0 B14R1.156 C=CCOC(=O)C=CC1=CC=CC=C1 CNP0240721.0 [0,0,0,0,0,0|0,0,2]=2 1 B14R1.156 C=CCOC(=O)COC1=CC=CC=C1 CNP0402399.0 [0,0,0,0,0,0|1,0,3]=4 2 B14R1.156 CCCCC(=O)OCC1=CC=CC=C1 CNP0222285.0 [0,0,0,0,0,0|2,0,1]=3 3 B14R1.156 CCCOC(=O)C=CC1=CC=CC=C1 CNP0077243.0 [0,0,0,0,0,0|0,0,0]=0 4 B14R1.156 CCCOC(=O)CCC1=CC=CC=C1 CNP0546590.0 [0,0,0,0,0,0|0,0,2]=2 5 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 CNP0036736.0 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.156 O=C(C=CC1=CC=CC=C1)NCCO CNP0209791.0 [0,0,0,0,0,0|2,0,0]=2 7 B14R1.156 O=C(CCC1=CC=CC=C1)OCCO CNP0364264.0 [0,0,0,0,0,0|1,0,2]=3 8 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 CNP0242577.0 [0,0,0,0,0,0|3,0,1]=4 9 B13R1.42 C=COC(=O)C=CC1=CC=CC=C1 CNP0604637.0 [1,0,0,0,0,0|0,0,2]=3 10 B13R1.42 CC#CC(=O)C=CC1=CC=CC=C1 CNP0236750.0 [1,0,0,0,0,0|0,0,2]=3 11 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 CNP0589106.0 [1,0,0,0,0,0|0,0,2]=3 12 B13R1.42 CCCC(=O)NNC1=CC=CC=C1 CNP0167245.0 [1,0,0,0,0,0|2,0,0]=3 13 B13R1.42 CCCC(=O)OCC1=CC=CC=C1 CNP0362696.0 [1,0,0,0,0,0|1,0,1]=3 14 B13R1.42 CCOC(=NCC1=CC=CC=C1)S CNP0609481.0 [1,0,0,0,0,0|1,1,1]=4 15 B13R1.42 CCOC(=O)C=CC1=CC=CC=C1 CNP0238965.0 [1,0,0,0,0,0|0,0,0]=1 16 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 CNP0131457.0 [1,0,0,0,0,0|0,0,2]=3 17 B13R1.42 CCOC(=S)NCC1=CC=CC=C1 CNP0330895.0 [1,0,0,0,0,0|1,1,1]=4 18 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 CNP0062686.0 [1,0,0,0,0,0|2,0,1]=4 19 B13R1.42 O=C(CCO)CCC1=CC=CC=C1 CNP0150058.0 [1,0,0,0,0,0|1,0,2]=4 20 B15R1.78 CCCCCC(=O)OCC1=CC=CC=C1 CNP0185938.0 [0,1,0,0,0,0|2,0,1]=4 21 B15R1.78 CCCCCC(O)C=CC1=CC=CC=C1 CNP0541967.0 [0,1,0,0,0,0|1,0,2]=4 22 B15R1.78 CCCCOC(=O)C=CC1=CC=CC=C1 CNP0358950.0 [0,1,0,0,0,0|0,0,0]=1 23 B15R1.78 CSC=CNC(=O)C=CC1=CC=CC=C1 CNP0296474.0 [0,1,0,0,0,0|1,0,2]=4 24 B15R1.78 CSCCNC(=O)C=CC1=CC=CC=C1 CNP0304825.0 [0,1,0,0,0,0|1,0,0]=2 25 B15R1.78 NCCCNC(=O)OCC1=CC=CC=C1 CNP0113027.0 [0,1,0,0,0,0|2,0,1]=4 26 B15R1.127 CCCOC(=O)CSC1=CC=CC(=N1)Cl CNP0037904.0 [0,1,0,0,0,0|2,0,1]=4 27 B15R1.139 O=C(C=CC1=CC=C(C=C1)O)OCCO CNP0209774.0 [0,1,0,0,0,0|1,0,0]=2 28 B15R1.741 CCC(C)OC(=O)CCC1=CC=CC=C1 CNP0493756.0 [0,1,0,0,0,0|0,0,2]=3 29 B15R1.826 CCC[C@@H](C)C(=O)NCC1=CC=CC=C1 CNP0481925.2 [0,1,0,0,0,0|2,0,1]=4 30 B15R1.826 CCC[C@H](C)C(=O)NCC1=CC=CC=C1 CNP0481925.1 [0,1,0,0,0,0|2,0,1]=4 31 B15R1.826 CN(CCO)C(=O)C=CC1=CC=CC=C1 CNP0217645.0 [0,1,0,0,0,0|2,0,0]=3 32 B15R1.5919 CC(C)CNC(=O)C=CC1=CC=CC=C1 CNP0581871.0 [0,1,0,0,0,0|1,0,0]=2 33 B15R1.5919 CC(C)COC(=O)C=CC1=CC=CC=C1 CNP0079856.0 [0,1,0,0,0,0|0,0,0]=1 34 B15R1.5919 CC(C)COC(=O)CCC1=CC=CC=C1 CNP0591880.0 [0,1,0,0,0,0|0,0,2]=3 35 B15R1.5919 CN(C)C=CC(=O)C=CC1=CC=CC=C1 CNP0287098.0 [0,1,0,0,0,0|2,0,1]=4 36 B15R1.5919 O=C(O)CNC(=O)C=CC1=CC=CC=C1 CNP0001920.0 [0,1,0,0,0,0|2,0,1]=4 37 B15R2.33 CC1=C(NC(=O)CC1)C2=CC=CC=C2 CNP0358281.0 [0,0,0,1,0,0|2,0,1]=4 38 B15R2.38 O=C1C=CCCC1=CC2=CC=CC=C2 CNP0245329.0 [0,0,0,1,0,0|1,0,1]=3 39 B15R2.38 O=C1CCCCC1NC2=CC=CC=C2 CNP0588216.0 [0,0,0,1,0,0|2,0,1]=4 40 B13R1.44 C=CCOC(=O)CC1=CC=CC=C1 CNP0293196.0 [0,0,0,0,1,0|0,0,3]=4 41 B13R1.44 CCCOC(=O)CC1=CC=CC=C1 CNP0002493.0 [0,0,0,0,1,0|0,0,1]=2 42 B13R1.153 CCCOC(=O)C=CC1=CC=CO1 CNP0319640.0 [0,0,0,0,1,0|1,0,0]=2 43 B15R1.157 CCCCC(=O)NCCC1=CC=CC=C1 CNP0564432.0 [0,0,0,0,0,1|1,0,2]=4 44 B15R1.157 CCCCC(=O)OCCC1=CC=CC=C1 CNP0003032.0 [0,0,0,0,0,1|1,0,2]=4 45 B15R1.157 CSC=CC(=O)NC=CC1=CC=CC=C1 CNP0332775.0 [0,0,0,0,0,1|2,0,1]=4 46 B12R1.27 CCC(=O)CCC1=CC=CC=C1 CNP0536432.0 [2,0,0,0,0,0|0,0,2]=4 47 B12R1.27 CCC(=O)NNC1=CC=CC=C1 CNP0034463.0 [2,0,0,0,0,0|2,0,0]=4 48 B12R1.27 CCC(=O)OCC1=CC=CC=C1 CNP0120803.0 [2,0,0,0,0,0|1,0,1]=4 49 B12R1.27 CNC(=O)C=CC1=CC=CC=C1 CNP0112097.0 [2,0,0,0,0,0|1,0,0]=3 50 B12R1.27 COC(=O)C=CC1=CC=CC=C1 