0 B15R2.4367 CNCc1cc(c2c(c1)OCO2)OC 207a_100102657272_100000185029 [1,0,0,0,0,0|1,0,0]=2 1 B15R2.4367 CNCc1cc(c2c(c1)OCO2)OC 2230a_100025755791_200000210301 [1,0,0,0,0,0|1,0,0]=2 2 B15R2.4367 CNCc1cc(c2c(c1)OCO2)OC 34a_100025755791_200000210301 [1,0,0,0,0,0|1,0,0]=2 3 B15R2.4367 COc1cc(cc2c1OCO2)CN[13CH3] 2230a_100025755791_200025704644 [1,0,0,0,0,0|1,0,0]=2 4 B15R2.4367 COc1cc(cc2c1OCO2)CN[13CH3] 34a_100025755791_200025704644 [1,0,0,0,0,0|1,0,0]=2 5 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Br 270004a_100102631434_100000682445 [1,0,0,0,0,0|3,0,0]=4 6 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Cl 270004a_100102631434_100000016197 [1,0,0,0,0,0|3,0,0]=4 7 B17R2.68833 COc1cc(cc2c1OCO2)C(=O)C(C)C 1458a_100011218003_100000210206 [0,1,0,0,0,0|1,0,1]=3 8 B17R2.68833 COc1cc(cc2c1OCO2)C(=O)N(C)C 11a_100102631434_100011218003 [0,1,0,0,0,0|2,0,1]=4 9 B17R2.68833 COc1cc(cc2c1OCO2)C(=O)N(C)C 1626a_100102631434_100011218003 [0,1,0,0,0,0|2,0,1]=4 10 B17R2.68833 COc1cc(cc2c1OCO2)C(=O)N(C)C 240690a_100102631434_100011218003 [0,1,0,0,0,0|2,0,1]=4 11 B17R2.68833 COc1cc(cc2c1OCO2)C(=O)N(C)C 527a_100102631434_100011218003 [0,1,0,0,0,0|2,0,1]=4 12 B17R2.68884 COc1cc(cc2c1OCO2)C=C(C)C#N 6a_100000185029_200000212204 [0,1,0,0,0,0|0,0,3]=4 13 B15R1.369 COc1cc(cc(c1OC)Br)CN(C)C 270004a_100102631434_100000183470 [0,0,1,0,0,0|3,0,0]=4 14 B15R1.369 COc1cc(cc(c1OC)Cl)CC(=O)C 34a_200010006941_200000210301 [0,0,1,0,0,0|2,0,1]=4 15 B15R1.369 COc1cc(cc(c1OC)Cl)CC(=O)C 7a_200010006941_200000210301 [0,0,1,0,0,0|2,0,1]=4 16 B15R1.369 COc1cc(cc(c1OC)Cl)CN(C)C 270004a_100102631434_100000184546 [0,0,1,0,0,0|3,0,0]=4 17 B15R1.369 COc1cc(cc(c1OC)I)CN(C)C 270004a_100102631434_100000188315 [0,0,1,0,0,0|3,0,0]=4 18 B15R1.369 COc1cc(cc(c1O[13CH3])Cl)CC(=O)C 34a_200010006941_200025704644 [0,0,1,0,0,0|2,0,1]=4 19 B15R1.369 COc1cc(cc(c1O[13CH3])Cl)CC(=O)C 7a_200010006941_200025704644 [0,0,1,0,0,0|2,0,1]=4 20 B15R1.390 COc1cc(cc(c1C)OC)CN(C)C 270004a_100102631434_200012186444 [0,0,1,0,0,0|3,0,0]=4 21 B15R1.390 COc1cc(cc(c1Cl)OC)NC(C)C 34a_100009986809_100000210206 [0,0,1,0,0,0|3,0,0]=4 22 B15R1.390 COc1cc(cc(c1F)OC)CN(C)C 270004a_100102631434_200009839898 [0,0,1,0,0,0|3,0,0]=4 23 B15R1.390 COc1cc(cc(c1F)OC)SC(C)C 62a_100000210206_100015304952 [0,0,1,0,0,0|3,0,0]=4 24 B15R1.390 COc1cc(cc(c1F)OC)SC(C)C 62a_100015304952_100000210206 [0,0,1,0,0,0|3,0,0]=4 25 B15R1.390 COc1cc(cc(c1O)OC)C=C(C)C 271570a_100102525489_100000691893 [0,0,1,0,0,0|1,0,2]=4 26 B15R1.390 COc1cc(cc(c1O)OC)CC(=O)C 1458a_100000043605_200000210301 [0,0,1,0,0,0|1,0,1]=3 27 B15R1.390 COc1cc(cc(c1O)OC)CC(=O)[13CH3] 1458a_100000043605_200025704644 [0,0,1,0,0,0|1,0,1]=3 28 B15R1.9548 CCOc1ccc(cc1OC)CC(=O)C 1458a_100000061229_200000210301 [0,0,1,0,0,0|2,0,1]=4 29 B15R1.9548 CCOc1ccc(cc1OC)CC(=O)C 34a_200000039568_100000210202 [0,0,1,0,0,0|2,0,1]=4 30 B15R1.9548 CCOc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000061229_200025704644 [0,0,1,0,0,0|2,0,1]=4 31 B15R1.9548 CCOc1ccc(cc1OC)CN(C)C 2230a_100025772790_200000210301 [0,0,1,0,0,0|3,0,0]=4 32 B15R1.9548 CCOc1ccc(cc1OC)CN(C)C 269982a_100025772790_200000210301 [0,0,1,0,0,0|3,0,0]=4 33 B15R1.9548 CCOc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000169853 [0,0,1,0,0,0|3,0,0]=4 34 B15R1.9548 CCOc1ccc(cc1OC)CN(C)[13CH3] 2230a_100025772790_200025704644 [0,0,1,0,0,0|3,0,0]=4 35 B15R1.9548 CCOc1ccc(cc1OC)CN(C)[13CH3] 269982a_100025772790_200025704644 [0,0,1,0,0,0|3,0,0]=4 36 B15R1.9548 CCOc1ccc(cc1OC)NC(C)C 2230a_100000184985_100000210206 [0,0,1,0,0,0|3,0,0]=4 37 B15R1.9548 CCOc1ccc(cc1OC)NC(C)C 34a_100000184985_100000210206 [0,0,1,0,0,0|3,0,0]=4 38 B15R1.9548 COc1cc(ccc1OCF)CC(=O)C 34a_200000039568_100015361967 [0,0,1,0,0,0|2,0,1]=4 39 B15R2.22662 COc1cc(cc2c1OCO2)C(=O)C 1458a_100011218003_200000210301 [0,0,0,0,1,0|1,0,1]=3 40 B15R2.22662 COc1cc(cc2c1OCO2)C(=O)[13CH3] 1458a_100011218003_200025704644 [0,0,0,0,1,0|1,0,1]=3 41 B17R2.68834 COc1cc(cc2c1OCO2)CNC(=O)C 11a_100025755791_100015343762 [0,0,0,0,0,1|1,0,1]=3 42 B17R2.68834 COc1cc(cc2c1OCO2)CNC(=O)C 1626a_100025755791_100015343762 [0,0,0,0,0,1|1,0,1]=3 43 B17R2.68834 COc1cc(cc2c1OCO2)CNC(=O)C 240690a_100025755791_100015343762 [0,0,0,0,0,1|1,0,1]=3 44 B17R2.68834 COc1cc(cc2c1OCO2)CNC(=O)C 527a_100025755791_100103153847 [0,0,0,0,0,1|1,0,1]=3 45 B17R2.68834 COc1cc(cc2c1OCO2)CNC(C)C 207a_100138425928_100000185029 [0,0,0,0,0,1|1,0,0]=2 46 B17R2.68834 COc1cc(cc2c1OCO2)CNC(C)C 2230a_100025755791_100000210206 [0,0,0,0,0,1|1,0,0]=2 47 B17R2.68834 COc1cc(cc2c1OCO2)CNC(C)C 34a_100025755791_100000210206 [0,0,0,0,0,1|1,0,0]=2 48 B17R2.68840 COc1cc(cc2c1OCCO2)CN(C)C 270004a_100102631434_100000010823 [0,0,0,0,0,1|2,0,0]=3 49 B14R1.343 COc1cc(cc(c1O)O)SC(C)C 62a_100000210206_200159242197 [1,0,1,0,0,0|2,0,0]=4 50 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Br 207a_100102657272_100000183470 [1,0,1,0,0,0|2,0,0]=4 51 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Br 270004a_106832991635_100000183470 [1,0,1,0,0,0|2,0,0]=4 52 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Br 34a_100000748475_200000210301 [1,0,1,0,0,0|2,0,0]=4 53 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Cl 207a_100102657272_100000184546 [1,0,1,0,0,0|2,0,0]=4 54 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Cl 270004a_106832991635_100000184546 [1,0,1,0,0,0|2,0,0]=4 55 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)I 207a_100102657272_100000188315 [1,0,1,0,0,0|2,0,0]=4 56 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)I 270004a_106832991635_100000188315 [1,0,1,0,0,0|2,0,0]=4 57 B14R1.3237 COCc1cc(c(c(c1)OC)OC)Br 34a_200000215730_200000210301 [1,0,1,0,0,0|2,0,0]=4 58 B14R1.3237 