0,0]=4 1392 B21R2.4286 OCCCCCOCc1ccccc1c2ccccc2 34a_100000032370_100000746330 [0,1,0,0,1,0|2,0,0]=4 1393 B21R2.4286 OCCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100000746330 [0,1,0,0,1,0|2,0,0]=4 1394 B21R2.4286 OCCCNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000230001 [0,1,0,0,1,0|2,0,0]=4 1395 B21R2.4286 OCCCNCCOc1ccccc1c2ccccc2 34a_100000746045_100000230001 [0,1,0,0,1,0|2,0,0]=4 1396 B21R2.4286 OCCCOCCOc1ccccc1c2ccccc2 34a_200000345248_100000230001 [0,1,0,0,1,0|2,0,0]=4 1397 B21R2.4286 OCCCOCCOc1ccccc1c2ccccc2 7a_200000345248_100011215043 [0,1,0,0,1,0|2,0,0]=4 1398 B21R2.4815 CCCCC(=O)COc1ccccc1c2ccccc2 1458a_100000260916_100000210211 [0,1,0,0,1,0|1,0,1]=4 1399 B21R2.4815 COCCC(=O)COc1ccccc1c2ccccc2 1458a_100000260916_100000233755 [0,1,0,0,1,0|1,0,1]=4 1400 B21R2.4815 CSCCC(=O)COc1ccccc1c2ccccc2 1458a_100000260916_100000751147 [0,1,0,0,1,0|1,0,1]=4 1401 B21R2.12957 C=C(C)CNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000748629 [0,1,0,0,1,0|2,0,0]=4 1402 B21R2.12957 C=C(C)CNCCOc1ccccc1c2ccccc2 34a_100000746045_100000748629 [0,1,0,0,1,0|2,0,0]=4 1403 B21R2.12957 C=C(C)COCCOc1ccccc1c2ccccc2 34a_200000345248_100000748629 [0,1,0,0,1,0|2,0,0]=4 1404 B21R2.12957 C=C(C)COCCOc1ccccc1c2ccccc2 7a_200000345248_100000748629 [0,1,0,0,1,0|2,0,0]=4 1405 B21R2.12957 CC(=O)CCCCNc1ccccc1c2ccccc2 34a_100000210918_100009817362 [0,1,0,0,1,0|2,0,0]=4 1406 B21R2.12957 CC(=O)CCCCOc1ccccc1c2ccccc2 34a_100000210297_100009817362 [0,1,0,0,1,0|1,0,0]=3 1407 B21R2.12957 CC(=O)CCCCOc1ccccc1c2ccccc2 7a_100000210297_100000735457 [0,1,0,0,1,0|1,0,0]=3 1408 B21R2.12957 CC(=O)CCCCOc1ccccc1c2ccccn2 34a_100012186605_100009817362 [0,1,0,0,1,0|2,0,0]=4 1409 B21R2.12957 CC(=O)CCCCOc1ccccc1c2ccccn2 7a_100012186605_100000735457 [0,1,0,0,1,0|2,0,0]=4 1410 B21R2.12957 CC(=O)CCCCOc1cccnc1c2ccccc2 34a_100011996219_100009817362 [0,1,0,0,1,0|2,0,0]=4 1411 B21R2.12957 CC(=O)CCCCOc1cccnc1c2ccccc2 7a_100011996219_100000735457 [0,1,0,0,1,0|2,0,0]=4 1412 B21R2.12957 CC(=O)OCCCOc1ccccc1c2ccccc2 34a_100000210297_100000042594 [0,1,0,0,1,0|2,0,0]=4 1413 B21R2.12957 CC(=O)OCCCOc1ccccc1c2ccccc2 7a_100000210297_100000042594 [0,1,0,0,1,0|2,0,0]=4 1414 B21R2.12957 CC(=O)SCCCOc1ccccc1c2ccccc2 34a_100000210297_100000038929 [0,1,0,0,1,0|2,0,0]=4 1415 B21R2.12957 CC(=O)SCCCOc1ccccc1c2ccccc2 7a_100000210297_100000038929 [0,1,0,0,1,0|2,0,0]=4 1416 B21R2.12957 CC(=S)OCCCOc1ccccc1c2ccccc2 34a_100000210297_200135323944 [0,1,0,0,1,0|2,0,0]=4 1417 B21R2.12957 CC(=S)OCCCOc1ccccc1c2ccccc2 7a_100000210297_200135323944 [0,1,0,0,1,0|2,0,0]=4 1418 B21R2.12957 CC(C)CCCCOc1ccccc1c2ccccn2 34a_100012186605_100011216152 [0,1,0,0,1,0|2,0,0]=4 1419 B21R2.12957 CC(C)CCCCOc1ccccc1c2ccccn2 7a_100012186605_100011216152 [0,1,0,0,1,0|2,0,0]=4 1420 B21R2.12957 CC(C)CCCCOc1cccnc1c2ccccc2 34a_100011996219_100011216152 [0,1,0,0,1,0|2,0,0]=4 1421 B21R2.12957 CC(C)CCCCOc1cccnc1c2ccccc2 7a_100011996219_100011216152 [0,1,0,0,1,0|2,0,0]=4 1422 B21R2.12957 CC(C)CNCCOc1ccccc1c2ccccc2 2230a_100000746045_100000210760 [0,1,0,0,1,0|2,0,0]=4 1423 B21R2.12957 CC(C)CNCCOc1ccccc1c2ccccc2 270004a_100000746045_100000210432 [0,1,0,0,1,0|2,0,0]=4 1424 B21R2.12957 CC(C)CNCCOc1ccccc1c2ccccc2 34a_100000746045_100000210624 [0,1,0,0,1,0|2,0,0]=4 1425 B21R2.12957 CC(C)COCCOc1ccccc1c2ccccc2 34a_200000345248_100000210624 [0,1,0,0,1,0|2,0,0]=4 1426 B21R2.12957 CC(C)COCCOc1ccccc1c2ccccc2 7a_200000345248_100000210760 [0,1,0,0,1,0|2,0,0]=4 1427 B21R2.12957 CC(O)CNCCOc1ccccc1c2ccccc2 2230a_100000746045_100011218427 [0,1,0,0,1,0|2,0,0]=4 1428 B21R2.12957 CC(O)CNCCOc1ccccc1c2ccccc2 34a_100000746045_100011218427 [0,1,0,0,1,0|2,0,0]=4 1429 B21R2.12957 CC(O)COCCOc1ccccc1c2ccccc2 34a_200000345248_100011218427 [0,1,0,0,1,0|2,0,0]=4 1430 B21R2.12957 CC(O)COCCOc1ccccc1c2ccccc2 7a_200000345248_100011218427 [0,1,0,0,1,0|2,0,0]=4 1431 B21R2.12957 CN(C)CCCCNc1ccccc1c2ccncc2 27a_100025707445_100010154595 [0,1,0,0,1,0|2,0,0]=4 1432 B21R2.12957 CN(C)CCCCNc1cccnc1c2ccccc2 27a_100025707445_100010138707 [0,1,0,0,1,0|2,0,0]=4 1433 B21R2.12957 CN(C)CCCCSc1ccccc1c2ccccc2 62a_100000033479_100000690147 [0,1,0,0,1,0|0,1,0]=3 1434 B21R2.12957 CN(C)CCCCSc1ccccc1c2ccccn2 62a_100010202516_100000690147 [0,1,0,0,1,0|1,1,0]=4 1435 B21R2.12957 CN(C)CCCCSc1ccccc1c2ccncc2 62a_100010154595_100000690147 [0,1,0,0,1,0|1,1,0]=4 1436 B21R2.12957 CN(C)CCCCSc1cccnc1c2ccccc2 62a_100010138707_100000690147 [0,1,0,0,1,0|1,1,0]=4 1437 B21R2.12957 CN(C)CCCCSc1cnccc1c2ccccc2 62a_100009816686_100000690147 [0,1,0,0,1,0|1,1,0]=4 1438 B21R2.12957 CN(C)CCCNCc1ccccc1c2ccccc2 207a_102531767803_100011219292 [0,1,0,0,1,0|2,0,0]=4 1439 B21R2.12957 CN(C)CCCNCc1ccccc1c2ccccc2 270004a_102531767803_100011219292 [0,1,0,0,1,0|2,0,0]=4 1440 B21R2.12957 CN(C)CCCOCc1ccccc1c2ccccc2 7a_100000032370_100000757444 [0,1,0,0,1,0|2,0,0]=4 1441 B21R2.12957 CN(C)CCCSCc1ccccc1c2ccccc2 62a_100009813379_100000757444 [0,1,0,0,1,0|2,0,0]=4 1442 B21R2.12957 C[C@@H](O)CNCCOc1ccccc1c2ccccc2 2230a_100000746045_100009817552 [0,1,0,0,1,0|2,0,0]=4 1443 B21R2.12957 C[C@@H](O)CNCCOc1ccccc1c2ccccc2 34a_100000746045_100009817552 [0,1,0,0,1,0|2,0,0]=4 1444 B21R2.12957 C[C@@H](O)COCCOc1ccccc1c2ccccc2 34a_200000345248_100009817552 [0,1,0,0,1,0|2,0,0]=4 1445 B21R2.12957 C[C@@H](O)COCCOc1ccccc1c2ccccc2 7a_200000345248_100009817552 [0,1,0,0,1,0|2,0,0]=4 1446 B21R2.12957 OB(O)CCCCOc1ccccc1c2ccccc2 34a_100000210297_200009817182 [0,1,0,0,1,0|2,0,0]=4 1447 B21R2.12957 OB(O)CCCCOc1ccccc1c2ccccc2 7a_100000210297_200009817182 [0,1,0,0,1,0|2,0,0]=4 1448 B21R2.20550 CCC(C)NCCOc1ccccc1c2ccccc2 2230a_100000746045_100000758301 [0,1,0,0,1,0|2,0,0]=4 1449 B21R2.20550 CCC(C)NCCOc1ccccc1c2ccccc2 34a_100000746045_100011215416 [0,1,0,0,1,0|2,0,0]=4 1450 B21R2.20550 CCC(C)OCCOc1ccccc1c2ccccc2 34a_200000345248_100011215416 [0,1,0,0,1,0|2,0,0]=4 1451 B21R2.20550 CCC(C)OCCOc1ccccc1c2ccccc2 7a_200000345248_100000758301 [0,1,0,0,1,0|2,0,0]=4 1452 B21R2.20550 CCN(C)CCCOc1ccccc1c2ccccc2 7a_100000210297_100015186262 [0,1,0,0,1,0|2,0,0]=4 1453 B21R2.20550 CNC(=O)CCCNc1ccccc1c2ccccc2 34a_100000210918_100000741757 [0,1,0,0,1,0|1,0,1]=4 1454 B21R2.20550 CNC(=O)CCCOc1ccccc1c2ccccc2 34a_100000210297_100000741757 [0,1,0,0,1,0|0,0,1]=3 1455 B21R2.20550 CNC(=O)CCCOc1ccccc1c2ccccc2 7a_100000210297_100000741757 [0,1,0,0,1,0|0,0,1]=3 1456 B21R2.20550 CNC(=O)CCCOc1ccccc1c2ccccn2 34a_100012186605_100000741757 [0,1,0,0,1,0|1,0,1]=4 1457 B21R2.20550 CNC(=O)CCCOc1ccccc1c2ccccn2 7a_100012186605_100000741757 [0,1,0,0,1,0|1,0,1]=4 1458 B21R2.20550 CNC(=O)CCCOc1cccnc1c2ccccc2 34a_100011996219_100000741757 [0,1,0,0,1,0|1,0,1]=4 1459 B21R2.20550 CNC(=O)CCCOc1cccnc1c2ccccc2 7a_100011996219_100000741757 [0,1,0,0,1,0|1,0,1]=4 1460 B21R2.20550 CNC(=O)CCCSc1ccccc1c2ccccc2 62a_100000033479_100000741757 [0,1,0,0,1,0|0,1,1]=4 1461 B21R2.20550 CNC(=O)CCCSc1ccccc1c2ccccc2 62a_100000741757_100000033479 [0,1,0,0,1,0|0,1,1]=4 1462 B21R2.20550 CNC(=O)NCCOc1ccccc1c2ccccc2 2708a_100000746045_106832991635 [0,1,0,0,1,0|1,0,1]=4 1463 B21R2.20550 CNC(=O)NCCOc1ccccc1c2ccccc2 2708a_100102657272_100000746045 [0,1,0,0,1,0|1,0,1]=4 1464 B21R2.20550 CNC(=O)NCCOc1ccccc1c2ccccc2 273464a_100000746045_100102657272 [0,1,0,0,1,0|1,0,1]=4 1465 B21R2.20550 CNC(=O)NCCOc1ccccc1c2ccccc2 273464a_100102657272_100000746045 [0,1,0,0,1,0|1,0,1]=4 1466 B21R2.20550 CNC(=O)NCCOc1ccccc1c2ccccc2 512a_100000746045_100102657272 [0,1,0,0,1,0|1,0,1]=4 1467 B21R2.20550 CNC(=O)NCCOc1ccccc1c2ccccc2 512a_106832991638_100000746045 [0,1,0,0,1,0|1,0,1]=4 1468 B21R2.20550 CNC(=O)OCCOc1ccccc1c2ccccc2 34a_100000210297_200011997002 [0,1,0,0,1,0|1,0,1]=4 1469 B21R2.20550 CNC(=O)OCCOc1ccccc1c2ccccc2 7a_100000210297_200011997002 [0,1,0,0,1,0|1,0,1]=4 1470 B21R2.20550 COC(=O)CCCOc1ccccc1c2ccccc2 34a_100000210297_100000742333 [0,1,0,0,1,0|1,0,1]=4 1471 B21R2.20550 COC(=O)CCCOc1ccccc1c2ccccc2 7a_100000210297_100011218270 [0,1,0,0,1,0|1,0,1]=4 1472 B21R2.24296 CCCOCCOc1ccccc1c2cccc(c2)Br 271570a_200012350181_100000691529 [0,1,0,0,1,0|2,0,0]=4 1473 B21R2.24296 CCCOCCOc1ccccc1c2cccc(c2)C 271570a_200012350181_100011215228 [0,1,0,0,1,0|2,0,0]=4 1474 B21R2.24296 CCCOCCOc1ccccc1c2cccc(c2)Cl 271570a_200012350181_100000699651 [0,1,0,0,1,0|2,0,0]=4 1475 B21R2.24296 CCCOCCOc1ccccc1c2cccc(c2)F 271570a_200012350181_100000685547 [0,1,0,0,1,0|2,0,0]=4 1476 B21R2.24296 CCCOCCOc1ccccc1c2cccc(c2)N 271570a_200012350181_100000210019 [0,1,0,0,1,0|2,0,0]=4 1477 B21R2.24296 CCCOCCOc1ccccc1c2cccc(c2)O 271570a_200012350181_100000211634 [0,1,0,0,1,0|2,0,0]=4 1478 B21R2.24296 CCCOCCOc1ccccc1c2cccc(c2)[S] 271570a_200012350181_114929384022 [0,1,0,0,1,0|2,0,0]=4 1479 B21R2.24296 COCCCCNc1ccccc1c2cccc(c2)C 2230a_100020605107_100000730899 [0,1,0,0,1,0|2,0,0]=4 1480 B21R2.24296 COCCCCNc1ccccc1c2cccc(c2)C 34a_100020605107_100000755781 [0,1,0,0,1,0|2,0,0]=4 1481 B21R2.24296 COCCCCNc1ccccc1c2cccc(c2)C 7a_100020605107_100000730899 [0,1,0,0,1,0|2,0,0]=4 1482 B21R2.24594 C#CCCCCOc1ccc(cc1c2ccccc2)N 34a_100000687115_100010269958 [0,1,0,0,1,0|1,0,1]=4 1483 B21R2.24594 C#CCCCCOc1ccc(cc1c2ccccc2)N 7a_100000687115_100010269958 [0,1,0,0,1,0|1,0,1]=4 1484 B21R2.24594 C=CCCCCOc1ccc(cc1c2ccccc2)N 34a_100000687115_100011215482 [0,1,0,0,1,0|1,0,1]=4 1485 B21R2.24594 C=CCCCCOc1ccc(cc1c2ccccc2)N 7a_100000687115_100011215482 [0,1,0,0,1,0|1,0,1]=4 1486 B21R2.24594 CCCCCCOc1ccc(cc1c2ccccc2)N 34a_100000687115_100000210314 [0,1,0,0,1,0|1,0,0]=3 1487 B21R2.24594 CCCCCCOc1ccc(cc1c2ccccc2)N 7a_100000687115_100000210314 [0,1,0,0,1,0|1,0,0]=3 1488 B21R2.24594 CCCCOCOc1ccc(cc1c2ccccc2)N 34a_100000687115_100011995733 [0,1,0,0,1,0|2,0,0]=4 1489 B21R2.24594 CCCOCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100011215938 [0,1,0,0,1,0|2,0,0]=4 1490 B21R2.24594 CCCOCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100011215938 [0,1,0,0,1,0|2,0,0]=4 1491 B21R2.24594 CCCOCCOc1ccc(cc1c2ccccc2)N 34a_100000687115_100011215938 [0,1,0,0,1,0|2,0,0]=4 1492 B21R2.24594 CCCOCCOc1ccc(cc1c2ccccc2)N 7a_100000687115_100011215938 [0,1,0,0,1,0|2,0,0]=4 1493 B21R2.24594 CCOCCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100012232248 [0,1,0,0,1,0|2,0,0]=4 1494 B21R2.24594 CCOCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100012232248 [0,1,0,0,1,0|2,0,0]=4 1495 B21R2.24594 CCOCCCOc1ccc(cc1c2ccccc2)N 34a_100000687115_100012232248 [0,1,0,0,1,0|2,0,0]=4 1496 B21R2.24594 CCOCCCOc1ccc(cc1c2ccccc2)N 7a_100000687115_100012232248 [0,1,0,0,1,0|2,0,0]=4 1497 B21R2.24594 COCCCCNc1ccc(cc1c2ccccc2)Cl 34a_100000716729_100000755781 [0,1,0,0,1,0|2,0,0]=4 1498 B21R2.24594 COCCCCNc1ccc(cc1c2ccccc2)Cl 7a_100000716729_100000730899 [0,1,0,0,1,0|2,0,0]=4 1499 B21R2.24594 COCCCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100000755781 [0,1,0,0,1,0|1,0,0]=3 1500 B21R2.24594 COCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100000730899 [0,1,0,0,1,0|1,0,0]=3 1501 B21R2.24594 COCCCCOc1ccc(cc1c2ccccc2)N 34a_100000687115_100000755781 [0,1,0,0,1,0|1,0,0]=3 1502 B21R2.24594 COCCCCOc1ccc(cc1c2ccccc2)N 7a_100000687115_100000730899 [0,1,0,0,1,0|1,0,0]=3 1503 B21R2.24594 COCCCCSc1ccc(cc1c2ccccc2)N 62a_200010239565_100000730899 [0,1,0,0,1,0|1,1,0]=4 1504 B21R2.24594 N#CCCCCOc1ccc(cc1c2ccccc2)N 7a_100000687115_100000211819 [0,1,0,0,1,0|2,0,0]=4 1505 B21R2.24594 Nc1ccc(c(c1)c2ccccc2)OCCCCC=O 7a_100000687115_100000139335 [0,1,0,0,1,0|2,0,0]=4 1506 B21R2.24594 Nc1ccc(c(c1)c2ccccc2)OCCCCCF 34a_100000687115_100000729378 [0,1,0,0,1,0|2,0,0]=4 1507 B21R2.24594 Nc1ccc(c(c1)c2ccccc2)OCCCCCF 7a_100000687115_100000729378 [0,1,0,0,1,0|2,0,0]=4 1508 B21R2.24594 Nc1ccc(c(c1)c2ccccc2)OCCCCCO 34a_100000687115_100000746330 [0,1,0,0,1,0|2,0,0]=4 1509 B21R2.24594 Nc1ccc(c(c1)c2ccccc2)OCCCCCO 7a_100000687115_100000746330 [0,1,0,0,1,0|2,0,0]=4 1510 B21R2.24594 O=CCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100000139335 [0,1,0,0,1,0|2,0,0]=4 1511 B21R2.24594 OCCCCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100000746330 [0,1,0,0,1,0|2,0,0]=4 1512 B21R2.24594 OCCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100000746330 [0,1,0,0,1,0|2,0,0]=4 1513 B21R2.46828 C#CCCCCOc1c(cccc1c2ccccc2)C 34a_100000060226_100010269958 [0,1,0,0,1,0|1,0,1]=4 1514 B21R2.46828 C#CCCCCOc1c(cccc1c2ccccc2)C 7a_100000060226_100010269958 [0,1,0,0,1,0|1,0,1]=4 1515 B21R2.46828 CCCCOCOc1c(cccc1c2ccccc2)C 34a_100000060226_100011995733 [0,1,0,0,1,0|2,0,0]=4 1516 B21R2.46828 CCCOCCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100011215938 [0,1,0,0,1,0|2,0,0]=4 1517 B21R2.46828 CCCOCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100011215938 [0,1,0,0,1,0|2,0,0]=4 1518 B21R2.46828 CCCOCCOc1c(cccc1c2ccccc2)C 34a_100000060226_100011215938 [0,1,0,0,1,0|2,0,0]=4 1519 B21R2.46828 CCCOCCOc1c(cccc1c2ccccc2)C 7a_100000060226_100011215938 [0,1,0,0,1,0|2,0,0]=4 1520 B21R2.46828 CCOCCCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100012232248 [0,1,0,0,1,0|2,0,0]=4 1521 B21R2.46828 CCOCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100012232248 [0,1,0,0,1,0|2,0,0]=4 1522 B21R2.46828 CCOCCCOc1c(cccc1c2ccccc2)C 34a_100000060226_100012232248 [0,1,0,0,1,0|2,0,0]=4 1523 B21R2.46828 CCOCCCOc1c(cccc1c2ccccc2)C 7a_100000060226_100012232248 [0,1,0,0,1,0|2,0,0]=4 1524 B21R2.46828 COCCCCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100000755781 [0,1,0,0,1,0|1,0,0]=3 1525 B21R2.46828 COCCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100000730899 [0,1,0,0,1,0|1,0,0]=3 1526 B21R2.46828 COCCCCOc1c(cccc1c2ccccc2)C 34a_100000060226_100000755781 [0,1,0,0,1,0|1,0,0]=3 1527 B21R2.46828 COCCCCOc1c(cccc1c2ccccc2)C 7a_100000060226_100000730899 [0,1,0,0,1,0|1,0,0]=3 1528 B21R2.46828 Cc1cccc(c1OCCCCC#N)c2ccccc2 7a_100000060226_100000211819 [0,1,0,0,1,0|2,0,0]=4 1529 B21R2.46828 Cc1cccc(c1OCCCCC=O)c2ccccc2 7a_100000060226_100000139335 [0,1,0,0,1,0|2,0,0]=4 1530 B21R2.46828 Cc1cccc(c1OCCCCCO)c2ccccc2 34a_100000060226_100000746330 [0,1,0,0,1,0|2,0,0]=4 1531 B21R2.46828 Cc1cccc(c1OCCCCCO)c2ccccc2 7a_100000060226_100000746330 [0,1,0,0,1,0|2,0,0]=4 1532 B21R2.46828 O=CCCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100000139335 [0,1,0,0,1,0|2,0,0]=4 1533 B21R2.46828 OCCCCCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100000746330 [0,1,0,0,1,0|2,0,0]=4 1534 B21R2.46828 OCCCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100000746330 [0,1,0,0,1,0|2,0,0]=4 1535 B21R2.470948 C#CCCCCOc1ccccc1c2ccccc2C 34a_200011997984_100010269958 [0,1,0,0,1,0|1,0,1]=4 1536 B21R2.470948 C#CCCCCOc1ccccc1c2ccccc2C 7a_200011997984_100010269958 [0,1,0,0,1,0|1,0,1]=4 1537 B21R2.470948 CCCCOCOc1ccccc1c2ccccc2C 34a_200011997984_100011995733 [0,1,0,0,1,0|2,0,0]=4 1538 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2Br 271570a_200012350181_100000695589 [0,1,0,0,1,0|2,0,0]=4 1539 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2C 271570a_200012350181_100000210755 [0,1,0,0,1,0|2,0,0]=4 1540 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2C 34a_200011997984_100011215938 [0,1,0,0,1,0|2,0,0]=4 1541 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2C 7a_200011997984_100011215938 [0,1,0,0,1,0|2,0,0]=4 1542 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2Cl 271570a_200012350181_100000764095 [0,1,0,0,1,0|2,0,0]=4 1543 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2F 271570a_200012350181_100011215700 [0,1,0,0,1,0|2,0,0]=4 1544 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2N 271570a_200012350181_100000210017 [0,1,0,0,1,0|2,0,0]=4 1545 B21R2.470948 CCCOCCOc1ccccc1c2ccccc2O 271570a_200012350181_100000739446 [0,1,0,0,1,0|2,0,0]=4 1546 B21R2.470948 CCOCCCOc1ccccc1c2ccccc2C 34a_200011997984_100012232248 [0,1,0,0,1,0|2,0,0]=4 1547 B21R2.470948 CCOCCCOc1ccccc1c2ccccc2C 7a_200011997984_100012232248 [0,1,0,0,1,0|2,0,0]=4 1548 B21R2.470948 COCCCCNc1ccccc1c2ccccc2C 34a_100020605195_100000755781 [0,1,0,0,1,0|2,0,0]=4 1549 B21R2.470948 COCCCCOc1ccccc1c2ccccc2C 34a_200011997984_100000755781 [0,1,0,0,1,0|1,0,0]=3 1550 B21R2.470948 COCCCCOc1ccccc1c2ccccc2C 7a_200011997984_100000730899 [0,1,0,0,1,0|1,0,0]=3 1551 B21R2.470948 Cc1ccccc1c2ccccc2OCCCCC#N 7a_200011997984_100000211819 [0,1,0,0,1,0|2,0,0]=4 1552 B21R2.470948 Cc1ccccc1c2ccccc2OCCCCC=O 7a_200011997984_100000139335 [0,1,0,0,1,0|2,0,0]=4 1553 B21R2.470948 Cc1ccccc1c2ccccc2OCCCCCO 34a_200011997984_100000746330 [0,1,0,0,1,0|2,0,0]=4 1554 B21R2.470948 Cc1ccccc1c2ccccc2OCCCCCO 7a_200011997984_100000746330 [0,1,0,0,1,0|2,0,0]=4 1555 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)O 270302a_100000185829_200000189357 [0,1,0,0,0,1|1,0,0]=3 1556 B23R2.29036 CCCOCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100011215938 [0,1,0,0,0,1|2,0,0]=4 1557 B23R2.29036 CCCOCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100011215938 [0,1,0,0,0,1|2,0,0]=4 1558 B23R2.29036 CCOCCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100012232248 [0,1,0,0,0,1|2,0,0]=4 1559 B23R2.29036 CCOCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100012232248 [0,1,0,0,0,1|2,0,0]=4 1560 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)F 2230a_100015187171_100000730899 [0,1,0,0,0,1|2,0,0]=4 1561 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)F 34a_100015187171_100000755781 [0,1,0,0,0,1|2,0,0]=4 1562 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)F 7a_100015187171_100000730899 [0,1,0,0,0,1|2,0,0]=4 1563 B23R2.29036 COCCCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100000755781 [0,1,0,0,0,1|1,0,0]=3 1564 B23R2.29036 COCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100000730899 [0,1,0,0,0,1|1,0,0]=3 1565 B23R2.29036 COCCCCOc1ccccc1CNc2ccc(cn2)Cl 34a_200005835295_100000755781 [0,1,0,0,0,1|2,0,0]=4 1566 B23R2.29036 COCCCCOc1ccccc1CNc2ccc(cn2)Cl 7a_200005835295_100000730899 [0,1,0,0,0,1|2,0,0]=4 1567 B23R2.29036 COCCCCSc1ccccc1OCc2ccc(cc2)F 62a_100000730899_200000151720 [0,1,0,0,0,1|1,1,0]=4 1568 B23R2.29036 COCCCCSc1ccccc1OCc2ccc(cc2)F 62a_200000151720_100000730899 [0,1,0,0,0,1|1,1,0]=4 1569 B23R2.29036 N#CCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100000211819 [0,1,0,0,0,1|2,0,0]=4 1570 B23R2.29036 O=CCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100000139335 [0,1,0,0,0,1|2,0,0]=4 1571 B23R2.29036 OCCCCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100000746330 [0,1,0,0,0,1|2,0,0]=4 1572 B23R2.29036 OCCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100000746330 [0,1,0,0,0,1|2,0,0]=4 1573 B23R2.29827 CCN(C)CCCOc1ccccc1OCc2ccccc2 7a_100000187230_100015186262 [0,1,0,0,0,1|2,0,0]=4 1574 B23R2.29827 CNC(=O)CCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000741757 [0,1,0,0,0,1|1,0,1]=4 1575 B23R2.29827 CNC(=O)CCCNc1ccccc1COc2ccccc2 34a_100000742786_100000741757 [0,1,0,0,0,1|1,0,1]=4 1576 B23R2.29827 CNC(=O)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100000741757 [0,1,0,0,0,1|1,0,1]=4 1577 B23R2.29827 CNC(=O)CCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000741757 [0,1,0,0,0,1|1,0,1]=4 1578 B23R2.29827 CNC(=O)CCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000741757 [0,1,0,0,0,1|1,0,1]=4 1579 B23R2.29827 CNC(=O)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000741757 [0,1,0,0,0,1|1,0,1]=4 1580 B23R2.29827 CNC(=O)CCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000741757 [0,1,0,0,0,1|1,0,1]=4 1581 B23R2.29827 CNC(=O)CCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000741757 [0,1,0,0,0,1|0,0,1]=3 1582 B23R2.29827 CNC(=O)CCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000741757 [0,1,0,0,0,1|0,0,1]=3 1583 B23R2.29827 CNC(=O)CCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000741757 [0,1,0,0,0,1|0,1,1]=4 1584 B23R2.29827 CNC(=O)CCCSc1ccccc1OCc2ccccc2 62a_100000741757_100000151716 [0,1,0,0,0,1|0,1,1]=4 1585 B23R2.29827 CNC(=O)OCCOc1ccccc1OCc2ccccc2 34a_100000187230_200011997002 [0,1,0,0,0,1|1,0,1]=4 1586 B23R2.29827 CNC(=O)OCCOc1ccccc1OCc2ccccc2 7a_100000187230_200011997002 [0,1,0,0,0,1|1,0,1]=4 1587 B23R2.29827 COC(=O)CCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000742333 [0,1,0,0,0,1|1,0,1]=4 1588 B23R2.29827 COC(=O)CCCOc1ccccc1OCc2ccccc2 7a_100000187230_100011218270 [0,1,0,0,0,1|1,0,1]=4 1589 B23R2.31771 CCCCCCOc1ccc(cc1CNc2ccccn2)C 34a_200015185502_100000210314 [0,1,0,0,0,1|2,0,0]=4 1590 B23R2.31771 CCCCCCOc1ccc(cc1CNc2ccccn2)C 7a_200015185502_100000210314 [0,1,0,0,0,1|2,0,0]=4 1591 B23R2.31771 CCCOCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100011215938 [0,1,0,0,0,1|2,0,0]=4 1592 B23R2.31771 CCCOCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100011215938 [0,1,0,0,0,1|2,0,0]=4 1593 B23R2.31771 CCOCCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100012232248 [0,1,0,0,0,1|2,0,0]=4 1594 B23R2.31771 CCOCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100012232248 [0,1,0,0,0,1|2,0,0]=4 1595 B23R2.31771 COCCCCNc1ccc(cc1OCc2ccccc2)C 2230a_100011220564_100000730899 [0,1,0,0,0,1|2,0,0]=4 1596 B23R2.31771 COCCCCNc1ccc(cc1OCc2ccccc2)C 34a_100011220564_100000755781 [0,1,0,0,0,1|2,0,0]=4 1597 B23R2.31771 COCCCCNc1ccc(cc1OCc2ccccc2)F 2230a_100011195462_100000730899 [0,1,0,0,0,1|2,0,0]=4 1598 B23R2.31771 COCCCCNc1ccc(cc1OCc2ccccc2)F 34a_100011195462_100000755781 [0,1,0,0,0,1|2,0,0]=4 1599 B23R2.31771 COCCCCNc1ccc(cc1OCc2ccccc2)F 7a_100011195462_100000730899 [0,1,0,0,0,1|2,0,0]=4 1600 B23R2.31771 COCCCCOc1ccc(cc1CNc2ccccn2)C 34a_200015185502_100000755781 [0,1,0,0,0,1|2,0,0]=4 1601 B23R2.31771 COCCCCOc1ccc(cc1CNc2ccccn2)C 7a_200015185502_100000730899 [0,1,0,0,0,1|2,0,0]=4 1602 B23R2.31771 COCCCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100000755781 [0,1,0,0,0,1|1,0,0]=3 1603 B23R2.31771 COCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100000730899 [0,1,0,0,0,1|1,0,0]=3 1604 B23R2.31771 COCCCCSc1ccc(cc1OCc2ccccc2)F 62a_100000730899_100012355265 [0,1,0,0,0,1|1,1,0]=4 1605 B23R2.31771 COCCCCSc1ccc(cc1OCc2ccccc2)F 62a_100012355265_100000730899 [0,1,0,0,0,1|1,1,0]=4 1606 B23R2.31771 O=CCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100000139335 [0,1,0,0,0,1|2,0,0]=4 1607 B23R2.31771 OCCCCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100000746330 [0,1,0,0,0,1|2,0,0]=4 1608 B23R2.31771 OCCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100000746330 [0,1,0,0,0,1|2,0,0]=4 1609 B23R2.32080 C#CCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100012094781 [0,1,0,0,0,1|1,0,1]=4 1610 B23R2.32080 C#CCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100012094781 [0,1,0,0,0,1|1,0,1]=4 1611 B23R2.32080 C#CCCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100010269958 [0,1,0,0,0,1|1,0,1]=4 1612 B23R2.32080 C#CCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100010269958 [0,1,0,0,0,1|1,0,1]=4 1613 B23R2.32080 C#CCCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100010269958 [0,1,0,0,0,1|1,0,1]=4 1614 B23R2.32080 C#CCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100010269958 [0,1,0,0,0,1|1,0,1]=4 1615 B23R2.32080 CCCCCCNCc1ccccc1COc2ccccc2 34a_100000737599_100000210314 [0,1,0,0,0,1|2,0,0]=4 1616 B23R2.32080 CCCCCCNCc1ccccc1OCc2ccccc2 