CNP0290830.0 [2,0,0,0,0,0|0,0,0]=2 51 B12R1.27 COC(=O)C=CC1=CC=CN=C1 CNP0057404.0 [2,0,0,0,0,0|1,0,0]=3 52 B12R1.27 COC(=O)CCC1=CC=CC=C1 CNP0253198.0 [2,0,0,0,0,0|0,0,2]=4 53 B12R1.27 O=C(C=CC1=CC=CC=C1)OO CNP0086495.0 [2,0,0,0,0,0|1,0,0]=3 54 B14R1.520 CC(=CC=CC1=CC=CC=C1)CCO CNP0170958.0 [1,1,0,0,0,0|2,0,0]=4 55 B14R1.716 CCC(=O)OCC=CC1=CC=CC=C1 CNP0002421.0 [1,1,0,0,0,0|0,0,2]=4 56 B14R1.29 CCCC(=O)NN(C)C1=CC=CC=C1 CNP0022032.0 [1,1,0,0,0,0|2,0,0]=4 57 B14R1.29 CCCC(=O)OC(C)C1=CC=CC=C1 CNP0002786.0 [1,1,0,0,0,0|1,0,1]=4 58 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 CNP0238620.0 [1,1,0,0,0,0|0,0,1]=3 59 B14R1.32 CCCC(=O)NNC1=CC=CC(=C1)Cl CNP0047837.0 [1,1,0,0,0,0|2,0,0]=4 60 B14R1.60 CCOC(=O)C(=O)CC1=CC=CC=C1 CNP0350709.0 [1,1,0,0,0,0|0,0,1]=3 61 B14R1.60 CCOC(=O)C(=O)NC1=CC=CC=C1 CNP0299874.0 [1,1,0,0,0,0|1,0,0]=3 62 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 CNP0259364.1 [1,1,0,0,0,0|0,0,2]=4 63 B14R1.60 CCOC(=O)[C@@H](O)CC1=CC=CC=C1 CNP0127852.1 [1,1,0,0,0,0|0,0,2]=4 64 B14R1.502 CCCC(=O)NNC1=CC=C(C=C1)C CNP0160302.0 [1,1,0,0,0,0|2,0,0]=4 65 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)C CNP0157244.0 [1,1,0,0,0,0|0,0,0]=2 66 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)O CNP0246158.0 [1,1,0,0,0,0|0,0,0]=2 67 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)O CNP0586111.0 [1,1,0,0,0,0|0,0,2]=4 68 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)Br CNP0190106.0 [1,1,0,0,0,0|1,0,1]=4 69 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)C CNP0052927.0 [1,1,0,0,0,0|1,0,1]=4 70 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)Cl CNP0111422.0 [1,1,0,0,0,0|1,0,1]=4 71 B14R1.598 CCOC(=O)C=CC1=CC=CC=C1C CNP0298915.0 [1,1,0,0,0,0|0,0,0]=2 72 B14R1.598 CCOC(=O)C=CC1=CC=CC=C1N CNP0070575.0 [1,1,0,0,0,0|0,0,0]=2 73 B14R1.598 CCOC(=O)C=CC1=CC=CC=C1O CNP0145722.0 [1,1,0,0,0,0|0,0,0]=2 74 B14R1.598 