COc1cc(cc(c1OC)Br)CN[13CH3] 34a_100000748475_200025704644 [1,0,1,0,0,0|2,0,0]=4 59 B14R1.3237 COc1cc(cc(c1OC)Br)CO[13CH3] 34a_200000215730_200025704644 [1,0,1,0,0,0|2,0,0]=4 60 B14R1.3651 COc1cc(ccc1CO)NC(C)C 34a_100012183141_100000210206 [1,0,1,0,0,0|2,0,0]=4 61 B14R1.3651 COc1cc(ccc1CO)OC(C)C 34a_200000116926_100000210206 [1,0,1,0,0,0|2,0,0]=4 62 B14R1.3651 COc1cc(ccc1CO)SC(C)C 62a_100000210206_100011277633 [1,0,1,0,0,0|2,0,0]=4 63 B14R1.3651 COc1cc(ccc1CO)SC(C)C 62a_100011277633_100000210206 [1,0,1,0,0,0|2,0,0]=4 64 B14R1.3651 COc1cc(ccc1O[13CH3])CC(=O)C 34a_200000039568_200025704644 [1,0,1,0,0,0|1,0,1]=4 65 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 1458a_100000184093_200000210301 [1,0,1,0,0,0|1,0,1]=4 66 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 34a_200000039568_200000210301 [1,0,1,0,0,0|1,0,1]=4 67 B14R1.3651 COc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000184093_200025704644 [1,0,1,0,0,0|1,0,1]=4 68 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100000180827_200000210301 [1,0,1,0,0,0|2,0,0]=4 69 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100102631434_100011233839 [1,0,1,0,0,0|2,0,0]=4 70 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100000180827_200000210301 [1,0,1,0,0,0|2,0,0]=4 71 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100102631434_100011233839 [1,0,1,0,0,0|2,0,0]=4 72 B14R1.3651 COc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000170513 [1,0,1,0,0,0|2,0,0]=4 73 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 2230a_100000180827_200025704644 [1,0,1,0,0,0|2,0,0]=4 74 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 269982a_100000180827_200025704644 [1,0,1,0,0,0|2,0,0]=4 75 B14R1.3651 COc1ccc(cc1OC)NC(C)C 34a_100000187404_100000210206 [1,0,1,0,0,0|2,0,0]=4 76 B14R1.3651 COc1ccc(cc1OC)OC(C)C 34a_100000039706_100000210206 [1,0,1,0,0,0|2,0,0]=4 77 B14R1.3651 COc1ccc(cc1OC)SC(C)C 62a_100000210206_100011356967 [1,0,1,0,0,0|2,0,0]=4 78 B14R1.379 COc1cc(cc(c1)NC(C)C)CO 2230a_100012182899_100000210206 [1,0,1,0,0,0|2,0,0]=4 79 B14R1.379 COc1cc(cc(c1)NC(C)C)CO 34a_100012182899_100000210206 [1,0,1,0,0,0|2,0,0]=4 80 B14R1.379 COc1cc(cc(c1)OC(C)C)OC 34a_100000181322_100000210206 [1,0,1,0,0,0|2,0,0]=4 81 B14R1.379 COc1cc(cc(c1)OC(C)C)OC 7a_100000181322_100000210206 [1,0,1,0,0,0|2,0,0]=4 82 B14R1.379 COc1cc(cc(c1)OC)CC(=O)C 1458a_100000070787_100011215721 [1,0,1,0,0,0|1,0,1]=4 83 B14R1.379 COc1cc(cc(c1)OC)CC(=O)C 1458a_100011214962_200000210301 [1,0,1,0,0,0|1,0,1]=4 84 B14R1.379 COc1cc(cc(c1)OC)CC(=O)[13CH3] 1458a_100011214962_200025704644 [1,0,1,0,0,0|1,0,1]=4 85 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 2230a_100000207622_200000210301 [1,0,1,0,0,0|2,0,0]=4 86 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 2230a_100102631434_100011215721 [1,0,1,0,0,0|2,0,0]=4 87 