207a_100000210581_100000151772 [0,1,0,0,0,1|2,0,0]=4 1617 B23R2.32080 CCCCCCNCc1ccccc1OCc2ccccc2 270004a_100000210581_100000151772 [0,1,0,0,0,1|2,0,0]=4 1618 B23R2.32080 CCCCCCNCc1ccccc1OCc2ccccc2 34a_100000741334_100000210314 [0,1,0,0,0,1|2,0,0]=4 1619 B23R2.32080 CCCCOCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000743108 [0,1,0,0,0,1|2,0,0]=4 1620 B23R2.32080 CCCCOCCNc1ccccc1COc2ccccc2 34a_100000742786_100000743108 [0,1,0,0,0,1|2,0,0]=4 1621 B23R2.32080 CCCCOCCNc1ccccc1COc2ccccc2 7a_100000742786_100000743108 [0,1,0,0,0,1|2,0,0]=4 1622 B23R2.32080 CCCCOCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000743108 [0,1,0,0,0,1|2,0,0]=4 1623 B23R2.32080 CCCCOCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000743108 [0,1,0,0,0,1|2,0,0]=4 1624 B23R2.32080 CCCCOCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000743108 [0,1,0,0,0,1|1,0,0]=3 1625 B23R2.32080 CCCCOCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000743108 [0,1,0,0,0,1|1,0,0]=3 1626 B23R2.32080 CCCCOCOCc1ccccc1CCc2ccccc2 34a_200000042600_100011995733 [0,1,0,0,0,1|2,0,0]=4 1627 B23R2.32080 CCCCOCOCc1ccccc1OCc2ccccc2 34a_100000187657_100011995733 [0,1,0,0,0,1|2,0,0]=4 1628 B23R2.32080 CCCOCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100011215938 [0,1,0,0,0,1|2,0,0]=4 1629 B23R2.32080 CCCOCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100011215938 [0,1,0,0,0,1|2,0,0]=4 1630 B23R2.32080 CCCOCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100011215938 [0,1,0,0,0,1|2,0,0]=4 1631 B23R2.32080 CCCOCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100011215938 [0,1,0,0,0,1|2,0,0]=4 1632 B23R2.32080 CCOCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100012232248 [0,1,0,0,0,1|2,0,0]=4 1633 B23R2.32080 CCOCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100012232248 [0,1,0,0,0,1|2,0,0]=4 1634 B23R2.32080 CCOCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100012232248 [0,1,0,0,0,1|2,0,0]=4 1635 B23R2.32080 CCOCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100012232248 [0,1,0,0,0,1|2,0,0]=4 1636 B23R2.32080 COCCCCNCc1ccccc1COc2ccccc2 34a_100000737599_100000755781 [0,1,0,0,0,1|2,0,0]=4 1637 B23R2.32080 COCCCCNCc1ccccc1OCc2ccccc2 34a_100000741334_100000755781 [0,1,0,0,0,1|2,0,0]=4 1638 B23R2.32080 COCCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100000755781 [0,1,0,0,0,1|1,0,0]=3 1639 B23R2.32080 COCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000730899 [0,1,0,0,0,1|1,0,0]=3 1640 B23R2.32080 COCCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100000755781 [0,1,0,0,0,1|1,0,0]=3 1641 B23R2.32080 COCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000730899 [0,1,0,0,0,1|1,0,0]=3 1642 B23R2.32080 COCCCOCCc1ccccc1OCc2ccccc2 34a_100000721452_100000740836 [0,1,0,0,0,1|2,0,0]=4 1643 B23R2.32080 COCCCOCCc1ccccc1OCc2ccccc2 7a_100000721452_100000740836 [0,1,0,0,0,1|2,0,0]=4 1644 B23R2.32080 COCCOCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000695917 [0,1,0,0,0,1|2,0,0]=4 1645 B23R2.32080 COCCOCCNc1ccccc1COc2ccccc2 34a_100000742786_100000695917 [0,1,0,0,0,1|2,0,0]=4 1646 B23R2.32080 COCCOCCNc1ccccc1COc2ccccc2 7a_100000742786_100000695917 [0,1,0,0,0,1|2,0,0]=4 1647 B23R2.32080 COCCOCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000695917 [0,1,0,0,0,1|2,0,0]=4 1648 B23R2.32080 COCCOCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000695917 [0,1,0,0,0,1|2,0,0]=4 1649 B23R2.32080 COCCOCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000695917 [0,1,0,0,0,1|2,0,0]=4 1650 B23R2.32080 COCCOCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000695917 [0,1,0,0,0,1|2,0,0]=4 1651 B23R2.32080 COCCOCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000695917 [0,1,0,0,0,1|1,0,0]=3 1652 B23R2.32080 COCCOCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000695917 [0,1,0,0,0,1|1,0,0]=3 1653 B23R2.32080 COCCOCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000695917 [0,1,0,0,0,1|1,1,0]=4 1654 B23R2.32080 COCCOCCSc1ccccc1OCc2ccccc2 62a_100000695917_100000151716 [0,1,0,0,0,1|1,1,0]=4 1655 B23R2.32080 FCCCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100015922095 [0,1,0,0,0,1|2,0,0]=4 1656 B23R2.32080 FCCCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100000729378 [0,1,0,0,0,1|2,0,0]=4 1657 B23R2.32080 FCCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000729378 [0,1,0,0,0,1|2,0,0]=4 1658 B23R2.32080 N#CCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100009813376 [0,1,0,0,0,1|1,0,1]=4 1659 B23R2.32080 N#CCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000211819 [0,1,0,0,0,1|2,0,0]=4 1660 B23R2.32080 N#CCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000211819 [0,1,0,0,0,1|2,0,0]=4 1661 B23R2.32080 O=CCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000139337 [0,1,0,0,0,1|1,0,1]=4 1662 B23R2.32080 O=CCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000139335 [0,1,0,0,0,1|2,0,0]=4 1663 B23R2.32080 O=CCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000139335 [0,1,0,0,0,1|2,0,0]=4 1664 B23R2.32080 OCCCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000766143 [0,1,0,0,0,1|2,0,0]=4 1665 B23R2.32080 OCCCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000766143 [0,1,0,0,0,1|2,0,0]=4 1666 B23R2.32080 OCCCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000766143 [0,1,0,0,0,1|2,0,0]=4 1667 B23R2.32080 OCCCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000766143 [0,1,0,0,0,1|2,0,0]=4 1668 B23R2.32080 OCCCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000766143 [0,1,0,0,0,1|2,0,0]=4 1669 B23R2.32080 OCCCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000766143 [0,1,0,0,0,1|2,0,0]=4 1670 B23R2.32080 OCCCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000766143 [0,1,0,0,0,1|2,0,0]=4 1671 B23R2.32080 OCCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000766143 [0,1,0,0,0,1|1,0,0]=3 1672 B23R2.32080 OCCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000766143 [0,1,0,0,0,1|1,0,0]=3 1673 B23R2.32080 OCCCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000766143 [0,1,0,0,0,1|1,1,0]=4 1674 B23R2.32080 OCCCCCCSc1ccccc1OCc2ccccc2 62a_100000766143_100000151716 [0,1,0,0,0,1|1,1,0]=4 1675 B23R2.32080 OCCCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100000746330 [0,1,0,0,0,1|2,0,0]=4 1676 B23R2.32080 OCCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000746330 [0,1,0,0,0,1|2,0,0]=4 1677 B23R2.32080 OCCCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100000746330 [0,1,0,0,0,1|2,0,0]=4 1678 B23R2.32080 OCCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000746330 [0,1,0,0,0,1|2,0,0]=4 1679 B23R2.42324 C#CCCCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100010269958 [0,1,0,0,0,1|1,0,1]=4 1680 B23R2.42324 C=CCCCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100011215482 [0,1,0,0,0,1|1,0,1]=4 1681 B23R2.42324 CCCCCCOc1ccccc1C(=O)Nc2ccccc2 34a_100000263231_100000210314 [0,1,0,0,0,1|1,0,1]=4 1682 B23R2.42324 CCCCCCOc1ccccc1C(=O)Nc2ccccc2 7a_100000263231_100000210314 [0,1,0,0,0,1|1,0,1]=4 1683 B23R2.42324 CCCCCCOc1ccccc1C(=O)Oc2ccccc2 7a_100005462448_100000210314 [0,1,0,0,0,1|1,0,1]=4 1684 B23R2.42324 CCCOCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100011215938 [0,1,0,0,0,1|2,0,0]=4 1685 B23R2.42324 CCOCCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100012232248 [0,1,0,0,0,1|2,0,0]=4 1686 B23R2.42324 COCCCCNc1ccccc1N(C)Cc2ccccc2 2230a_100000745351_100000730899 [0,1,0,0,0,1|2,0,0]=4 1687 B23R2.42324 COCCCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100000730899 [0,1,0,0,0,1|1,0,0]=3 1688 B23R2.42324 COCCCCOc1ccccc1C(=O)Nc2ccccc2 34a_100000263231_100000755781 [0,1,0,0,0,1|1,0,1]=4 1689 B23R2.42324 COCCCCOc1ccccc1C(=O)Nc2ccccc2 7a_100000263231_100000730899 [0,1,0,0,0,1|1,0,1]=4 1690 B23R2.42324 COCCCCOc1ccccc1C(=O)Oc2ccccc2 7a_100005462448_100000730899 [0,1,0,0,0,1|1,0,1]=4 1691 B23R2.42324 N#CCCCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100000211819 [0,1,0,0,0,1|2,0,0]=4 1692 B23R2.42324 O=C(Cc1ccccc1)c2ccccc2OCCCCCF 7a_100000040333_100000729378 [0,1,0,0,0,1|2,0,0]=4 1693 B23R2.42324 O=C(Cc1ccccc1)c2ccccc2OCCCCCO 7a_100000040333_100000746330 [0,1,0,0,0,1|2,0,0]=4 1694 B23R2.42324 O=CCCCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100000139335 [0,1,0,0,0,1|2,0,0]=4 1695 B23R2.62086 COCCCCC(=O)c1ccccc1CCc2ccccc2 1458a_100000610640_100000755781 [0,1,0,0,0,1|2,0,0]=4 1696 B23R2.62086 COCCCCC(=O)c1ccccc1COc2ccccc2 1458a_100000272412_100000755781 [0,1,0,0,0,1|2,0,0]=4 1697 B23R2.62086 COCCCCC(=O)c1ccccc1CSc2ccccc2 1458a_100000292687_100000755781 [0,1,0,0,0,1|2,0,0]=4 1698 B23R2.62086 COCCCCC(=O)c1ccccc1OCc2ccccc2 1458a_100000183716_100000755781 [0,1,0,0,0,1|2,0,0]=4 1699 B23R2.79607 COCCCCNc1cc(ccc1OCc2ccccc2)Br 2230a_200011228974_100000730899 [0,1,0,0,0,1|2,0,0]=4 1700 B23R2.79607 COCCCCNc1cc(ccc1OCc2ccccc2)Br 34a_200011228974_100000755781 [0,1,0,0,0,1|2,0,0]=4 1701 B23R2.79607 COCCCCNc1cc(ccc1OCc2ccccc2)Br 7a_200011228974_100000730899 [0,1,0,0,0,1|2,0,0]=4 1702 B23R2.79607 COCCCCSc1cc(ccc1OCc2ccccc2)F 62a_100000730899_200000151671 [0,1,0,0,0,1|1,1,0]=4 1703 B23R2.79607 COCCCCSc1cc(ccc1OCc2ccccc2)F 62a_200000151671_100000730899 [0,1,0,0,0,1|1,1,0]=4 1704 B23R2.186861 CC(=O)CCCCNc1ccccc1COc2ccccc2 34a_100000742786_100009817362 [0,1,0,0,0,1|2,0,0]=4 1705 B23R2.186861 CC(=O)CCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000735457 [0,1,0,0,0,1|2,0,0]=4 1706 B23R2.186861 CC(=O)CCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100009817362 [0,1,0,0,0,1|2,0,0]=4 1707 B23R2.186861 CC(=O)CCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100009817362 [0,1,0,0,0,1|2,0,0]=4 1708 B23R2.186861 CC(=O)CCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100009817362 [0,1,0,0,0,1|1,0,0]=3 1709 B23R2.186861 CC(=O)CCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000735457 [0,1,0,0,0,1|1,0,0]=3 1710 B23R2.186861 CC(=O)OCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000042594 [0,1,0,0,0,1|2,0,0]=4 1711 B23R2.186861 CC(=O)OCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000042594 [0,1,0,0,0,1|2,0,0]=4 1712 B23R2.186861 CC(=O)SCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000038929 [0,1,0,0,0,1|2,0,0]=4 1713 B23R2.186861 CC(=O)SCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000038929 [0,1,0,0,0,1|2,0,0]=4 1714 B23R2.186861 CC(=S)OCCCOc1ccccc1OCc2ccccc2 34a_100000187230_200135323944 [0,1,0,0,0,1|2,0,0]=4 1715 B23R2.186861 CC(=S)OCCCOc1ccccc1OCc2ccccc2 7a_100000187230_200135323944 [0,1,0,0,0,1|2,0,0]=4 1716 B23R2.186861 CC(C)CCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100011216152 [0,1,0,0,0,1|2,0,0]=4 1717 B23R2.186861 CN(C)CCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000690147 [0,1,0,0,0,1|0,1,0]=3 1718 B23R2.186861 CN(C)CCCCSc1cccnc1OCc2ccccc2 62a_200011465151_100000690147 [0,1,0,0,0,1|1,1,0]=4 1719 B23R2.186861 CN(C)CCCCSc1ncccc1OCc2ccccc2 62a_100011501402_100000690147 [0,1,0,0,0,1|1,1,0]=4 1720 B23R2.186861 CN(C)CCCNCc1ccccc1OCc2ccccc2 207a_102531767803_100000151772 [0,1,0,0,0,1|2,0,0]=4 1721 B23R2.186861 CN(C)CCCNCc1ccccc1OCc2ccccc2 270004a_102531767803_100000151772 [0,1,0,0,0,1|2,0,0]=4 1722 B23R2.186861 CN(C)CCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000757444 [0,1,0,0,0,1|2,0,0]=4 1723 B23R2.186861 CN(C)CCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000757444 [0,1,0,0,0,1|2,0,0]=4 1724 B23R2.186861 CN(C)CCOCCc1ccccc1OCc2ccccc2 7a_100000721452_100000755713 [0,1,0,0,0,1|2,0,0]=4 1725 B23R2.186861 OB(O)CCCCOc1ccccc1OCc2ccccc2 34a_100000187230_200009817182 [0,1,0,0,0,1|2,0,0]=4 1726 B23R2.186861 OB(O)CCCCOc1ccccc1OCc2ccccc2 7a_100000187230_200009817182 [0,1,0,0,0,1|2,0,0]=4 1727 B23R2.794954 COCCCCNc1ccccc1SCc2ccccc2F 34a_100015187786_100000755781 [0,1,0,0,0,1|2,0,0]=4 1728 B23R2.794954 COCCCCNc1ccccc1SCc2ccccc2F 7a_100015187786_100000730899 [0,1,0,0,0,1|2,0,0]=4 1729 B23R2.925149 COCCCCNc1cccc(c1OCc2ccccc2)F 2230a_100013039107_100000730899 [0,1,0,0,0,1|2,0,0]=4 1730 B23R2.925149 COCCCCNc1cccc(c1OCc2ccccc2)F 34a_100013039107_100000755781 [0,1,0,0,0,1|2,0,0]=4 1731 B23R2.925205 CCCCCCOc1ccccc1CNc2cc(ccn2)C 34a_100005794344_100000210314 [0,1,0,0,0,1|2,0,0]=4 1732 B23R2.925205 CCCCCCOc1ccccc1CNc2cc(ccn2)C 7a_100005794344_100000210314 [0,1,0,0,0,1|2,0,0]=4 1733 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)O 270302a_100000210217_200000189357 [0,1,0,0,0,1|1,0,0]=3 1734 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(n2)C 34a_100005731527_100000210314 [0,1,0,0,0,1|2,0,0]=4 1735 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(n2)C 7a_100005731527_100000210314 [0,1,0,0,0,1|2,0,0]=4 1736 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)F 2230a_100015187172_100000730899 [0,1,0,0,0,1|2,0,0]=4 1737 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)F 34a_100015187172_100000755781 [0,1,0,0,0,1|2,0,0]=4 1738 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)F 7a_100015187172_100000730899 [0,1,0,0,0,1|2,0,0]=4 1739 B23R2.925205 COCCCCOc1ccccc1CNc2cc(ccn2)C 34a_100005794344_100000755781 [0,1,0,0,0,1|2,0,0]=4 1740 B23R2.925205 COCCCCOc1ccccc1CNc2cc(ccn2)C 7a_100005794344_100000730899 [0,1,0,0,0,1|2,0,0]=4 1741 B23R2.925205 COCCCCOc1ccccc1CNc2cccc(n2)C 34a_100005731527_100000755781 [0,1,0,0,0,1|2,0,0]=4 1742 B23R2.925205 COCCCCOc1ccccc1CNc2cccc(n2)C 7a_100005731527_100000730899 [0,1,0,0,0,1|2,0,0]=4 1743 B23R2.472094 CN(C)CCCC(=O)Nc1ccccc1Cc2ccccc2 11a_100000211252_100000740757 [0,2,0,0,0,0|1,0,1]=4 1744 B23R2.472094 CN(C)CCCC(=O)Nc1ccccc1Cc2ccccc2 22a_100000211252_100000740757 [0,2,0,0,0,0|1,0,1]=4 1745 B23R2.472094 CN(C)CCCN(C)Cc1ccccc1Cc2ccccc2 269982a_100000225831_100010254464 [0,2,0,0,0,0|2,0,0]=4 1746 B23R2.472094 CN(C)CCCN(C)Cc1ccccc1Cc2ccccc2 270004a_100000225831_100009842342 [0,2,0,0,0,0|2,0,0]=4 1747 B23R2.768 CCCCCC(=O)CNc1ccccc1Cc2ccccc2 2230a_100000211252_200012276598 [0,2,0,0,0,0|2,0,0]=4 1748 B23R2.768 CCCCCC(=O)CNc1ccccc1Cc2ccccc2 34a_100000211252_200012276598 [0,2,0,0,0,0|2,0,0]=4 1749 B23R2.768 CCCCCC(=O)CNc1ccccc1Cc2ccccc2 7a_100000211252_200012276598 [0,2,0,0,0,0|2,0,0]=4 1750 B23R2.768 CCCCCC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_200012276598 [0,2,0,0,0,0|1,0,0]=3 1751 B23R2.768 CCCCCC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_200012276598 [0,2,0,0,0,0|1,0,0]=3 1752 B23R2.768 CCCCNC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000182744 [0,2,0,0,0,0|1,0,1]=4 1753 B23R2.768 CCCCNC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000182744 [0,2,0,0,0,0|1,0,1]=4 1754 B23R2.768 CCCCOC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000211628 [0,2,0,0,0,0|1,0,1]=4 1755 B23R2.768 CCCCOC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000211628 [0,2,0,0,0,0|1,0,1]=4 1756 B23R2.768 COCCCC(C)OCc1ccccc1Cc2ccccc2 34a_200011539412_100010254464 [0,2,0,0,0,0|1,0,0]=3 1757 B23R2.768 COCCCC(C)OCc1ccccc1Cc2ccccc2 7a_200011539412_100010254464 [0,2,0,0,0,0|1,0,0]=3 1758 B23R2.768 COCCCC(C)OCc1ccccc1Oc2ccccc2 7a_200011539412_100000199117 [0,2,0,0,0,0|2,0,0]=4 1759 B23R2.768 COCCNC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000183275 [0,2,0,0,0,0|1,0,1]=4 1760 B23R2.768 COCCNC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000183275 [0,2,0,0,0,0|1,0,1]=4 1761 B23R2.768 COCCOC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_200000040189 [0,2,0,0,0,0|1,0,1]=4 1762 B23R2.768 COCCOC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_200000040189 [0,2,0,0,0,0|1,0,1]=4 1763 B23R2.9754 COCCOCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000695917 [0,2,0,0,0,0|1,0,0]=3 1764 B23R2.9754 COCCOCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000695917 [0,2,0,0,0,0|1,0,0]=3 1765 B23R2.9754 OCCCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000766143 [0,2,0,0,0,0|1,0,0]=3 1766 B23R2.9754 OCCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000766143 [0,2,0,0,0,0|1,0,0]=3 1767 B23R2.22871 CCC[C@H](N)CCOCc1ccccc1Cc2ccccc2 34a_100015193777_100010254464 [0,2,0,0,0,0|1,0,0]=3 1768 B23R2.22871 CCOC(=O)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100009991533 [0,2,0,0,0,0|1,0,1]=4 1769 B23R2.22871 CCOC(=O)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011215271 [0,2,0,0,0,0|1,0,1]=4 1770 B23R2.27394 CCN(C)CCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100015186262 [0,2,0,0,0,0|2,0,0]=4 1771 B23R2.27394 CNC(=O)CCCNCc1ccccc1Cc2ccccc2 207a_100000740002_100009842342 [0,2,0,0,0,0|1,0,1]=4 1772 B23R2.27394 CNC(=O)CCCNCc1ccccc1Cc2ccccc2 2230a_100000740002_100010254464 [0,2,0,0,0,0|1,0,1]=4 1773 B23R2.27394 CNC(=O)CCCNCc1ccccc1Cc2ccccc2 270004a_100000740002_100009842342 [0,2,0,0,0,0|1,0,1]=4 1774 B23R2.27394 CNC(=O)CCCNCc1ccccc1Cc2ccccc2 34a_100000740002_100010254464 [0,2,0,0,0,0|1,0,1]=4 1775 B23R2.27394 CNC(=O)CCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000741757 [0,2,0,0,0,0|1,0,1]=4 1776 B23R2.27394 CNC(=O)CCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000741757 [0,2,0,0,0,0|1,0,1]=4 1777 B23R2.27394 CNC(=O)CCCSCc1ccccc1Cc2ccccc2 62a_100000741757_100010254464 [0,2,0,0,0,0|0,1,1]=4 1778 B23R2.27394 CNC(=O)CCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000741757 [0,2,0,0,0,0|0,1,1]=4 1779 B23R2.27394 COC(=O)CCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000204269 [0,2,0,0,0,0|2,0,0]=4 1780 B23R2.27394 COC(=O)CCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000204269 [0,2,0,0,0,0|2,0,0]=4 1781 B23R2.27394 COC(=O)CCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000204269 [0,2,0,0,0,0|2,0,0]=4 1782 B23R2.27394 COC(=O)CCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000204269 [0,2,0,0,0,0|1,0,0]=3 1783 B23R2.27394 COC(=O)CCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000204269 [0,2,0,0,0,0|1,0,0]=3 1784 B23R2.27394 COC(=O)CCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000204269 [0,2,0,0,0,0|2,0,0]=4 1785 B23R2.27394 COC(=O)CCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000204269 [0,2,0,0,0,0|2,0,0]=4 1786 B23R2.27394 COC(=O)CCCCSc1ccccc1Cc2ccccc2 62a_100000204269_200011216382 [0,2,0,0,0,0|1,1,0]=4 1787 B23R2.27394 COC(=O)CCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000204269 [0,2,0,0,0,0|1,1,0]=4 1788 B23R2.27394 COC(=O)COCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000090808 [0,2,0,0,0,0|1,0,1]=4 1789 B23R2.27394 COC(=O)COCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000090808 [0,2,0,0,0,0|1,0,1]=4 1790 B23R2.27394 C[C@@H](CN)CCCOCc1ccccc1Cc2ccccc2 34a_100160569302_100010254464 [0,2,0,0,0,0|2,0,0]=4 1791 B23R2.27394 NNC(=O)CCCOCc1ccccc1Cc2ccccc2 34a_100000211488_100010254464 [0,2,0,0,0,0|1,0,1]=4 1792 B23R2.28636 C#CCCCCCOCc1ccccc1Cc2ccccc2 34a_100000766912_100010254464 [0,2,0,0,0,0|1,0,1]=4 1793 B23R2.28636 C#CCCCCCOCc1ccccc1Cc2ccccc2 7a_100000766912_100010254464 [0,2,0,0,0,0|1,0,1]=4 1794 B23R2.28636 C=COCCCCOCc1ccccc1Cc2ccccc2 34a_100000031558_100010254464 [0,2,0,0,0,0|1,0,1]=4 1795 B23R2.28636 C=COCCCCOCc1ccccc1Cc2ccccc2 7a_100000031558_100010254464 [0,2,0,0,0,0|1,0,1]=4 1796 B23R2.28636 CCCC#CCCOCc1ccccc1Cc2ccccc2 34a_100000042726_100010254464 [0,2,0,0,0,0|1,0,1]=4 1797 B23R2.28636 CCCC#CCCOCc1ccccc1Cc2ccccc2 7a_100000042726_100010254464 [0,2,0,0,0,0|1,0,1]=4 1798 B23R2.28636 CCCCC#CCOCc1ccccc1Cc2ccccc2 34a_200000034558_100010254464 [0,2,0,0,0,0|1,0,1]=4 1799 B23R2.28636 CCCCC#CCOCc1ccccc1Cc2ccccc2 7a_200000034558_100010254464 [0,2,0,0,0,0|1,0,1]=4 1800 B23R2.28636 CCCCOCCOCc1ccccc1Cc2ccccc2 34a_100000210238_100010254464 [0,2,0,0,0,0|1,0,0]=3 1801 B23R2.28636 CCCCOCCOCc1ccccc1Cc2ccccc2 7a_100000210238_100010254464 [0,2,0,0,0,0|1,0,0]=3 1802 B23R2.28636 CCCCOCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000743108 [0,2,0,0,0,0|2,0,0]=4 1803 B23R2.28636 CCCCOCCOCc1ccccc1Oc2ccccc2 7a_100000210238_100000199117 [0,2,0,0,0,0|2,0,0]=4 1804 B23R2.28636 CCCCOCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000743108 [0,2,0,0,0,0|2,0,0]=4 1805 B23R2.28636 CCCCSCCNCc1ccccc1Cc2ccccc2 207a_100025743550_100009842342 [0,2,0,0,0,0|2,0,0]=4 1806 B23R2.28636 CCCCSCCNCc1ccccc1Cc2ccccc2 2230a_100025743550_100010254464 [0,2,0,0,0,0|2,0,0]=4 1807 B23R2.28636 CCCCSCCNCc1ccccc1Cc2ccccc2 270004a_100025743550_100009842342 [0,2,0,0,0,0|2,0,0]=4 1808 B23R2.28636 CCCOCCCNCc1ccccc1Cc2ccccc2 207a_100011217757_100009842342 [0,2,0,0,0,0|2,0,0]=4 1809 B23R2.28636 CCCOCCCNCc1ccccc1Cc2ccccc2 2230a_100011217757_100010254464 [0,2,0,0,0,0|2,0,0]=4 1810 B23R2.28636 CCCOCCCNCc1ccccc1Cc2ccccc2 270004a_100011217757_100009842342 [0,2,0,0,0,0|2,0,0]=4 1811 B23R2.28636 CCCOCCCNCc1ccccc1Cc2ccccc2 34a_100011217757_100010254464 [0,2,0,0,0,0|2,0,0]=4 1812 B23R2.28636 CCOCCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011211534 [0,2,0,0,0,0|2,0,0]=4 1813 B23R2.28636 CCOCCOCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011211534 [0,2,0,0,0,0|2,0,0]=4 1814 B23R2.28636 CCOCCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011211534 [0,2,0,0,0,0|2,0,0]=4 1815 B23R2.28636 CCOCCOCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011211534 [0,2,0,0,0,0|1,0,0]=3 1816 B23R2.28636 CCOCCOCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011211534 [0,2,0,0,0,0|1,0,0]=3 1817 B23R2.28636 CCOCCOCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011211534 [0,2,0,0,0,0|2,0,0]=4 1818 B23R2.28636 CCOCCOCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011211534 [0,2,0,0,0,0|2,0,0]=4 1819 B23R2.28636 CCOCCOCCSc1ccccc1Cc2ccccc2 62a_100011211534_200011216382 [0,2,0,0,0,0|1,1,0]=4 1820 B23R2.28636 CCOCCOCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011211534 [0,2,0,0,0,0|1,1,0]=4 1821 B23R2.28636 CNCCCCCOCc1ccccc1Cc2ccccc2 34a_100000722520_100010254464 [0,2,0,0,0,0|0,0,0]=2 1822 B23R2.28636 CNCCOCCOCc1ccccc1Cc2ccccc2 34a_100000228057_100010254464 [0,2,0,0,0,0|0,0,0]=2 1823 B23R2.28636 COCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011998445 [0,2,0,0,0,0|2,0,0]=4 1824 B23R2.28636 COCCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011998445 [0,2,0,0,0,0|2,0,0]=4 1825 B23R2.28636 COCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011998445 [0,2,0,0,0,0|2,0,0]=4 1826 B23R2.28636 COCCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011998445 [0,2,0,0,0,0|1,0,0]=3 1827 B23R2.28636 COCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011998445 [0,2,0,0,0,0|1,0,0]=3 1828 B23R2.28636 COCCCCCNCc1ccccc1Cc2ccccc2 207a_100000747528_100009842342 [0,2,0,0,0,0|2,0,0]=4 1829 B23R2.28636 COCCCCCNCc1ccccc1Cc2ccccc2 2230a_100000747528_100010254464 [0,2,0,0,0,0|2,0,0]=4 1830 B23R2.28636 COCCCCCNCc1ccccc1Cc2ccccc2 270004a_100000747528_100009842342 [0,2,0,0,0,0|2,0,0]=4 1831 B23R2.28636 COCCCCCNCc1ccccc1Cc2ccccc2 34a_100000747528_100010254464 [0,2,0,0,0,0|2,0,0]=4 1832 B23R2.28636 COCCOCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011216529 [0,2,0,0,0,0|2,0,0]=4 1833 B23R2.28636 COCCOCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011216529 [0,2,0,0,0,0|2,0,0]=4 1834 B23R2.28636 COCCOCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011216529 [0,2,0,0,0,0|2,0,0]=4 1835 B23R2.28636 COCCOCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011216529 [0,2,0,0,0,0|1,0,0]=3 1836 B23R2.28636 COCCOCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011216529 [0,2,0,0,0,0|1,0,0]=3 1837 B23R2.28636 COCCOCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011216529 [0,2,0,0,0,0|2,0,0]=4 1838 B23R2.28636 COCCOCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011216529 [0,2,0,0,0,0|2,0,0]=4 1839 B23R2.28636 COCCOCCCSc1ccccc1Cc2ccccc2 62a_100011216529_200011216382 [0,2,0,0,0,0|1,1,0]=4 1840 B23R2.28636 COCCOCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011216529 [0,2,0,0,0,0|1,1,0]=4 1841 B23R2.28636 COCCOCCNCc1ccccc1Cc2ccccc2 207a_100000745349_100009842342 [0,2,0,0,0,0|2,0,0]=4 1842 B23R2.28636 COCCOCCNCc1ccccc1Cc2ccccc2 2230a_100000745349_100010254464 [0,2,0,0,0,0|2,0,0]=4 1843 B23R2.28636 COCCOCCNCc1ccccc1Cc2ccccc2 270004a_100000745349_100009842342 [0,2,0,0,0,0|2,0,0]=4 1844 B23R2.28636 COCCOCCNCc1ccccc1Cc2ccccc2 34a_100000745349_100010254464 [0,2,0,0,0,0|2,0,0]=4 1845 B23R2.28636 COCCOCCOCc1ccccc1Cc2ccccc2 34a_100011215163_100010254464 [0,2,0,0,0,0|1,0,0]=3 1846 B23R2.28636 COCCOCCOCc1ccccc1Cc2ccccc2 7a_100011215163_100010254464 [0,2,0,0,0,0|1,0,0]=3 1847 B23R2.28636 COCCOCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000695917 [0,2,0,0,0,0|2,0,0]=4 1848 B23R2.28636 COCCOCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000695917 [0,2,0,0,0,0|2,0,0]=4 1849 B23R2.28636 COCCOCCOCc1ccccc1Oc2ccccc2 7a_100011215163_100000199117 [0,2,0,0,0,0|2,0,0]=4 1850 B23R2.28636 COCCOCCSCc1ccccc1Cc2ccccc2 62a_100000695917_100010254464 [0,2,0,0,0,0|1,1,0]=4 1851 B23R2.28636 COCCOCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000695917 [0,2,0,0,0,0|1,1,0]=4 1852 B23R2.28636 NCCCCCCOCc1ccccc1Cc2ccccc2 34a_100000686447_100010254464 [0,2,0,0,0,0|1,0,0]=3 1853 B23R2.28636 OCCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000760002 [0,2,0,0,0,0|2,0,0]=4 1854 B23R2.28636 OCCCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000760002 [0,2,0,0,0,0|2,0,0]=4 1855 B23R2.28636 OCCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000760002 [0,2,0,0,0,0|2,0,0]=4 1856 B23R2.28636 OCCCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000760002 [0,2,0,0,0,0|1,0,0]=3 1857 B23R2.28636 OCCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000760002 [0,2,0,0,0,0|1,0,0]=3 1858 B23R2.28636 OCCCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000760002 [0,2,0,0,0,0|2,0,0]=4 1859 B23R2.28636 OCCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000760002 [0,2,0,0,0,0|2,0,0]=4 1860 B23R2.28636 OCCCCCCNCc1ccccc1Cc2ccccc2 207a_100000686447_100009842342 [0,2,0,0,0,0|2,0,0]=4 1861 B23R2.28636 OCCCCCCNCc1ccccc1Cc2ccccc2 2230a_100000686447_100010254464 [0,2,0,0,0,0|2,0,0]=4 1862 B23R2.28636 OCCCCCCNCc1ccccc1Cc2ccccc2 270004a_100000686447_100009842342 [0,2,0,0,0,0|2,0,0]=4 1863 B23R2.28636 OCCCCCCNCc1ccccc1Cc2ccccc2 34a_100000686447_100010254464 [0,2,0,0,0,0|2,0,0]=4 1864 B23R2.28636 OCCCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000766143 [0,2,0,0,0,0|2,0,0]=4 1865 B23R2.28636 OCCCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000766143 [0,2,0,0,0,0|2,0,0]=4 1866 B23R2.29520 CC(=O)CCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100009817362 [0,2,0,0,0,0|2,0,0]=4 1867 B23R2.29520 CC(=O)CCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000735457 [0,2,0,0,0,0|2,0,0]=4 1868 B23R2.29520 CC(=O)NCCCNCc1ccccc1Cc2ccccc2 207a_100000736810_100009842342 [0,2,0,0,0,0|2,0,0]=4 1869 B23R2.29520 CC(=O)NCCCNCc1ccccc1Cc2ccccc2 270004a_100000736810_100009842342 [0,2,0,0,0,0|2,0,0]=4 1870 B23R2.29520 CC(=O)NCCCNCc1ccccc1Cc2ccccc2 34a_100000736810_100010254464 [0,2,0,0,0,0|2,0,0]=4 1871 B23R2.29520 CC(=O)NCCCOCc1ccccc1Cc2ccccc2 34a_100000752032_100010254464 [0,2,0,0,0,0|2,0,0]=4 1872 B23R2.29520 CC(=O)OCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000033659 [0,2,0,0,0,0|2,0,0]=4 1873 B23R2.29520 CC(=O)OCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000033659 [0,2,0,0,0,0|2,0,0]=4 1874 B23R2.29520 CC(=O)OCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000033659 [0,2,0,0,0,0|1,0,0]=3 1875 B23R2.29520 CC(=O)OCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000033659 [0,2,0,0,0,0|1,0,0]=3 1876 B23R2.29520 CC(=O)OCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000033659 [0,2,0,0,0,0|2,0,0]=4 1877 B23R2.29520 CC(=O)OCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000033659 [0,2,0,0,0,0|2,0,0]=4 1878 B23R2.29520 CC(=O)OCCCCSc1ccccc1Cc2ccccc2 62a_100000033659_200011216382 [0,2,0,0,0,0|1,1,0]=4 1879 B23R2.29520 CC(=O)OCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000033659 [0,2,0,0,0,0|1,1,0]=4 1880 B23R2.29520 CC(=O)OCCOCOc1ccccc1Cc2ccccc2 34a_100000211249_100000076355 [0,2,0,0,0,0|2,0,0]=4 1881 B23R2.29520 CC(=O)SCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_200010402107 [0,2,0,0,0,0|2,0,0]=4 1882 B23R2.29520 CC(=O)SCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_200010402107 [0,2,0,0,0,0|2,0,0]=4 1883 B23R2.29520 CC(=O)SCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_200010402107 [0,2,0,0,0,0|2,0,0]=4 1884 B23R2.29520 CC(=O)SCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_200010402107 [0,2,0,0,0,0|1,0,0]=3 1885 B23R2.29520 CC(=O)SCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_200010402107 [0,2,0,0,0,0|1,0,0]=3 1886 B23R2.29520 CC(=O)SCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_200010402107 [0,2,0,0,0,0|2,0,0]=4 1887 B23R2.29520 CC(=O)SCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_200010402107 [0,2,0,0,0,0|2,0,0]=4 1888 B23R2.29520 CC(C)CNCCOCc1ccccc1Cc2ccccc2 34a_100015185251_100010254464 [0,2,0,0,0,0|2,0,0]=4 1889 B23R2.29520 CC(C)COCCOCc1ccccc1Cc2ccccc2 34a_100000703358_100010254464 [0,2,0,0,0,0|2,0,0]=4 1890 B23R2.29520 CC(C)COCCOCc1ccccc1Cc2ccccc2 7a_100000703358_100010254464 [0,2,0,0,0,0|2,0,0]=4 1891 B23R2.29520 CC(C)NCCCOCc1ccccc1Cc2ccccc2 34a_100000182298_100010254464 [0,2,0,0,0,0|2,0,0]=4 1892 B23R2.29520 CN(C)CCCCNCc1ccccc1Cc2ccccc2 207a_100025707445_100009842342 [0,2,0,0,0,0|1,0,0]=3 1893 B23R2.29520 CN(C)CCCCNCc1ccccc1Oc2ccccc2 207a_100025707445_100011234122 [0,2,0,0,0,0|2,0,0]=4 1894 B23R2.29520 CN(C)CCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000690147 [0,2,0,0,0,0|0,1,0]=3 1895 B23R2.29520 NC(=O)CCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100009817443 [0,2,0,0,0,0|1,0,1]=4 1896 B23R2.29520 NC(=O)CCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100009817443 [0,2,0,0,0,0|1,0,1]=4 1897 B23R2.29520 NC(=O)CCCCOCc1ccccc1Cc2ccccc2 34a_100012022536_100010254464 [0,2,0,0,0,0|2,0,0]=4 1898 B23R2.29520 NC(=O)CCCCOCc1ccccc1Cc2ccccc2 7a_100012022536_100010254464 [0,2,0,0,0,0|2,0,0]=4 1899 B23R2.29520 O=[N+]([O-])CCCCOCc1ccccc1Cc2ccccc2 34a_200015379883_100010254464 [0,2,0,0,0,0|1,0,1]=4 1900 B23R2.29520 O=[N+]([O-])CCCCOCc1ccccc1Cc2ccccc2 7a_200015379883_100010254464 [0,2,0,0,0,0|1,0,1]=4 1901 B23R2.29520 O=[N+]([O-])OCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100015694321 [0,2,0,0,0,0|1,0,1]=4 1902 B23R2.29520 O=[N+]([O-])OCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100015694321 [0,2,0,0,0,0|1,0,1]=4 1903 B23R2.29520 OB(O)CCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_200009817188 [0,2,0,0,0,0|2,0,0]=4 1904 B23R2.29520 OB(O)CCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_200009817188 [0,2,0,0,0,0|2,0,0]=4 1905 B23R2.33313 CCCC[C@H](N)COCc1ccccc1Cc2ccccc2 34a_100011934283_100010254464 [0,2,0,0,0,0|1,0,0]=3 1906 B23R2.33313 COCO[C@H](C)COCc1ccccc1Cc2ccccc2 34a_100016172286_100010254464 [0,2,0,0,0,0|2,0,0]=4 1907 B23R2.33313 COCO[C@H](C)COCc1ccccc1Cc2ccccc2 7a_100016172286_100010254464 [0,2,0,0,0,0|2,0,0]=4 1908 B23R2.33313 CSCC[C@H](N)COCc1ccccc1Cc2ccccc2 34a_100011827619_100010254464 [0,2,0,0,0,0|1,0,0]=3 1909 B23R2.186195 CCCCCCNC(=O)c1ccccc1Cc2ccccc2 11a_100000210581_100000211042 [0,2,0,0,0,0|2,0,0]=4 1910 B23R2.186195 CCCCCCNC(=O)c1ccccc1Cc2ccccc2 1626a_100000210581_100000211042 [0,2,0,0,0,0|2,0,0]=4 1911 B23R2.186195 CCCCCCNC(=O)c1ccccc1Cc2ccccc2 240690a_100000210581_100000211042 [0,2,0,0,0,0|2,0,0]=4 1912 B23R2.186195 CCCCCCNC(=O)c1ccccc1Cc2ccccc2 527a_100000210581_100000211042 [0,2,0,0,0,0|2,0,0]=4 1913 B23R2.186195 CCCCOCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000743108 [0,2,0,0,0,0|2,0,0]=4 1914 B23R2.186195 COCCOCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000695917 [0,2,0,0,0,0|2,0,0]=4 1915 B23R2.186195 O=C(CCCCCCO)c1ccccc1Cc2ccccc2 1458a_100000211042_100000766143 [0,2,0,0,0,0|2,0,0]=4 1916 B23R2.939005 CCCCOCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000743108 [0,2,0,0,0,0|2,0,0]=4 1917 B23R2.939005 CCCCOCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000743108 [0,2,0,0,0,0|2,0,0]=4 1918 B23R2.939005 CCCCOCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000743108 [0,2,0,0,0,0|2,0,0]=4 1919 B23R2.939005 CCCCOCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000743108 [0,2,0,0,0,0|1,0,1]=4 1920 B23R2.939005 CCCCOCCSc1ccccc1C(N)c2ccccc2 62a_100000743108_100011211563 [0,2,0,0,0,0|1,1,0]=4 1921 B23R2.939005 CCCCOCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000743108 [0,2,0,0,0,0|1,1,0]=4 1922 B23R2.939005 COCCOCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000695917 [0,2,0,0,0,0|2,0,0]=4 1923 B23R2.939005 COCCOCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000695917 [0,2,0,0,0,0|2,0,0]=4 1924 B23R2.939005 COCCOCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000695917 [0,2,0,0,0,0|2,0,0]=4 1925 B23R2.939005 COCCOCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000695917 [0,2,0,0,0,0|1,0,1]=4 1926 B23R2.939005 COCCOCCSc1ccccc1C(N)c2ccccc2 62a_100000695917_100011211563 [0,2,0,0,0,0|1,1,0]=4 1927 B23R2.939005 COCCOCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000695917 [0,2,0,0,0,0|1,1,0]=4 1928 B23R2.939005 NC(c1ccccc1)c2ccccc2SCCCCCCO 62a_100000766143_100011211563 [0,2,0,0,0,0|1,1,0]=4 1929 B23R2.939005 NC(c1ccccc1)c2ccccc2SCCCCCCO 62a_100011211563_100000766143 [0,2,0,0,0,0|1,1,0]=4 1930 B23R2.939005 O=C(c1ccccc1)c2ccccc2OCCCCCCF 7a_100011215220_100015922095 [0,2,0,0,0,0|1,0,1]=4 1931 B23R2.939005 O=C(c1ccccc1)c2ccccc2OCCCCCCO 7a_100011215220_100000766143 [0,2,0,0,0,0|1,0,1]=4 1932 B23R2.939005 OC(c1ccccc1)c2ccccc2NCCCCCCF 2230a_100000246470_100015922095 [0,2,0,0,0,0|2,0,0]=4 1933 B23R2.939005 OC(c1ccccc1)c2ccccc2NCCCCCCF 34a_100000246470_100015922095 [0,2,0,0,0,0|2,0,0]=4 1934 B23R2.939005 OC(c1ccccc1)c2ccccc2NCCCCCCF 7a_100000246470_100015922095 [0,2,0,0,0,0|2,0,0]=4 1935 B23R2.939005 OCCCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000766143 [0,2,0,0,0,0|2,0,0]=4 1936 B23R2.939005 OCCCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000766143 [0,2,0,0,0,0|2,0,0]=4 1937 B23R2.939005 OCCCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000766143 [0,2,0,0,0,0|2,0,0]=4 1938 B23R2.58972 C[Si](C)(C)CCOCOc1ccccc1Cc2ccccc2 34a_100000211249_100000032501 [0,2,0,0,0,0|2,0,0]=4 1939 B23R2.60464 CC(=O)OCC(O)COc1ccccc1Cc2ccccc2 34a_100000211249_200000139349 [0,2,0,0,0,0|2,0,0]=4 1940 B23R2.60464 CC(=O)OCC(O)COc1ccccc1Cc2ccccc2 7a_100000211249_200000139349 [0,2,0,0,0,0|2,0,0]=4 1941 B23R2.60464 CC(=O)SCC(C)COc1ccccc1Cc2ccccc2 34a_100000211249_200000116872 [0,2,0,0,0,0|2,0,0]=4 1942 B23R2.60464 CC(=O)SCC(C)COc1ccccc1Cc2ccccc2 