CCOC(=O)CCC1=CC=CC=C1O CNP0147042.0 [1,1,0,0,0,0|0,0,2]=4 75 B14R1.598 CCOC(=O)COC1=CC=CC=C1Cl CNP0301851.0 [1,1,0,0,0,0|1,0,1]=4 76 B14R1.756 CC[C@@H](C)C(=O)OCC1=CC=CC=C1 CNP0174832.1 [1,1,0,0,0,0|1,0,1]=4 77 B14R1.818 CC(C)CC(=O)OCC1=CC=CC=C1 CNP0227794.0 [1,1,0,0,0,0|1,0,1]=4 78 B14R1.818 CC(C)OC(=O)C=CC1=CC=CC=C1 CNP0180499.0 [1,1,0,0,0,0|0,0,0]=2 79 B14R1.818 CC(C)OC(=O)CCC1=CC=CC=C1 CNP0542232.0 [1,1,0,0,0,0|0,0,2]=4 80 B14R1.33 CCCCC(=O)OC1=CC=C(C=C1)Br CNP0379282.0 [0,1,0,0,1,0|2,0,0]=4 81 B14R1.34 O=C(NC1=CC=CC(=C1)Cl)OCCCl CNP0069257.0 [0,1,0,0,1,0|2,0,0]=4 82 B14R1.166 CCCCC(=O)C(=O)C1=CC=CC=C1 CNP0565444.0 [0,1,0,0,1,0|1,0,0]=3 83 B14R1.423 CC(C)CNC(=O)CC1=CC=CC=C1 CNP0428187.0 [0,1,0,0,1,0|1,0,1]=4 84 B14R1.423 CC(C)COC(=O)CC1=CC=CC=C1 CNP0003033.0 [0,1,0,0,1,0|0,0,1]=3 85 B14R1.467 CCCCC(=CC1=CC=CC=C1)C=O CNP0012703.0 [0,1,0,0,1,0|1,0,0]=3 86 B16R1.1694 CCCCOC(=O)NCCC1=CC=CC=C1 CNP0288242.0 [0,1,0,0,0,1|0,0,2]=4 87 B16R1.608 C=C(C)CCOC(=O)C=CC1=CC=CC=C1 CNP0192386.0 [0,2,0,0,0,0|0,0,0]=2 88 B16R1.608 CC(=CCOC(=O)C=CC1=CC=CC=C1)C CNP0304663.0 [0,2,0,0,0,0|0,0,1]=3 89 B16R1.608 CC(C)CCNC(=O)C=CC1=CC=CC=C1 CNP0486417.0 [0,2,0,0,0,0|1,0,0]=3 90 B16R1.608 CC(C)CCOC(=O)C=CC1=CC=CC=C1 CNP0002795.0 [0,2,0,0,0,0|0,0,0]=2 91 B16R1.608 CC(C)CCOC(=O)CCC1=CC=CC=C1 CNP0502390.0 [0,2,0,0,0,0|0,0,2]=4 92 B16R1.608 CN(C)CCOC(=O)C=CC1=CC=CC=C1 CNP0121597.0 [0,2,0,0,0,0|0,0,0]=2 93 B16R1.688 CCCCCNC(=O)C=CC1=CC=CC=C1 CNP0232825.0 [0,2,0,0,0,0|1,0,0]=3 94 B16R1.688 NCCCCNC(=O)C=CC1=CC=CC=C1 CNP0608679.0 [0,2,0,0,0,0|1,0,0]=3 95 B16R1.1343 CCC(C)COC(=O)CCC1=CC=CC=C1 CNP0599490.0 [0,2,0,0,0,0|0,0,2]=4 96 B16R1.20760 CCCOC(=O)C=CC1=CC=C(C(=C1)O)O CNP0410431.0 [0,2,0,0,0,0|0,0,0]=2 97 B16R1.20760 O=C(C=CC1=CC=C(C(=C1)O)O)OCCO CNP0182315.0 [0,2,0,0,0,0|1,0,0]=3 98 B16R1.979 CN(CCO)C(=O)C=CC1=CC=C(C=C1)O CNP0112867.0 [0,2,0,0,0,0|2,0,0]=4 99 B16R1.1061 