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 269982a_100000207622_200000210301 [1,0,1,0,0,0|2,0,0]=4 88 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 269982a_100102631434_100011215721 [1,0,1,0,0,0|2,0,0]=4 89 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 270004a_100102631434_100000211681 [1,0,1,0,0,0|2,0,0]=4 90 B14R1.379 COc1cc(cc(c1)OC)CN(C)[13CH3] 2230a_100000207622_200025704644 [1,0,1,0,0,0|2,0,0]=4 91 B14R1.379 COc1cc(cc(c1)OC)CN(C)[13CH3] 269982a_100000207622_200025704644 [1,0,1,0,0,0|2,0,0]=4 92 B14R1.379 COc1cc(cc(c1)OC)NC(C)C 2230a_100000210928_100000210206 [1,0,1,0,0,0|2,0,0]=4 93 B14R1.379 COc1cc(cc(c1)OC)NC(C)C 34a_100000210928_100000210206 [1,0,1,0,0,0|2,0,0]=4 94 B14R1.379 COc1cc(cc(c1)SC(C)C)CO 62a_100000210206_100009995317 [1,0,1,0,0,0|2,0,0]=4 95 B14R1.379 COc1cc(cc(c1)SC(C)C)CO 62a_100009995317_100000210206 [1,0,1,0,0,0|2,0,0]=4 96 B14R1.379 COc1cc(cc(c1)SC(C)C)OC 62a_100000210206_100000685218 [1,0,1,0,0,0|2,0,0]=4 97 B14R1.3236 CC=Cc1cc(c(c(c1)OC)O)OC 271570a_100016259895_100000691893 [1,0,1,0,0,0|0,0,2]=4 98 B14R1.3236 CCNc1cc(c(c(c1)OC)Cl)OC 34a_100009986809_100000210202 [1,0,1,0,0,0|2,0,0]=4 99 B14R1.3236 CCSc1cc(c(c(c1)OC)F)OC 62a_100000210202_100015304952 [1,0,1,0,0,0|2,0,0]=4 100 B14R1.3236 CCSc1cc(c(c(c1)OC)F)OC 62a_100015304952_100000210202 [1,0,1,0,0,0|2,0,0]=4 101 B14R1.3236 CNCc1cc(c(c(c1)OC)Br)OC 207a_100102657272_100009814401 [1,0,1,0,0,0|2,0,0]=4 102 B14R1.3236 CNCc1cc(c(c(c1)OC)C)OC 207a_100102657272_200012186444 [1,0,1,0,0,0|2,0,0]=4 103 B14R1.3236 CNCc1cc(c(c(c1)OC)C)OC 270004a_106832991635_200012186444 [1,0,1,0,0,0|2,0,0]=4 104 B14R1.3236 CNCc1cc(c(c(c1)OC)F)OC 207a_100102657272_200009839898 [1,0,1,0,0,0|2,0,0]=4 105 B14R1.3236 CNCc1cc(c(c(c1)OC)F)OC 270004a_106832991635_200009839898 [1,0,1,0,0,0|2,0,0]=4 106 B14R1.3236 COCc1cc(c(c(c1)OC)Br)OC 34a_100010169844_200000210301 [1,0,1,0,0,0|2,0,0]=4 107 B14R1.3236 COCc1cc(c(c(c1)OC)Br)OC 7a_100010169844_200000210301 [1,0,1,0,0,0|2,0,0]=4 108 B14R1.3236 COc1cc(cc(c1Br)OC)CO[13CH3] 34a_100010169844_200025704644 [1,0,1,0,0,0|2,0,0]=4 109 B14R1.3236 COc1cc(cc(c1Br)OC)CO[13CH3] 7a_100010169844_200025704644 [1,0,1,0,0,0|2,0,0]=4 110 B14R1.6788 CCCc1ccc(c(c1)OC)OCC 34a_100000012292_100000210202 [1,0,1,0,0,0|1,0,0]=3 111 B14R1.6788 CCCc1ccc(c(c1)OC)OCC 7a_100000012292_100000210202 [1,0,1,0,0,0|1,0,0]=3 112 B14R1.6788 CCCc1ccc(c(c1)OC)OCF 34a_100000012292_100015361967 [1,0,1,0,0,0|1,0,0]=3 113 B14R1.6788 CCCc1ccc(c(c1)OC)OCF 7a_100000012292_100015361967 [1,0,1,0,0,0|1,0,0]=3 114 B14R1.6788 CCNc1ccc(c(c1)OC)OCC 2230a_100000184985_100000210202 [1,0,1,0,0,0|2,0,0]=4 115 B14R1.6788 CCNc1ccc(c(c1)OC)OCC 34a_100000184985_100000210202 [1,0,1,0,0,0|2,0,0]=4 116 B14R1.6788 CCOc1ccc(cc1OC)CCBr 34a_100010741665_100000210202 [1,0,1,0,0,0|2,0,0]=4 117 B14R1.6788 CCOc1ccc(cc1OC)CCBr 