7a_100000211249_200000116872 [0,2,0,0,0,0|2,0,0]=4 1943 B23R2.183410 CC(=O)OCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000042594 [0,2,0,0,0,0|2,0,0]=4 1944 B23R2.183410 CC(=O)OCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000042594 [0,2,0,0,0,0|2,0,0]=4 1945 B23R2.183410 CC(=O)SCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000038929 [0,2,0,0,0,0|2,0,0]=4 1946 B23R2.183410 CC(=O)SCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000038929 [0,2,0,0,0,0|2,0,0]=4 1947 B23R2.183410 OB(O)CCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_200009817182 [0,2,0,0,0,0|2,0,0]=4 1948 B23R2.183410 OB(O)CCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_200009817182 [0,2,0,0,0,0|2,0,0]=4 1949 B23R2.471020 CC(=O)CCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000735457 [0,2,0,0,0,0|2,0,0]=4 1950 B23R2.471020 CN(C)CCCNC(=O)c1ccccc1Cc2ccccc2 240690a_102531767803_100000211042 [0,2,0,0,0,0|2,0,0]=4 1951 B23R2.471020 CN(C)CCCNC(=O)c1ccccc1Cc2ccccc2 527a_102531767803_100000211042 [0,2,0,0,0,0|2,0,0]=4 1952 B23R2.472247 CC(=O)CCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100009817362 [0,2,0,0,0,0|2,0,0]=4 1953 B23R2.472247 CC(=O)CCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000735457 [0,2,0,0,0,0|2,0,0]=4 1954 B23R2.472247 CC(=O)CCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000735457 [0,2,0,0,0,0|1,0,1]=4 1955 B23R2.472247 CC(=O)CCCCSc1ccccc1C(N)c2ccccc2 62a_100000735457_100011211563 [0,2,0,0,0,0|1,1,0]=4 1956 B23R2.472247 CC(=O)CCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000735457 [0,2,0,0,0,0|1,1,0]=4 1957 B23R2.472247 CN(C)CCCCNc1ccccc1C(=O)c2ccccc2 27a_100025707445_100000198044 [0,2,0,0,0,0|1,0,1]=4 1958 B23R2.472247 CN(C)CCCCSc1ccccc1C(=O)c2ccccc2 62a_100000198044_100000690147 [0,2,0,0,0,0|0,1,1]=4 1959 B23R2.472247 CN(C)CCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000690147 [0,2,0,0,0,0|0,1,0]=3 1960 B23R2.474503 CC(CSCc1ccccc1Cc2ccccc2)CN(C)C 62a_100010254464_100015348159 [0,2,0,0,0,0|2,0,0]=4 1961 B23R2.474503 CC(CSCc1ccccc1Cc2ccccc2)CN(C)C 62a_100015348159_100010254464 [0,2,0,0,0,0|2,0,0]=4 1962 B23R2.477240 CN(C)C(=O)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000737642 [0,2,0,0,0,0|1,0,1]=4 1963 B23R2.477240 CN(C)C(=O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000737642 [0,2,0,0,0,0|1,0,1]=4 1964 B23R2.477240 CN(C)C(=O)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000737642 [0,2,0,0,0,0|0,0,1]=3 1965 B23R2.477240 CN(C)C(=O)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000737642 [0,2,0,0,0,0|1,0,1]=4 1966 B23R2.477240 CN(C)C(=O)CCCSc1ccccc1Cc2ccccc2 62a_100000737642_200011216382 [0,2,0,0,0,0|0,1,1]=4 1967 B23R2.477240 CN(C)C(=O)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000737642 [0,2,0,0,0,0|0,1,1]=4 1968 B23R2.11107 CC(C)(C#N)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000759902 [0,2,0,0,0,0|2,0,0]=4 1969 B23R2.11107 CC(C)(C#N)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000759902 [0,2,0,0,0,0|2,0,0]=4 1970 B23R2.15730 CCN(CC)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000709985 [0,2,0,0,0,0|2,0,0]=4 1971 B23R2.15730 COC(CCCNc1ccccc1Cc2ccccc2)OC 2230a_100000211252_100000069011 [0,2,0,0,0,0|2,0,0]=4 1972 B23R2.15730 COC(CCCNc1ccccc1Cc2ccccc2)OC 34a_100000211252_100000069011 [0,2,0,0,0,0|2,0,0]=4 1973 B23R2.15730 COC(CCCNc1ccccc1Cc2ccccc2)OC 7a_100000211252_100000069011 [0,2,0,0,0,0|2,0,0]=4 1974 B23R2.15730 COC(CCCOc1ccccc1Cc2ccccc2)OC 34a_100000211249_100000069011 [0,2,0,0,0,0|1,0,0]=3 1975 B23R2.15730 COC(CCCOc1ccccc1Cc2ccccc2)OC 7a_100000211249_100000069011 [0,2,0,0,0,0|1,0,0]=3 1976 B23R2.15730 COC(CCCOc1ccccc1Oc2ccccc2)OC 34a_100000074787_100000069011 [0,2,0,0,0,0|2,0,0]=4 1977 B23R2.15730 COC(CCCOc1ccccc1Oc2ccccc2)OC 7a_100000074787_100000069011 [0,2,0,0,0,0|2,0,0]=4 1978 B23R2.15730 COC(CCCSc1ccccc1Cc2ccccc2)OC 62a_100000069011_200011216382 [0,2,0,0,0,0|1,1,0]=4 1979 B23R2.15730 COC(CCCSc1ccccc1Cc2ccccc2)OC 62a_200011216382_100000069011 [0,2,0,0,0,0|1,1,0]=4 1980 B23R2.21961 COC(=O)C[C@@H](O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000754131 [0,2,0,0,0,0|1,0,1]=4 1981 B23R2.21961 COC(=O)C[C@@H](O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000754131 [0,2,0,0,0,0|1,0,1]=4 1982 B23R2.30127 CCN(C)CCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100015186262 [0,2,0,0,0,0|2,0,0]=4 1983 B23R2.30127 CNC(=O)CCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000741757 [0,2,0,0,0,0|0,0,1]=3 1984 B23R2.30127 CNC(=O)CCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000741757 [0,2,0,0,0,0|0,0,1]=3 1985 B23R2.30127 CNC(=O)OCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_200011997002 [0,2,0,0,0,0|1,0,1]=4 1986 B23R2.30127 CNC(=O)OCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_200011997002 [0,2,0,0,0,0|1,0,1]=4 1987 B23R2.30127 COC(=O)CCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000742333 [0,2,0,0,0,0|1,0,1]=4 1988 B23R2.30127 COC(=O)CCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100011218270 [0,2,0,0,0,0|1,0,1]=4 1989 B23R2.36378 COC(=O)C(C)CCOc1ccccc1Cc2ccccc2 34a_100000211249_100000034942 [0,2,0,0,0,0|1,0,1]=4 1990 B23R2.36378 COC(=O)C(C)CCOc1ccccc1Cc2ccccc2 7a_100000211249_100000034942 [0,2,0,0,0,0|1,0,1]=4 1991 B23R2.752816 CNC(=O)CCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000741757 [0,2,0,0,0,0|1,0,1]=4 1992 B23R2.818457 CNC(=O)CCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000741757 [0,2,0,0,0,0|1,0,1]=4 1993 B23R2.818457 CNC(=O)CCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000741757 [0,2,0,0,0,0|1,0,1]=4 1994 B23R2.818457 CNC(=O)CCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000741757 [0,2,0,0,0,0|1,0,1]=4 1995 B23R2.818457 CNC(=O)CCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000741757 [0,2,0,0,0,0|0,0,2]=4 1996 B23R2.818457 CNC(=O)CCCSc1ccccc1C(N)c2ccccc2 62a_100000741757_100011211563 [0,2,0,0,0,0|0,1,1]=4 1997 B23R2.818457 CNC(=O)CCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000741757 [0,2,0,0,0,0|0,1,1]=4 1998 B23R2.31770 COCCCCNc1ccc(cc1C(C)c2ccccc2)C 2230a_100010591190_100000730899 [0,2,0,0,0,0|2,0,0]=4 1999 B23R2.31770 COCCCCNc1ccc(cc1C(C)c2ccccc2)C 34a_100010591190_100000755781 [0,2,0,0,0,0|2,0,0]=4 2000 B23R2.31770 COCCCCNc1ccc(cc1C(C)c2ccccc2)C 7a_100010591190_100000730899 [0,2,0,0,0,0|2,0,0]=4 2001 B23R2.31770 COCCCCNc1ccc(cc1C(O)c2ccccc2)Cl 2230a_100000011915_100000730899 [0,2,0,0,0,0|2,0,0]=4 2002 B23R2.31770 COCCCCNc1ccc(cc1C(O)c2ccccc2)Cl 34a_100000011915_100000755781 [0,2,0,0,0,0|2,0,0]=4 2003 B23R2.31770 COCCCCNc1ccc(cc1C(O)c2ccccc2)Cl 7a_100000011915_100000730899 [0,2,0,0,0,0|2,0,0]=4 2004 B23R2.31770 COCCCCOc1ccc(cc1C(=O)c2ccccc2)Br 7a_200011217964_100000730899 [0,2,0,0,0,0|1,0,1]=4 2005 B23R2.31770 COCCCCOc1ccc(cc1C(=O)c2ccccc2)C 7a_100011219697_100000730899 [0,2,0,0,0,0|1,0,1]=4 2006 B23R2.31770 COCCCCOc1ccc(cc1C(=O)c2ccccc2)Cl 34a_100011215916_100000755781 [0,2,0,0,0,0|1,0,1]=4 2007 B23R2.31770 COCCCCOc1ccc(cc1C(=O)c2ccccc2)Cl 7a_100011215916_100000730899 [0,2,0,0,0,0|1,0,1]=4 2008 B23R2.41902 COCCCCOc1cc(ccc1C(=O)c2ccccc2)C 7a_100000066476_100000730899 [0,2,0,0,0,0|1,0,1]=4 2009 B23R3.25858 O=C1CCCC1Oc2ccccc2OCc3ccccc3 34a_100000187230_100000709159 [0,0,0,1,0,1|2,0,0]=4 2010 B23R3.25858 O=C1CCCC1Oc2ccccc2OCc3ccccc3 7a_100000187230_100000211823 [0,0,0,1,0,1|2,0,0]=4 2011 B23R3.1927712 c1ccc(cc1)CNc2ccccc2N3CCCCCC3 207a_100000735991_100015611070 [0,0,0,1,0,1|2,0,0]=4 2012 B23R3.1927712 c1ccc(cc1)CNc2ccccc2N3CCCCCC3 270302a_100000735991_100015611070 [0,0,0,1,0,1|2,0,0]=4 2013 B23R3.1927712 c1ccc(cc1)CNc2ccccc2N3CCCCCC3 34a_100000735991_100015291786 [0,0,0,1,0,1|2,0,0]=4 2014 B23R3.1974195 c1ccc(cc1)CNc2ccccc2OCC3CCCO3 207a_200011193920_100015611070 [0,0,0,1,0,1|2,0,0]=4 2015 B23R3.1974195 c1ccc(cc1)CNc2ccccc2OCC3CCCO3 270302a_200011193920_100015611070 [0,0,0,1,0,1|2,0,0]=4 2016 B23R3.1974195 c1ccc(cc1)CNc2ccccc2OCC3CCCO3 34a_200011193920_100015291786 [0,0,0,1,0,1|2,0,0]=4 2017 B23R3.1974195 c1ccc(cc1)COc2ccccc2NCC3CCCC3 34a_100011193923_100000740388 [0,0,0,1,0,1|2,0,0]=4 2018 B23R3.1974195 c1ccc(cc1)COc2ccccc2NCC3CCOC3 34a_100011193923_100011261433 [0,0,0,1,0,1|2,0,0]=4 2019 B23R3.1974195 c1ccc(cc1)COc2ccccc2OCC3CCCC3 34a_100000187230_100000740388 [0,0,0,1,0,1|1,0,0]=3 2020 B23R3.1974195 c1ccc(cc1)COc2ccccc2OCC3CCCC3 7a_100000187230_100000740388 [0,0,0,1,0,1|1,0,0]=3 2021 B23R3.1974195 c1ccc(cc1)COc2ccccc2OCC3CCCO3 7a_100000187230_100000203698 [0,0,0,1,0,1|2,0,0]=4 2022 B23R3.1974195 c1ccc(cc1)COc2ccccc2OCC3CCOC3 34a_100000187230_100011261433 [0,0,0,1,0,1|1,0,0]=3 2023 B23R3.1974195 c1ccc(cc1)COc2ccccc2OCC3CCOC3 7a_100000187230_100000702531 [0,0,0,1,0,1|1,0,0]=3 2024 B23R3.1974195 c1ccc(cc1)COc2ccccc2SCC3CCOC3 62a_100000151716_100000702531 [0,0,0,1,0,1|1,1,0]=4 2025 B23R3.1974195 c1ccc(cc1)COc2ccccc2SCC3CCOC3 62a_100000702531_100000151716 [0,0,0,1,0,1|1,1,0]=4 2026 B23R3.1974195 c1ccc(cc1)CSc2ccccc2NCC3CCOC3 34a_100000198535_100011261433 [0,0,0,1,0,1|2,0,0]=4 2027 B23R3.1974195 c1ccc(cc1)CSc2ccccc2NCC3CCOC3 7a_100000198535_100000702531 [0,0,0,1,0,1|2,0,0]=4 2028 B23R3.1974195 c1ccc(cc1)OCc2ccccc2NCC3CCCC3 2230a_100000742786_100000740388 [0,0,0,1,0,1|2,0,0]=4 2029 B23R3.1974195 c1ccc(cc1)OCc2ccccc2NCC3CCCC3 34a_100000742786_100000740388 [0,0,0,1,0,1|2,0,0]=4 2030 B23R3.1974195 c1ccc(cc1)OCc2ccccc2NCC3CCCC3 7a_100000742786_100000740388 [0,0,0,1,0,1|2,0,0]=4 2031 B23R3.1974195 c1ccc(cc1)OCc2ccccc2NCC3CCOC3 2230a_100000742786_100000702531 [0,0,0,1,0,1|2,0,0]=4 2032 B23R3.1974195 c1ccc(cc1)OCc2ccccc2NCC3CCOC3 34a_100000742786_100011261433 [0,0,0,1,0,1|2,0,0]=4 2033 B23R3.1974195 c1ccc(cc1)OCc2ccccc2NCC3CCOC3 7a_100000742786_100000702531 [0,0,0,1,0,1|2,0,0]=4 2034 B23R3.1974195 c1cncc(c1)NCc2ccccc2OCC3CCCC3 34a_200000712809_100000740388 [0,0,0,1,0,1|2,0,0]=4 2035 B23R3.1974195 c1cncc(c1)NCc2ccccc2OCC3CCOC3 34a_200000712809_100011261433 [0,0,0,1,0,1|2,0,0]=4 2036 B23R3.1974227 C(#Cc1ccccc1OC2CCCCC2)c3ccccc3 271570a_100000069678_200011235867 [0,0,0,1,0,1|1,0,1]=4 2037 B23R3.1974227 C1=CC(CCC1)Oc2ccccc2OCc3ccccc3 7a_100000187230_100000751183 [0,0,0,1,0,1|1,0,1]=4 2038 B23R3.1974227 c1ccc(cc1)CNc2ccccc2OC3CCOCC3 207a_100011439705_100015611070 [0,0,0,1,0,1|2,0,0]=4 2039 B23R3.1974227 c1ccc(cc1)CNc2ccccc2OC3CCOCC3 2230a_100011439705_100015291786 [0,0,0,1,0,1|2,0,0]=4 2040 B23R3.1974227 c1ccc(cc1)CNc2ccccc2OC3CCOCC3 270302a_100011439705_100015611070 [0,0,0,1,0,1|2,0,0]=4 2041 B23R3.1974227 c1ccc(cc1)CNc2ccccc2OC3CCOCC3 34a_100011439705_100015291786 [0,0,0,1,0,1|2,0,0]=4 2042 B23R3.1974227 c1ccc(cc1)COc2ccccc2NC3CCCOC3 34a_100011193923_100000693364 [0,0,0,1,0,1|2,0,0]=4 2043 B23R3.1974227 c1ccc(cc1)COc2ccccc2OC3CCCCC3 34a_100000187230_100000210327 [0,0,0,1,0,1|1,0,0]=3 2044 B23R3.1974227 c1ccc(cc1)COc2ccccc2OC3CCCCC3 7a_100000187230_100000210327 [0,0,0,1,0,1|1,0,0]=3 2045 B23R3.1974227 c1ccc(cc1)COc2ccccc2OC3CCCOC3 34a_100000187230_100000693364 [0,0,0,1,0,1|1,0,0]=3 2046 B23R3.1974227 c1ccc(cc1)COc2ccccc2OC3CCCOC3 7a_100000187230_100000693364 [0,0,0,1,0,1|1,0,0]=3 2047 B23R3.1974227 c1ccc(cc1)COc2ccccc2OC3CCOCC3 7a_100000187230_100000686592 [0,0,0,1,0,1|2,0,0]=4 2048 B23R3.1974227 c1ccc(cc1)COc2ccccc2OC3CCSCC3 34a_100000187230_100000069128 [0,0,0,1,0,1|2,0,0]=4 2049 B23R3.1974227 c1ccc(cc1)COc2ccccc2OC3CCSCC3 7a_100000187230_100011500858 [0,0,0,1,0,1|2,0,0]=4 2050 B23R3.1974227 c1ccc(cc1)COc2ccccc2SC3CCCOC3 62a_100000151716_100000693364 [0,0,0,1,0,1|1,1,0]=4 2051 B23R3.1974227 c1ccc(cc1)CSc2ccccc2NC3CCCOC3 34a_100000198535_100000693364 [0,0,0,1,0,1|2,0,0]=4 2052 B23R3.1974227 c1ccc(cc1)CSc2ccccc2NC3CCCOC3 7a_100000198535_100000693364 [0,0,0,1,0,1|2,0,0]=4 2053 B23R3.1974227 c1ccc(cc1)NCc2ccccc2OC3CCOCC3 207a_100000106764_200011935146 [0,0,0,1,0,1|2,0,0]=4 2054 B23R3.1974227 c1ccc(cc1)NCc2ccccc2OC3CCOCC3 270302a_100000106764_200011935146 [0,0,0,1,0,1|2,0,0]=4 2055 B23R3.1974227 c1ccc(cc1)OCc2ccccc2NC3CCCOC3 34a_100000742786_100000693364 [0,0,0,1,0,1|2,0,0]=4 2056 B23R3.1974227 c1ccc(cc1)OCc2ccccc2NC3CCCOC3 7a_100000742786_100000693364 [0,0,0,1,0,1|2,0,0]=4 2057 B23R3.1974227 c1cncc(c1)NCc2ccccc2OC3CCCCC3 34a_200000712809_100000210327 [0,0,0,1,0,1|2,0,0]=4 2058 B23R3.1974227 c1cncc(c1)NCc2ccccc2OC3CCCOC3 34a_200000712809_100000693364 [0,0,0,1,0,1|2,0,0]=4 2059 B23R3.3868843 c1ccc(cc1)COc2ccccc2NCCCC3CO3 34a_100011193923_100000733510 [0,0,0,1,0,1|2,0,0]=4 2060 B23R3.3868843 c1ccc(cc1)COc2ccccc2OCCCC3CO3 34a_100000187230_100000733510 [0,0,0,1,0,1|1,0,0]=3 2061 B23R3.3868843 c1ccc(cc1)COc2ccccc2OCCCC3CO3 7a_100000187230_100000733510 [0,0,0,1,0,1|1,0,0]=3 2062 B23R3.3868843 c1ccc(cc1)COc2ccccc2SCCCC3CO3 62a_100000151716_100000733510 [0,0,0,1,0,1|1,1,0]=4 2063 B23R3.3868843 c1ccc(cc1)COc2ccccc2SCCCC3CO3 62a_100000733510_100000151716 [0,0,0,1,0,1|1,1,0]=4 2064 B23R3.3868843 c1ccc(cc1)CSc2ccccc2NCCCC3CO3 34a_100000198535_100000733510 [0,0,0,1,0,1|2,0,0]=4 2065 B23R3.3868843 c1ccc(cc1)CSc2ccccc2NCCCC3CO3 7a_100000198535_100000733510 [0,0,0,1,0,1|2,0,0]=4 2066 B23R3.3868843 c1ccc(cc1)OCc2ccccc2NCCCC3CO3 2230a_100000742786_100000733510 [0,0,0,1,0,1|2,0,0]=4 2067 B23R3.3868843 c1ccc(cc1)OCc2ccccc2NCCCC3CO3 34a_100000742786_100000733510 [0,0,0,1,0,1|2,0,0]=4 2068 B23R3.3868843 c1ccc(cc1)OCc2ccccc2NCCCC3CO3 7a_100000742786_100000733510 [0,0,0,1,0,1|2,0,0]=4 2069 B23R3.3868843 c1cncc(c1)NCc2ccccc2OCCCC3CO3 34a_200000712809_100000733510 [0,0,0,1,0,1|2,0,0]=4 2070 B23R3.6612 CCN1CCC(C1)Oc2ccccc2Cc3ccccc3 7a_100000211249_200011861547 [0,1,0,1,0,0|2,0,0]=4 2071 B23R3.4596 C1=CCC(C1)COCc2ccccc2Cc3ccccc3 34a_100000688395_100010254464 [0,1,0,1,0,0|1,0,1]=4 2072 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCCC3 207a_100000737975_100009842342 [0,1,0,1,0,0|2,0,0]=4 2073 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCCC3 2230a_100000737975_100010254464 [0,1,0,1,0,0|2,0,0]=4 2074 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCCC3 270004a_100000737975_100009842342 [0,1,0,1,0,0|2,0,0]=4 2075 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCCC3 34a_100000737975_100010254464 [0,1,0,1,0,0|2,0,0]=4 2076 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCOC3 207a_100000737293_100009842342 [0,1,0,1,0,0|2,0,0]=4 2077 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCOC3 2230a_100000737293_100010254464 [0,1,0,1,0,0|2,0,0]=4 2078 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCOC3 270004a_100000737293_100009842342 [0,1,0,1,0,0|2,0,0]=4 2079 B23R3.4596 c1ccc(cc1)Cc2ccccc2CNCC3CCOC3 34a_100000737293_100010254464 [0,1,0,1,0,0|2,0,0]=4 2080 B23R3.4596 c1ccc(cc1)Cc2ccccc2COCC3CCCC3 34a_100000742336_100010254464 [0,1,0,1,0,0|1,0,0]=3 2081 B23R3.4596 c1ccc(cc1)Cc2ccccc2COCC3CCCC3 7a_100000742336_100010254464 [0,1,0,1,0,0|1,0,0]=3 2082 B23R3.4596 c1ccc(cc1)Cc2ccccc2COCC3CCCO3 34a_100000210270_100010254464 [0,1,0,1,0,0|2,0,0]=4 2083 B23R3.4596 c1ccc(cc1)Cc2ccccc2COCC3CCCO3 7a_100000210270_100010254464 [0,1,0,1,0,0|2,0,0]=4 2084 B23R3.4596 c1ccc(cc1)Cc2ccccc2COCC3CCNC3 34a_100000748654_100010254464 [0,1,0,1,0,0|0,0,0]=2 2085 B23R3.4596 c1ccc(cc1)Cc2ccccc2COCC3CCOC3 34a_100000740260_100010254464 [0,1,0,1,0,0|1,0,0]=3 2086 B23R3.4596 c1ccc(cc1)Cc2ccccc2COCC3COCO3 34a_100011216627_100010254464 [0,1,0,1,0,0|2,0,0]=4 2087 B23R3.4596 c1ccc(cc1)Cc2ccccc2COC[C@H]3CCCN3 34a_100000745186_100010254464 [0,1,0,1,0,0|2,0,0]=4 2088 B23R3.4596 c1ccc(cc1)Cc2ccccc2CSCC3CCOC3 62a_100000702531_100010254464 [0,1,0,1,0,0|1,1,0]=4 2089 B23R3.4596 c1ccc(cc1)Cc2ccccc2CSCC3CCOC3 62a_100010254464_100000702531 [0,1,0,1,0,0|1,1,0]=4 2090 B23R3.4596 c1ccc(cc1)Cc2ccccc2NCCN3CCCC3 7a_100000211252_100000004467 [0,1,0,1,0,0|2,0,0]=4 2091 B23R3.4596 c1ccc(cc1)Cc2ccccc2OCCC3OCCO3 34a_100000211249_100000740749 [0,1,0,1,0,0|2,0,0]=4 2092 B23R3.4596 c1ccc(cc1)Cc2ccccc2OCCC3OCCO3 7a_100000211249_100000740749 [0,1,0,1,0,0|2,0,0]=4 2093 B23R3.4596 c1ccc(cc1)Cc2ccccc2OCCN3CCCC3 7a_100000211249_100000004467 [0,1,0,1,0,0|1,0,0]=3 2094 B23R3.4596 c1ccc(cc1)Cc2ccccc2SCCN3CCCC3 62a_100000700749_200011216382 [0,1,0,1,0,0|1,1,0]=4 2095 B23R3.4596 c1ccc(cc1)Cc2ccccc2SCCN3CCCC3 62a_200011216382_100000004467 [0,1,0,1,0,0|1,1,0]=4 2096 B23R3.4596 c1ccc(cc1)Oc2ccccc2COCC3CCOC3 34a_100000246416_100011261433 [0,1,0,1,0,0|2,0,0]=4 2097 B23R3.4596 c1ccc(cc1)Oc2ccccc2COCC3CCOC3 7a_100000246416_100000702531 [0,1,0,1,0,0|2,0,0]=4 2098 B23R3.4596 c1ccc(cc1)Oc2ccccc2OCCN3CCCC3 7a_100000074787_100000004467 [0,1,0,1,0,0|2,0,0]=4 2099 B23R3.8059 CCCCCN1CCc2ccccc2[C@@H]1c3ccccc3 2230a_100010197342_100000210326 [0,1,0,1,0,0|2,0,0]=4 2100 B23R3.8059 CCCCCN1CCc2ccccc2[C@@H]1c3ccccc3 269982a_100010197342_100000210215 [0,1,0,1,0,0|2,0,0]=4 2101 B23R3.8059 CCCCCN1CCc2ccccc2[C@@H]1c3ccccc3 34a_100010197342_100000718602 [0,1,0,1,0,0|2,0,0]=4 2102 B23R3.8059 COCCCN1CCc2ccccc2[C@@H]1c3ccccc3 2230a_100010197342_100000740836 [0,1,0,1,0,0|2,0,0]=4 2103 B23R3.8059 COCCCN1CCc2ccccc2[C@@H]1c3ccccc3 269982a_100010197342_100000740836 [0,1,0,1,0,0|2,0,0]=4 2104 B23R3.8059 COCCCN1CCc2ccccc2[C@@H]1c3ccccc3 34a_100010197342_100000740836 [0,1,0,1,0,0|2,0,0]=4 2105 B23R3.31542 COCC1CCN1Cc2ccccc2Cc3ccccc3 2230a_100015195929_100010254464 [0,1,0,1,0,0|2,0,0]=4 2106 B23R3.31542 COCC1CCN1Cc2ccccc2Cc3ccccc3 269982a_100015195929_100010254464 [0,1,0,1,0,0|2,0,0]=4 2107 B23R3.31542 COCC1CCN1Cc2ccccc2Cc3ccccc3 26a_100015195929_100000211249 [0,1,0,1,0,0|2,0,0]=4 2108 B23R3.31542 COCC1CCN1Cc2ccccc2Cc3ccccc3 270004a_100015195929_100009842342 [0,1,0,1,0,0|2,0,0]=4 2109 B23R3.31542 COCC1CCN1Cc2ccccc2Cc3ccccc3 34a_100015195929_100010254464 [0,1,0,1,0,0|2,0,0]=4 2110 B23R3.41065 CC1CCCC1OCc2ccccc2Cc3ccccc3 34a_100011216460_100010254464 [0,1,0,1,0,0|1,0,0]=3 2111 B23R3.41065 CC1CCCC1OCc2ccccc2Cc3ccccc3 7a_100011216460_100010254464 [0,1,0,1,0,0|1,0,0]=3 2112 B23R3.41065 C[C@@H]1CNC[C@@H]1OCc2ccccc2Cc3ccccc3 34a_200015306588_100010254464 [0,1,0,1,0,0|2,0,0]=4 2113 B23R3.41065 Cl[C@@H]1CCC[C@H]1OCc2ccccc2Cc3ccccc3 34a_200016002552_100010254464 [0,1,0,1,0,0|2,0,0]=4 2114 B23R3.41065 N[C@H]1CCC[C@@H]1OCc2ccccc2Cc3ccccc3 34a_100000748460_100010254464 [0,1,0,1,0,0|2,0,0]=4 2115 B23R3.41065 O=C1CCCC1OCc2ccccc2Cc3ccccc3 34a_200000719330_100010254464 [0,1,0,1,0,0|2,0,0]=4 2116 B23R3.41961 CC1CCCCN1Cc2ccccc2Cc3ccccc3 2230a_100000211376_100010254464 [0,1,0,1,0,0|2,0,0]=4 2117 B23R3.41961 CC1CCCCN1Cc2ccccc2Cc3ccccc3 269982a_100000211376_100010254464 [0,1,0,1,0,0|2,0,0]=4 2118 B23R3.41961 CC1CCCCN1Cc2ccccc2Cc3ccccc3 26a_100000211376_100000211249 [0,1,0,1,0,0|2,0,0]=4 2119 B23R3.41961 CC1CCCCN1Cc2ccccc2Cc3ccccc3 270004a_100000211376_100009842342 [0,1,0,1,0,0|2,0,0]=4 2120 B23R3.41961 CC1CCCCN1Cc2ccccc2Cc3ccccc3 34a_100000211376_100010254464 [0,1,0,1,0,0|2,0,0]=4 2121 B23R3.41961 FC1CCCCC1Nc2ccccc2Cc3ccccc3 34a_100000211252_100015423560 [0,1,0,1,0,0|2,0,0]=4 2122 B23R3.41961 FC1CCCCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_100015423560 [0,1,0,1,0,0|1,0,0]=3 2123 B23R3.41961 O=C1CCCCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_100000754470 [0,1,0,1,0,0|1,0,1]=4 2124 B23R3.41961 O=C1CCCCC1Oc2ccccc2Cc3ccccc3 7a_100000211249_100000204591 [0,1,0,1,0,0|1,0,1]=4 2125 B23R3.41961 O=C1CCOCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_100012180262 [0,1,0,1,0,0|1,0,1]=4 2126 B23R3.41961 O=C1CCOCC1Oc2ccccc2Cc3ccccc3 7a_100000211249_100012180262 [0,1,0,1,0,0|1,0,1]=4 2127 B23R3.41961 O=C1NCCCC1Nc2ccccc2Cc3ccccc3 2230a_100000211252_100000687798 [0,1,0,1,0,0|1,0,1]=4 2128 B23R3.41961 O=C1NCCCC1Nc2ccccc2Cc3ccccc3 34a_100000211252_100000687798 [0,1,0,1,0,0|1,0,1]=4 2129 B23R3.41961 O=C1NCCCC1Nc2ccccc2Cc3ccccc3 7a_100000211252_100000687798 [0,1,0,1,0,0|1,0,1]=4 2130 B23R3.41961 O=C1NCCCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_100000687798 [0,1,0,1,0,0|0,0,1]=3 2131 B23R3.41961 O=C1NCCCC1Oc2ccccc2Cc3ccccc3 7a_100000211249_100000687798 [0,1,0,1,0,0|0,0,1]=3 2132 B23R3.41961 O=C1NCCCC1Oc2ccccc2Oc3ccccc3 34a_100000074787_100000687798 [0,1,0,1,0,0|1,0,1]=4 2133 B23R3.41961 O=C1NCCCC1Oc2ccccc2Oc3ccccc3 7a_100000074787_100000687798 [0,1,0,1,0,0|1,0,1]=4 2134 B23R3.41961 O=C1NCCCC1Sc2ccccc2Cc3ccccc3 62a_100000687798_200011216382 [0,1,0,1,0,0|0,1,1]=4 2135 B23R3.41961 O=C1NCCCC1Sc2ccccc2Cc3ccccc3 62a_200011216382_100000687798 [0,1,0,1,0,0|0,1,1]=4 2136 B23R3.41961 OC1CCCCC1Nc2ccccc2Cc3ccccc3 34a_100000211252_100000038908 [0,1,0,1,0,0|2,0,0]=4 2137 B23R3.41961 OC1CCCCC1Oc2ccccc2Cc3ccccc3 34a_100000211249_100000038908 [0,1,0,1,0,0|1,0,0]=3 2138 B23R3.41961 OC1CCCCC1Oc2ccccc2Oc3ccccc3 34a_100000074787_100000038908 [0,1,0,1,0,0|2,0,0]=4 2139 B23R3.41961 OC1CCCCC1Sc2ccccc2Cc3ccccc3 62a_100000038908_200011216382 [0,1,0,1,0,0|1,1,0]=4 2140 B23R3.41961 OC1CCCCC1Sc2ccccc2Cc3ccccc3 62a_200011216382_100000038908 [0,1,0,1,0,0|1,1,0]=4 2141 B23R3.79869 CCC1CCCN1Cc2ccccc2Cc3ccccc3 2230a_100000754278_100010254464 [0,1,0,1,0,0|2,0,0]=4 2142 B23R3.79869 CCC1CCCN1Cc2ccccc2Cc3ccccc3 269982a_100000754278_100010254464 [0,1,0,1,0,0|2,0,0]=4 2143 B23R3.79869 CCC1CCCN1Cc2ccccc2Cc3ccccc3 26a_100000754278_100000211249 [0,1,0,1,0,0|2,0,0]=4 2144 B23R3.79869 CCC1CCCN1Cc2ccccc2Cc3ccccc3 270004a_100000754278_100009842342 [0,1,0,1,0,0|2,0,0]=4 2145 B23R3.79869 CCC1CCCN1Cc2ccccc2Cc3ccccc3 34a_100000754278_100010254464 [0,1,0,1,0,0|2,0,0]=4 2146 B23R3.814718 O=C1CCC1CCOc2ccccc2Cc3ccccc3 7a_100000211249_200016118888 [0,1,0,1,0,0|1,0,1]=4 2147 B23R3.958723 CCCCOCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000743108 [0,1,0,1,0,0|2,0,0]=4 2148 B23R3.958723 CCCCOCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000743108 [0,1,0,1,0,0|2,0,0]=4 2149 B23R3.958723 COCCOCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000695917 [0,1,0,1,0,0|2,0,0]=4 2150 B23R3.958723 COCCOCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000695917 [0,1,0,1,0,0|2,0,0]=4 2151 B23R3.958723 OCCCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000766143 [0,1,0,1,0,0|2,0,0]=4 2152 B23R3.958723 OCCCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000766143 [0,1,0,1,0,0|2,0,0]=4 2153 B23R3.1974367 c1ccc(cc1)Cc2ccccc2COCCNC3CC3 34a_100000738766_100010254464 [0,1,0,1,0,0|2,0,0]=4 2154 B23R3.1974367 c1ccc(cc1)Cc2ccccc2CSCCCC3CO3 62a_100000733510_100010254464 [0,1,0,1,0,0|1,1,0]=4 2155 B23R3.1974367 c1ccc(cc1)Cc2ccccc2CSCCCC3CO3 62a_100010254464_100000733510 [0,1,0,1,0,0|1,1,0]=4 2156 B23R3.1974367 c1ccc(cc1)Oc2ccccc2COCCCC3CO3 34a_100000246416_100000733510 [0,1,0,1,0,0|2,0,0]=4 2157 B23R3.1974367 c1ccc(cc1)Oc2ccccc2COCCCC3CO3 7a_100000246416_100000733510 [0,1,0,1,0,0|2,0,0]=4 2158 B23R3.1974368 c1ccc(cc1)Cc2ccccc2COCCC3COC3 34a_100009855314_100010254464 [0,1,0,1,0,0|1,0,0]=3 2159 B23R3.31995510 CNCCCOCc1c2ccccc2cc3c1cccc3 34a_100000213112_100009992879 [0,1,0,1,0,0|1,0,1]=4 2160 B23R3.31995510 COCCCCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000730899 [0,1,0,1,0,0|2,0,0]=4 2161 B23R3.49764 CN(C)CCN1CCc2ccccc2[C@@H]1c3ccccc3 269982a_100010197342_100000755713 [0,1,0,1,0,0|2,0,0]=4 2162 B23R3.112046 