CC(C)CNC(=O)C=CC1=CC=C(C=C1)Cl CNP0531598.0 [0,2,0,0,0,0|1,0,0]=3 100 B16R1.1061 O=C(O)COC(=O)C=CC1=CC=C(C=C1)O CNP0021876.0 [0,2,0,0,0,0|1,0,1]=4 101 B16R1.1480 COC1=CC=C(C=C1)C=CC(=O)NCCN CNP0324871.0 [0,2,0,0,0,0|2,0,0]=4 102 B16R1.4122 C[C@H](O)[C@H](C)OC(=O)/C=C/C1=CC=CC=C1 CNP0234931.1 [0,2,0,0,0,0|0,0,0]=2 103 B16R1.4122 C[C@H](O)[C@H](C)OC(=O)/C=C\C1=CC=CC=C1 CNP0234931.2 [0,2,0,0,0,0|0,0,0]=2 104 B14R2.3 CCCCN1C=CC2=CC=CC=C12 CNP0206702.0 [1,0,0,1,0,0|2,0,0]=4 105 B14R2.101 C(=CC1OCCO1)C2=CC=CC=C2 CNP0002857.0 [1,0,0,1,0,0|1,0,1]=4 106 B14R2.15 CC[C@@H]1C(=O)N[C@@H]1C2=CC=CC=C2 CNP0065289.3 [1,0,0,1,0,0|1,0,1]=4 107 B14R2.15 CC[C@@H]1C(=O)N[C@H]1C2=CC=CC=C2 CNP0065289.1 [1,0,0,1,0,0|1,0,1]=4 108 B14R2.15 CC[C@H]1C(=O)N[C@@H]1C2=CC=CC=C2 CNP0065289.4 [1,0,0,1,0,0|1,0,1]=4 109 B14R2.15 CC[C@H]1C(=O)N[C@H]1C2=CC=CC=C2 CNP0065289.2 [1,0,0,1,0,0|1,0,1]=4 110 B14R2.21 O=C1C=C(SCC1)C2=CC=CC=C2 CNP0044156.0 [1,0,0,1,0,0|1,0,0]=3 111 B14R2.21 O=C1CCC=C(O1)C2=CC=CC=C2 CNP0057103.0 [1,0,0,1,0,0|1,0,1]=4 112 B14R2.112 CCCC1=CC=C2C=CC=CC2=N1 CNP0276038.0 [1,0,0,1,0,0|1,0,0]=3 113 B14R2.112 CCCC1=CN=C2C=CC=CC2=C1 CNP0572034.0 [1,0,0,1,0,0|2,0,0]=4 114 B14R2.112 CCOC1=CC=C2C=CC=CC2=C1 CNP0003641.0 [1,0,0,1,0,0|1,0,0]=3 115 B14R2.203 CCC1=C(C=CC2=CC=CC=C12)C CNP0567644.0 [1,0,0,1,0,0|1,0,1]=4 116 B14R2.598 O=C1C=C([C@@H](O1)O)C2=CC=CC=C2 CNP0314934.1 [1,0,0,1,0,0|1,0,0]=3 117 B16R2.71 O=C1CCCCC1=CNC2=CC=CC=C2 CNP0417644.0 [0,0,0,1,0,1|1,0,0]=3 118 B16R2.2238 O=C(C=CC1=CC=CC=C1)N2CCCC2 CNP0192642.0 [0,1,0,1,0,0|1,0,0]=3 119 B16R2.2441 CCCC=CC1=CC=C2C=CC=CC2=N1 CNP0224840.0 [0,1,0,1,0,0|2,0,0]=4 120 B16R2.2441 CCCCCC1=CC=C2C=CC=CC2=N1 CNP0150480.0 [0,1,0,1,0,0|2,0,0]=4 121 B16R2.132 O[C@H]1CO[C@@H](OC1)/C=C/C2=CC=CC=C2 CNP0231251.1 [0,1,0,1,0,0|0,0,2]=4 122 B16R2.132 O[C@H]1CO[C@H](OC1)/C=C/C2=CC=CC=C2 CNP0231251.2 [0,1,0,1,0,0|0,0,2]=4 123 B16R2.1285 