7a_100010741665_100000210202 [1,0,1,0,0,0|2,0,0]=4 118 B14R1.6788 CCOc1ccc(cc1OC)CCN 34a_100000756042_100000210202 [1,0,1,0,0,0|1,0,0]=3 119 B14R1.6788 CCOc1ccc(cc1OC)CCO 34a_100011215244_100000210202 [1,0,1,0,0,0|2,0,0]=4 120 B14R1.6788 CCOc1ccc(cc1OC)CNC 207a_100102657272_100000169853 [1,0,1,0,0,0|2,0,0]=4 121 B14R1.6788 CCOc1ccc(cc1OC)CNC 2230a_200000739100_200000210301 [1,0,1,0,0,0|2,0,0]=4 122 B14R1.6788 CCOc1ccc(cc1OC)CNC 270004a_106832991635_100000169853 [1,0,1,0,0,0|2,0,0]=4 123 B14R1.6788 CCOc1ccc(cc1OC)CNC 34a_200000739100_200000210301 [1,0,1,0,0,0|2,0,0]=4 124 B14R1.6788 CCOc1ccc(cc1OC)CN[13CH3] 2230a_200000739100_200025704644 [1,0,1,0,0,0|2,0,0]=4 125 B14R1.6788 CCOc1ccc(cc1OC)CN[13CH3] 34a_200000739100_200025704644 [1,0,1,0,0,0|2,0,0]=4 126 B14R1.6788 CCOc1ccc(cc1OC)COC 34a_100000184821_200000210301 [1,0,1,0,0,0|2,0,0]=4 127 B14R1.6788 CCOc1ccc(cc1OC)CO[13CH3] 34a_100000184821_200025704644 [1,0,1,0,0,0|2,0,0]=4 128 B14R1.6788 COc1cc(ccc1OCF)CCBr 34a_100010741665_100015361967 [1,0,1,0,0,0|2,0,0]=4 129 B14R1.6788 COc1cc(ccc1OCF)CCBr 7a_100010741665_100015361967 [1,0,1,0,0,0|2,0,0]=4 130 B14R1.6788 COc1cc(ccc1OCF)CCN 34a_100000756042_100015361967 [1,0,1,0,0,0|1,0,0]=3 131 B14R1.6788 COc1cc(ccc1OCF)CCO 34a_100011215244_100015361967 [1,0,1,0,0,0|2,0,0]=4 132 B14R2.587 CNCc1cc(c2c(c1)OCO2)Br 207a_100102657272_100000682445 [2,0,0,0,0,0|2,0,0]=4 133 B14R2.587 CNCc1cc(c2c(c1)OCO2)Br 270004a_106832991635_100000682445 [2,0,0,0,0,0|2,0,0]=4 134 B14R2.587 CNCc1cc(c2c(c1)OCO2)Cl 207a_100102657272_100000016197 [2,0,0,0,0,0|2,0,0]=4 135 B14R2.587 CNCc1cc(c2c(c1)OCO2)Cl 270004a_106832991635_100000016197 [2,0,0,0,0,0|2,0,0]=4 136 B14R2.587 COCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_200000210301 [2,0,0,0,0,0|2,0,0]=4 137 B14R2.587 COCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_200000210301 [2,0,0,0,0,0|2,0,0]=4 138 B14R2.587 [13CH3]OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_200025704644 [2,0,0,0,0,0|2,0,0]=4 139 B14R2.587 [13CH3]OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_200025704644 [2,0,0,0,0,0|2,0,0]=4 140 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [2,0,0,0,0,0|1,0,1]=4 141 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000210206 [2,0,0,0,0,0|2,0,0]=4 142 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210206 [2,0,0,0,0,0|2,0,0]=4 143 B14R2.1008 CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210206 [2,0,0,0,0,0|2,0,0]=4 144 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_200000210301 [2,0,0,0,0,0|2,0,0]=4 145 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_200000210301 [2,0,0,0,0,0|2,0,0]=4 146 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100102631434_100000189651 [2,0,0,0,0,0|2,0,0]=4 147 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 2230a_100000186720_200025704644 [2,0,0,0,0,0|2,0,0]=4 148 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 269982a_100000186720_200025704644 [2,0,0,0,0,0|2,0,0]=4 149 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [2,0,0,0,0,0|1,0,1]=4 150 B16R1.412 COc1cc(cc(c1OC)OC)CC(=O)C 1458a_100000209934_200000210301 [0,1,1,0,0,0|1,0,1]=4 151 B16R1.412 COc1cc(cc(c1OC)OC)CC(=O)C 34a_200009994829_200000210301 [0,1,1,0,0,0|1,0,1]=4 152 B16R1.412 COc1cc(cc(c1OC)OC)CC(=O)[13CH3] 1458a_100000209934_200025704644 [0,1,1,0,0,0|1,0,1]=4 153 B16R1.412 COc1cc(cc(c1OC)OC)CN(C)C 2230a_100000207510_200000210301 [0,1,1,0,0,0|2,0,0]=4 154 B16R1.412 COc1cc(cc(c1OC)OC)CN(C)C 2230a_100102631434_100011218709 [0,1,1,0,0,0|2,0,0]=4 155 B16R1.412 COc1cc(cc(c1OC)OC)CN(C)C 269982a_100000207510_200000210301 [0,1,1,0,0,0|2,0,0]=4 156 B16R1.412 COc1cc(cc(c1OC)OC)CN(C)C 269982a_100102631434_100011218709 [0,1,1,0,0,0|2,0,0]=4 157 B16R1.412 COc1cc(cc(c1OC)OC)CN(C)C 270004a_100102631434_100000210037 [0,1,1,0,0,0|2,0,0]=4 158 B16R1.412 COc1cc(cc(c1OC)OC)CN(C)[13CH3] 2230a_100000207510_200025704644 [0,1,1,0,0,0|2,0,0]=4 159 B16R1.412 COc1cc(cc(c1OC)OC)CN(C)[13CH3] 269982a_100000207510_200025704644 [0,1,1,0,0,0|2,0,0]=4 160 B16R1.412 COc1cc(cc(c1OC)OC)NC(C)C 34a_100000209829_100000210206 [0,1,1,0,0,0|2,0,0]=4 161 B16R1.412 COc1cc(cc(c1OC)OC)OC(C)C 34a_100000757337_100000210206 [0,1,1,0,0,0|2,0,0]=4 162 B16R1.412 COc1cc(cc(c1OC)O[13CH3])CC(=O)C 34a_200009994829_200025704644 [0,1,1,0,0,0|1,0,1]=4 163 B16R1.413 COc1cc(cc(c1OC)O)C(=O)C(C)C 1458a_100000032013_100000210206 [0,1,1,0,0,0|1,0,1]=4 164 B16R1.11569 CNC(C)Cc1cc(c(c(c1)OC)OC)O 270004a_106832991635_200009994829 [0,1,1,0,0,0|0,0,0]=2 165 B16R1.422 COc1cc(cc(c1O)OC)C(=O)C(C)C 1458a_100000692901_100000210206 [0,1,1,0,0,0|1,0,1]=4 166 B16R1.11588 CCC(=O)Cc1cc(c(c(c1)OC)O)OC 1458a_100000043605_100000210202 [0,1,1,0,0,0|1,0,1]=4 167 B16R1.11588 CNC(=O)Cc1cc(c(c(c1)OC)O)OC 240690a_100102657272_100000043605 [0,1,1,0,0,0|1,0,1]=4 168 B16R1.11588 CNC(=O)Cc1cc(c(c(c1)OC)O)OC 527a_100102657272_100000043605 [0,1,1,0,0,0|1,0,1]=4 169 B16R1.11588 COc1cc(cc(c1O)OC)CC(=O)CF 1458a_100000043605_100015361967 [0,1,1,0,0,0|1,0,1]=4 170 B16R1.17853 COc1cc(ccc1OCCO)CC(=O)C 34a_200000039568_100000211926 [0,1,1,0,0,0|1,0,1]=4 171 B16R1.17853 COc1cc(ccc1OCCO)SC(C)C 62a_100000210206_100012347953 [0,1,1,0,0,0|2,0,0]=4 172 B16R1.17853 COc1cc(ccc1OCCO)SC(C)C 62a_100012347953_100000210206 [0,1,1,0,0,0|2,0,0]=4 173 B16R2.12177 CCNCc1cc(c2c(c1)OCO2)OC 207a_100015525214_100000185029 [1,1,0,0,0,0|0,0,0]=2 174 B16R2.12177 CCNCc1cc(c2c(c1)OCO2)OC 2230a_100025755791_100000210202 [1,1,0,0,0,0|0,0,0]=2 175 B16R2.12177 CCNCc1cc(c2c(c1)OCO2)OC 34a_100025755791_100000210202 [1,1,0,0,0,0|0,0,0]=2 176 B16R2.12177 COc1cc(cc2c1OCO2)CNCF 34a_100025755791_100015361967 [1,1,0,0,0,0|1,0,0]=3 177 B16R2.40075 CCC(=O)c1cc(c2c(c1)OCO2)OC 