CN1CCC(C1)CNc2ccccc2Cc3ccccc3 34a_100000211252_200000690779 [0,1,0,1,0,0|1,0,0]=3 2163 B23R3.112046 CN1CCC(C1)CNc2ccccc2Cc3ccccc3 7a_100000211252_200000690779 [0,1,0,1,0,0|1,0,0]=3 2164 B23R3.112046 CN1CCC(C1)CNc2ccccc2Oc3ccccc3 34a_100000182328_200000690779 [0,1,0,1,0,0|2,0,0]=4 2165 B23R3.112046 CN1CCC(C1)COc2ccccc2Cc3ccccc3 34a_100000211249_200000690779 [0,1,0,1,0,0|0,0,0]=2 2166 B23R3.112046 CN1CCC(C1)COc2ccccc2Cc3ccccc3 7a_100000211249_200000690779 [0,1,0,1,0,0|0,0,0]=2 2167 B23R3.112046 CN1CCC(C1)COc2ccccc2Oc3ccccc3 34a_100000074787_200000690779 [0,1,0,1,0,0|1,0,0]=3 2168 B23R3.112046 CN1CCC(C1)COc2ccccc2Oc3ccccc3 7a_100000074787_200000690779 [0,1,0,1,0,0|1,0,0]=3 2169 B23R3.112046 CN1CCC(C1)COc2ccccc2Oc3ccccn3 34a_100000748224_200000690779 [0,1,0,1,0,0|2,0,0]=4 2170 B23R3.112046 CN1CCC(C1)CSc2ccccc2Cc3ccccc3 62a_200000690779_200011216382 [0,1,0,1,0,0|0,1,0]=3 2171 B23R3.112046 CN1CCC(C1)CSc2ccccc2Cc3ccccc3 62a_200011216382_200000690779 [0,1,0,1,0,0|0,1,0]=3 2172 B23R3.112046 CN1CCC(C1)CSc2ccccc2Nc3ccccc3 62a_200000690779_100009815782 [0,1,0,1,0,0|1,1,0]=4 2173 B23R3.112046 CN1CCC(C1)CSc2ccccc2Oc3ccccc3 62a_200000690779_100000049502 [0,1,0,1,0,0|1,1,0]=4 2174 B23R3.112046 CN1CCC(C1)NCc2ccccc2Cc3ccccc3 207a_100000744687_100009842342 [0,1,0,1,0,0|2,0,0]=4 2175 B23R3.112046 CN1CCC(C1)NCc2ccccc2Cc3ccccc3 270004a_100000744687_100009842342 [0,1,0,1,0,0|2,0,0]=4 2176 B23R3.112046 CN1CCC(C1)SCc2ccccc2Cc3ccccc3 62a_100010254464_200012183744 [0,1,0,1,0,0|2,0,0]=4 2177 B23R3.112046 O=C1CC[C@H](N1)COc2ccccc2Cc3ccccc3 7a_100000211249_100015189358 [0,1,0,1,0,0|2,0,0]=4 2178 B23R3.112046 O=C1NCC(O1)COc2ccccc2Cc3ccccc3 34a_100000211249_100000181169 [0,1,0,1,0,0|1,0,1]=4 2179 B23R3.112046 O=C1NCC(O1)COc2ccccc2Cc3ccccc3 7a_100000211249_100000181169 [0,1,0,1,0,0|1,0,1]=4 2180 B23R3.258076 FC1(CCCC1Oc2ccccc2Cc3ccccc3)F 34a_100000211249_100119073726 [0,1,0,1,0,0|2,0,0]=4 2181 B23R3.337470 CN1CC(C1)CNCc2ccccc2Cc3ccccc3 270004a_100000723568_100009842342 [0,1,0,1,0,0|2,0,0]=4 2182 B23R3.920838 CC(=O)CCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100009817362 [0,1,0,1,0,0|2,0,0]=4 2183 B23R3.920838 CC(=O)CCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000735457 [0,1,0,1,0,0|2,0,0]=4 2184 B23R3.1354499 CNC(=O)CCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000741757 [0,1,0,1,0,0|1,0,1]=4 2185 B23R3.1354499 CNC(=O)CCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000741757 [0,1,0,1,0,0|1,0,1]=4 2186 B23R3.4556960 COCCCCOc1cccc2c1oc3c2cc(cc3)F 34a_100160571805_100000755781 [0,1,0,1,0,0|2,0,0]=4 2187 B23R3.4556960 COCCCCOc1cccc2c1oc3c2cc(cc3)F 7a_100160571805_100000730899 [0,1,0,1,0,0|2,0,0]=4 2188 B23R3.17829 Clc1ccc(c(c1)Cc2ccccc2)OCC3CCCO3 7a_100000211996_100000203698 [0,1,0,1,0,0|2,0,0]=4 2189 B23R3.17829 Clc1ccc(c(c1)Cc2ccccc2)OCC3CCOC3 34a_100000211996_100011261433 [0,1,0,1,0,0|1,0,0]=3 2190 B23R3.17829 Clc1ccc(c(c1)Cc2ccccc2)OCC3CCOC3 7a_100000211996_100000702531 [0,1,0,1,0,0|1,0,0]=3 2191 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3CCCOC3 34a_100000211996_100000693364 [0,1,0,1,0,0|1,0,0]=3 2192 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3CCCOC3 7a_100000211996_100000693364 [0,1,0,1,0,0|1,0,0]=3 2193 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3CCOCC3 7a_100000211996_100000686592 [0,1,0,1,0,0|2,0,0]=4 2194 B23R3.170315 O=C1CCCC1Oc2ccc(cc2Cc3ccccc3)Cl 34a_100000211996_100000709159 [0,1,0,1,0,0|2,0,0]=4 2195 B23R3.170315 O=C1CCCC1Oc2ccc(cc2Cc3ccccc3)Cl 7a_100000211996_100000211823 [0,1,0,1,0,0|2,0,0]=4 2196 B23R3.170331 Clc1ccc(c(c1)Cc2ccccc2)OCCCC3CO3 34a_100000211996_100000733510 [0,1,0,1,0,0|1,0,0]=3 2197 B23R3.170331 Clc1ccc(c(c1)Cc2ccccc2)OCCCC3CO3 7a_100000211996_100000733510 [0,1,0,1,0,0|1,0,0]=3 2198 B23R3.7295191 O=C(COc1ccccc1Cc2ccccc2)C3CCC3 34a_100000211249_100000686122 [0,1,0,1,0,0|1,0,1]=4 2199 B23R3.7295191 O=C(COc1ccccc1Cc2ccccc2)C3CCC3 7a_100000211249_100000686122 [0,1,0,1,0,0|1,0,1]=4 2200 B23R3.940728 O=C(CC1CCOC1)c2ccccc2Cc3ccccc3 1458a_100000211042_100000702531 [0,1,0,1,0,0|2,0,0]=4 2201 B23R3.1995329 NC(c1ccccc1)c2ccccc2SC3CCCOC3 62a_100011211563_100000693364 [0,1,0,1,0,0|1,1,0]=4 2202 B23R3.1995329 O=C(c1ccccc1)c2ccccc2OC3CCCCC3 7a_100011215220_100000210327 [0,1,0,1,0,0|1,0,1]=4 2203 B23R3.1995329 O=C(c1ccccc1)c2ccccc2OC3CCCOC3 7a_100011215220_100000693364 [0,1,0,1,0,0|1,0,1]=4 2204 B23R3.1995329 O=C(c1ccccc1Cc2ccccc2)C3CCCOC3 1458a_100000211042_100000693364 [0,1,0,1,0,0|2,0,0]=4 2205 B23R3.1995329 OC(c1ccccc1)c2ccccc2NC3CCCCC3 34a_100000246470_100000210327 [0,1,0,1,0,0|2,0,0]=4 2206 B23R3.1995329 OC(c1ccccc1)c2ccccc2NC3CCCCC3 7a_100000246470_100000210327 [0,1,0,1,0,0|2,0,0]=4 2207 B23R3.1995329 OC(c1ccccc1)c2ccccc2NC3CCCOC3 34a_100000246470_100000693364 [0,1,0,1,0,0|2,0,0]=4 2208 B23R3.1995329 OC(c1ccccc1)c2ccccc2NC3CCCOC3 7a_100000246470_100000693364 [0,1,0,1,0,0|2,0,0]=4 2209 B23R3.4258012 COCCCCC(=O)c1cccc-2c1Cc3c2cccc3 1458a_100000033212_100000755781 [0,1,0,1,0,0|2,0,0]=4 2210 B23R3.7294869 O=C(CCCC1CO1)c2ccccc2Cc3ccccc3 1458a_100000211042_100000733510 [0,1,0,1,0,0|2,0,0]=4 2211 B23R3.1995321 NC(c1ccccc1)c2ccccc2SCC3CCOC3 62a_100000702531_100011211563 [0,1,0,1,0,0|1,1,0]=4 2212 B23R3.1995321 NC(c1ccccc1)c2ccccc2SCC3CCOC3 62a_100011211563_100000702531 [0,1,0,1,0,0|1,1,0]=4 2213 B23R3.1995321 O=C(c1ccccc1)c2ccccc2OCC3CCCC3 7a_100011215220_100000740388 [0,1,0,1,0,0|1,0,1]=4 2214 B23R3.1995321 O=C(c1ccccc1)c2ccccc2OCC3CCOC3 7a_100011215220_100000702531 [0,1,0,1,0,0|1,0,1]=4 2215 B23R3.1995321 OC(c1ccccc1)c2ccccc2NCC3CCCC3 2230a_100000246470_100000740388 [0,1,0,1,0,0|2,0,0]=4 2216 B23R3.1995321 OC(c1ccccc1)c2ccccc2NCC3CCCC3 34a_100000246470_100000740388 [0,1,0,1,0,0|2,0,0]=4 2217 B23R3.1995321 OC(c1ccccc1)c2ccccc2NCC3CCCC3 7a_100000246470_100000740388 [0,1,0,1,0,0|2,0,0]=4 2218 B23R3.1995321 OC(c1ccccc1)c2ccccc2NCC3CCOC3 2230a_100000246470_100000702531 [0,1,0,1,0,0|2,0,0]=4 2219 B23R3.1995321 OC(c1ccccc1)c2ccccc2NCC3CCOC3 34a_100000246470_100011261433 [0,1,0,1,0,0|2,0,0]=4 2220 B23R3.1995321 OC(c1ccccc1)c2ccccc2NCC3CCOC3 7a_100000246470_100000702531 [0,1,0,1,0,0|2,0,0]=4 2221 B23R3.4261830 NC(c1ccccc1)c2ccccc2SCCCC3CO3 62a_100000733510_100011211563 [0,1,0,1,0,0|1,1,0]=4 2222 B23R3.4261830 NC(c1ccccc1)c2ccccc2SCCCC3CO3 62a_100011211563_100000733510 [0,1,0,1,0,0|1,1,0]=4 2223 B23R3.4261830 O=C(c1ccccc1)c2ccccc2OCCCC3CO3 7a_100011215220_100000733510 [0,1,0,1,0,0|1,0,1]=4 2224 B23R3.4261830 OC(c1ccccc1)c2ccccc2NCCCC3CO3 2230a_100000246470_100000733510 [0,1,0,1,0,0|2,0,0]=4 2225 B23R3.4261830 OC(c1ccccc1)c2ccccc2NCCCC3CO3 34a_100000246470_100000733510 [0,1,0,1,0,0|2,0,0]=4 2226 B23R3.4261830 OC(c1ccccc1)c2ccccc2NCCCC3CO3 7a_100000246470_100000733510 [0,1,0,1,0,0|2,0,0]=4 2227 B23R3.4555582 CCCCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000210314 [0,1,0,1,0,0|2,0,0]=4 2228 B23R3.4555582 COCCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000755781 [0,1,0,1,0,0|2,0,0]=4 2229 B23R4.5460 c1ccc2c(c1)oc3c2cccc3OC4CCCOC4 34a_100010256078_100000693364 [0,0,0,2,0,0|2,0,0]=4 2230 B23R4.5460 c1ccc2c(c1)oc3c2cccc3OC4CCCOC4 7a_100010256078_100000693364 [0,0,0,2,0,0|2,0,0]=4 2231 B23R4.1517178 c1ccc2c(c1)oc3c2cccc3OCC4CCOC4 34a_100010256078_100011261433 [0,0,0,2,0,0|2,0,0]=4 2232 B23R4.1517178 c1ccc2c(c1)oc3c2cccc3OCC4CCOC4 7a_100010256078_100000702531 [0,0,0,2,0,0|2,0,0]=4 2233 B23R4.1541817 c1ccc2c(c1)oc3c2cccc3OCCCC4CO4 34a_100010256078_100000733510 [0,0,0,2,0,0|2,0,0]=4 2234 B23R4.1541817 c1ccc2c(c1)oc3c2cccc3OCCCC4CO4 7a_100010256078_100000733510 [0,0,0,2,0,0|2,0,0]=4 2235 B21R2.2593 C#CCCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100010269958 [0,0,0,0,1,1|1,0,1]=4 2236 B21R2.2593 C#CCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100010269958 [0,0,0,0,1,1|1,0,1]=4 2237 B21R2.2593 CCCCOCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100011995733 [0,0,0,0,1,1|2,0,0]=4 2238 B21R2.2593 CCCOCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100011215938 [0,0,0,0,1,1|2,0,0]=4 2239 B21R2.2593 CCCOCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100011215938 [0,0,0,0,1,1|2,0,0]=4 2240 B21R2.2593 CCOCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100012232248 [0,0,0,0,1,1|2,0,0]=4 2241 B21R2.2593 CCOCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100012232248 [0,0,0,0,1,1|2,0,0]=4 2242 B21R2.2593 COCCCCNc1cccc(c1)Cc2ccccc2 2230a_200000043086_100000730899 [0,0,0,0,1,1|2,0,0]=4 2243 B21R2.2593 COCCCCNc1cccc(c1)Cc2ccccc2 34a_200000043086_100000755781 [0,0,0,0,1,1|2,0,0]=4 2244 B21R2.2593 COCCCCNc1cccc(c1)Cc2ccccc2 7a_200000043086_100000730899 [0,0,0,0,1,1|2,0,0]=4 2245 B21R2.2593 COCCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100000755781 [0,0,0,0,1,1|1,0,0]=3 2246 B21R2.2593 COCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100000730899 [0,0,0,0,1,1|1,0,0]=3 2247 B21R2.2593 COCCCCOc1cccc(c1)Nc2ccccc2 34a_100000031534_100000755781 [0,0,0,0,1,1|2,0,0]=4 2248 B21R2.2593 COCCCCOc1cccc(c1)Nc2ccccc2 7a_100000031534_100000730899 [0,0,0,0,1,1|2,0,0]=4 2249 B21R2.2593 COCCCCOc1cccc(c1)Oc2ccccc2 7a_100000199087_100000730899 [0,0,0,0,1,1|2,0,0]=4 2250 B21R2.2593 FCCCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100000729378 [0,0,0,0,1,1|2,0,0]=4 2251 B21R2.2593 FCCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100000729378 [0,0,0,0,1,1|2,0,0]=4 2252 B21R2.2593 N#CCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100000211819 [0,0,0,0,1,1|2,0,0]=4 2253 B21R2.2593 O=CCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100000139335 [0,0,0,0,1,1|2,0,0]=4 2254 B21R2.2593 OCCCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100000746330 [0,0,0,0,1,1|2,0,0]=4 2255 B21R2.2593 OCCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100000746330 [0,0,0,0,1,1|2,0,0]=4 2256 B23R2.925206 C#CCCCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100010269958 [0,0,0,0,0,2|1,0,1]=4 2257 B23R2.925206 C=CCCCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100011215482 [0,0,0,0,0,2|1,0,1]=4 2258 B23R2.925206 CCCCCCOc1ccccc1CNCc2ccccc2 207a_100015324214_200000189357 [0,0,0,0,0,2|1,0,0]=3 2259 B23R2.925206 CCCCCCOc1ccccc1CNCc2ccccc2 270004a_100015324214_200000189357 [0,0,0,0,0,2|1,0,0]=3 2260 B23R2.925206 CCCCCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100000210314 [0,0,0,0,0,2|1,0,0]=3 2261 B23R2.925206 CCCCCCOc1ccccc1CNCc2ccccn2 270004a_100000210449_200000189357 [0,0,0,0,0,2|2,0,0]=4 2262 B23R2.925206 CCCCCCOc1ccccc1CNCc2cccnc2 207a_100000210453_200000189357 [0,0,0,0,0,2|2,0,0]=4 2263 B23R2.925206 CCCCCCOc1ccccc1CNCc2cccnc2 270004a_100000210453_200000189357 [0,0,0,0,0,2|2,0,0]=4 2264 B23R2.925206 CCCCOCOc1ccccc1CNCc2ccccc2 34a_100011219060_100011995733 [0,0,0,0,0,2|2,0,0]=4 2265 B23R2.925206 CCCOCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100011215938 [0,0,0,0,0,2|2,0,0]=4 2266 B23R2.925206 CCOCCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100012232248 [0,0,0,0,0,2|2,0,0]=4 2267 B23R2.925206 COCCCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100000755781 [0,0,0,0,0,2|1,0,0]=3 2268 B23R2.925206 COCCCCSc1ccccc1CNCc2ccccc2 62a_100000730899_200000195884 [0,0,0,0,0,2|1,1,0]=4 2269 B23R2.925206 COCCCCSc1ccccc1CNCc2ccccc2 62a_200000195884_100000730899 [0,0,0,0,0,2|1,1,0]=4 2270 B23R2.925206 FCCCCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100000729378 [0,0,0,0,0,2|2,0,0]=4 2271 B23R2.925206 OCCCCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100000746330 [0,0,0,0,0,2|2,0,0]=4