CCCOC1=CC=C2C=CC(=O)OC2=C1 CNP0407292.0 [0,1,0,1,0,0|2,0,0]=4 124 B16R2.767 CCCC(=O)C1=CC=C2C=CC=CC2=C1 CNP0146796.0 [0,1,0,1,0,0|2,0,0]=4 125 B16R2.477 CC(C)CCC1=CC=C2C=CC=CC2=C1 CNP0201965.0 [0,1,0,1,0,0|2,0,0]=4 126 B16R2.477 CC(C)COC1=CC=C2C=CC=CC2=C1 CNP0362324.0 [0,1,0,1,0,0|1,0,0]=3 127 B16R3.1720 C1=CC=C2C=C3CCCCC3=CC2=C1 CNP0172811.0 [0,0,0,2,0,0|2,0,0]=4 128 B16R3.1720 C1=CC=C2C=C3OCCCC3=CC2=C1 CNP0308762.0 [0,0,0,2,0,0|1,0,0]=3 129 B16R3.1720 C1=CC=C2N=C3CCCCC3=CC2=C1 CNP0257287.0 [0,0,0,2,0,0|2,0,0]=4 130 B16R3.17428 O=C1ON[C@H]2C1=CC3=CC=CC=C3C2 CNP0393391.1 [0,0,0,2,0,0|1,0,0]=3 131 B12R1.32 CCCC(=O)CC1=CC=CC=C1 CNP0538882.0 [1,0,0,0,1,0|0,0,1]=3 132 B12R1.32 CCCC(=O)OC1=CC=CC=C1 CNP0002394.0 [1,0,0,0,1,0|1,0,0]=3 133 B12R1.32 CCNC(=O)CC1=CC=CC=C1 CNP0069475.0 [1,0,0,0,1,0|1,0,1]=4 134 B12R1.32 CCOC(=O)CC1=CC=CC=C1 CNP0112866.0 [1,0,0,0,1,0|0,0,1]=3 135 B12R1.32 CCOC(=O)NC1=CC=CC=C1 CNP0116883.0 [1,0,0,0,1,0|1,0,0]=3 136 B12R1.32 CCOC(=S)NC1=CC=CC=C1 CNP0226110.0 [1,0,0,0,1,0|1,1,0]=4 137 B12R1.51 CCOC(=O)C=CC1=CC=CO1 CNP0393898.0 [1,0,0,0,1,0|1,0,0]=3 138 B12R1.51 CCOC(=O)C=CC1=CNC=N1 CNP0226961.0 [1,0,0,0,1,0|2,0,0]=4 139 B12R1.30 C=CCOC(=O)C1=CC=CC=C1 CNP0100792.0 [0,0,0,0,2,0|0,0,2]=4 140 B12R1.30 CCC=CC(=O)C1=CC=CC=C1 CNP0126866.0 [0,0,0,0,2,0|1,0,1]=4 141 B12R1.30 CCCCC(=O)C1=CC=CC=C1 CNP0346038.0 [0,0,0,0,2,0|1,0,0]=3 142 B12R1.30 CCCN=C(C)C1=CC=CC=C1 CNP0446142.0 [0,0,0,0,2,0|2,0,0]=4 143 B12R1.30 CCCNC(=O)C1=CC=CC=C1 CNP0268362.0 [0,0,0,0,2,0|1,0,0]=3 144 B12R1.30 CCCOC(=O)C1=CC=CC=C1 CNP0261819.0 [0,0,0,0,2,0|0,0,0]=2 145 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 CNP0513261.0 [0,0,0,0,2,0|2,0,0]=4 146 B12R1.30 O=C(NCCO)C1=CC=CC=C1 CNP0563015.0 [0,0,0,0,2,0|2,0,0]=4 147 B12R1.30 O=C(OCCO)C1=CC=CC=C1 CNP0577678.0 [0,0,0,0,2,0|1,0,0]=3 148 B16R1.1465 CCCCC(=O)OCC=CC1=CC=CC=C1 CNP0538386.0 [0,0,0,0,0,2|1,0,0]=3