1458a_100011218003_100000210202 [1,1,0,0,0,0|0,0,1]=3 178 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 11a_106832991635_100011218003 [1,1,0,0,0,0|1,0,1]=4 179 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 1626a_100102657272_100011218003 [1,1,0,0,0,0|1,0,1]=4 180 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 240690a_100102657272_100011218003 [1,1,0,0,0,0|1,0,1]=4 181 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 527a_100102657272_100011218003 [1,1,0,0,0,0|1,0,1]=4 182 B16R2.40075 COc1cc(cc2c1OCO2)C(=O)CF 1458a_100011218003_100015361967 [1,1,0,0,0,0|1,0,1]=4 183 B18R2.113905 C=C(C)CC(=O)c1cc(c2c(c1)OCO2)OC 1458a_100011218003_100000748629 [0,1,0,0,0,1|1,0,1]=4 184 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)CC(=O)N 1458a_100011218003_100000187820 [0,1,0,0,0,1|1,0,1]=4 185 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)CC(C)C 1458a_100011218003_100000210624 [0,1,0,0,0,1|1,0,0]=3 186 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)CC(C)O 1458a_100011218003_100011218427 [0,1,0,0,0,1|1,0,0]=3 187 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)CC(F)F 1458a_100011218003_100011934356 [0,1,0,0,0,1|2,0,0]=4 188 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)NC(C)C 11a_100138425928_100011218003 [0,1,0,0,0,1|1,0,1]=4 189 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)NC(C)C 1626a_100138425928_100011218003 [0,1,0,0,0,1|1,0,1]=4 190 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)NC(C)C 240690a_100138425928_100011218003 [0,1,0,0,0,1|1,0,1]=4 191 B18R2.113905 COc1cc(cc2c1OCO2)C(=O)NC(C)C 527a_100138425928_100011218003 [0,1,0,0,0,1|1,0,1]=4 192 B18R2.113908 C#CC(C)NCc1cc(c2c(c1)OCO2)OC 34a_100025755791_200000035995 [0,1,0,0,0,1|1,0,0]=3 193 B18R2.113908 CCC(=O)NCc1cc(c2c(c1)OCO2)OC 11a_100025755791_100000210414 [0,1,0,0,0,1|1,0,1]=4 194 B18R2.113908 CCC(=O)NCc1cc(c2c(c1)OCO2)OC 1626a_100025755791_100000210414 [0,1,0,0,0,1|1,0,1]=4 195 B18R2.113908 CCC(=O)NCc1cc(c2c(c1)OCO2)OC 240690a_100025755791_100000210414 [0,1,0,0,0,1|1,0,1]=4 196 B18R2.113908 CCC(=O)NCc1cc(c2c(c1)OCO2)OC 527a_100025755791_100000210414 [0,1,0,0,0,1|1,0,1]=4 197 B18R2.113908 CCC(C)NCc1cc(c2c(c1)OCO2)OC 207a_100000209981_100000185029 [0,1,0,0,0,1|1,0,0]=3 198 B18R2.113908 CCC(C)NCc1cc(c2c(c1)OCO2)OC 2230a_100025755791_100000758301 [0,1,0,0,0,1|1,0,0]=3 199 B18R2.113908 CCC(C)NCc1cc(c2c(c1)OCO2)OC 34a_100025755791_100011215416 [0,1,0,0,0,1|1,0,0]=3 200 B18R2.113908 CNC(=O)NCc1cc(c2c(c1)OCO2)OC 2708a_100025755791_106832991635 [0,1,0,0,0,1|1,0,1]=4 201 B18R2.113908 CNC(=O)NCc1cc(c2c(c1)OCO2)OC 2708a_100102657272_100025755791 [0,1,0,0,0,1|1,0,1]=4 202 B18R2.113908 CNC(=O)NCc1cc(c2c(c1)OCO2)OC 273464a_100025755791_100102657272 [0,1,0,0,0,1|1,0,1]=4 203 B18R2.113908 CNC(=O)NCc1cc(c2c(c1)OCO2)OC 273464a_100102657272_100025755791 [0,1,0,0,0,1|1,0,1]=4 204 B18R2.113908 CNC(=O)NCc1cc(c2c(c1)OCO2)OC 512a_100025755791_100102657272 [0,1,0,0,0,1|1,0,1]=4 205 B18R2.113908 CNC(=O)NCc1cc(c2c(c1)OCO2)OC 512a_106832991638_100025755791 [0,1,0,0,0,1|1,0,1]=4 206 B18R2.113908 COc1cc(cc2c1OCO2)CNC(=O)CO 240690a_100025755791_100000210174 [0,1,0,0,0,1|1,0,1]=4 207 B18R2.113908 COc1cc(cc2c1OCO2)CNC(=O)CO 527a_100025755791_100000210174 [0,1,0,0,0,1|1,0,1]=4 208 B18R2.113908 COc1cc(cc2c1OCO2)CNC(C)C#N 2230a_100025755791_100000184139 [0,1,0,0,0,1|0,0,1]=3 209 B18R2.113908 COc1cc(cc2c1OCO2)CNC(C)CO 2230a_100025755791_100012180447 [0,1,0,0,0,1|1,0,0]=3 210 B18R2.113908 COc1cc(cc2c1OCO2)CNC(C)CO 34a_100025755791_100012180447 [0,1,0,0,0,1|1,0,0]=3 211 B18R2.113908 COc1cc(cc2c1OCO2)CN[C@H](C)CF 207a_100102880703_100000185029 [0,1,0,0,0,1|1,0,0]=3 212 B18R2.113908 COc1cc(cc2c1OCO2)CN[C@H](C)CO 207a_100000737577_100000185029 [0,1,0,0,0,1|1,0,0]=3 213 B18R2.832106 COc1cc(cc2c1OCO2)CNC(C)(C)C 207a_100000715429_100000185029 [0,1,0,0,0,1|1,0,0]=3 214 B18R2.832106 COc1cc(cc2c1OCO2)CNC(C)(C)C 34a_100025755791_100000210625 [0,1,0,0,0,1|1,0,0]=3 215 B18R2.832106 COc1cc(cc2c1OCO2)CNC(F)(F)F 34a_100025755791_200103152311 [0,1,0,0,0,1|2,0,0]=4 216 B18R2.832106 COc1cc(cc2c1OCO2)CNS(=O)(=O)C 40a_100025755791_100000738038 [0,1,0,0,0,1|2,0,0]=4 217 B18R2.830727 COc1cc(cc2c1OCCO2)C(=O)C(C)C 1458a_100000198598_100000210206 [0,1,0,0,0,1|1,0,1]=4 218 B18R2.113910 C#CC(C)C(=O)c1cc(c2c(c1)OCO2)OC 1458a_100011218003_200000035995 [0,2,0,0,0,0|1,0,1]=4 219 B18R2.113910 CCC(C)C(=O)c1cc(c2c(c1)OCO2)OC 1458a_100011218003_100000758301 [0,2,0,0,0,0|1,0,1]=4 220 B18R2.113910 COc1cc(cc2c1OCO2)C(=O)C(C)C#N 1458a_100011218003_100000703298 [0,2,0,0,0,0|0,0,2]=4 221 B18R3.164901 COc1cc(cc2c1OCO2)CNC3CC3 34a_100025755791_100000211595 [0,0,0,1,0,1|1,0,0]=3 222 B14R1.350 COc1cc(cc(c1OC)O)C(=O)C 1458a_100000032013_200000210301 [0,0,1,0,1,0|1,0,1]=4 223 B14R1.350 COc1cc(cc(c1OC)O)C(=O)[13CH3] 1458a_100000032013_200025704644 [0,0,1,0,1,0|1,0,1]=4 224 B14R1.362 C=C(C)c1cc(c(c(c1)OC)O)OC 271570a_100000694244_100000691893 [0,0,1,0,1,0|1,0,1]=4 225 B14R1.362 COc1cc(cc(c1O)OC)C(=O)C 1458a_100000692901_200000210301 [0,0,1,0,1,0|1,0,1]=4 226 B14R1.362 COc1cc(cc(c1O)OC)C(=O)[13CH3] 1458a_100000692901_200025704644 [0,0,1,0,1,0|1,0,1]=4 227 B14R1.6723 CCOc1ccc(cc1OC)C(C)O 34a_100000246512_100000210202 [0,0,1,0,1,0|2,0,0]=4 228 B14R1.6723 CCOc1ccc(cc1OC)C(C)O 7a_100000246512_100000210202 [0,0,1,0,1,0|2,0,0]=4 229 B14R1.6723 COc1cc(ccc1OCF)C(C)O 34a_100000246512_100015361967 [0,0,1,0,1,0|2,0,0]=4 230 B14R1.6723 COc1cc(ccc1OCF)C(C)O 7a_100000246512_100015361967 [0,0,1,0,1,0|2,0,0]=4 231 B16R1.414 COc1cc(cc(c1OC)Br)CNC(C)C 207a_100138425928_100000183470 [0,0,1,0,0,1|2,0,0]=4 232 B16R1.414 COc1cc(cc(c1OC)Br)CNC(C)C 34a_100000748475_100000210206 [0,0,1,0,0,1|2,0,0]=4 233 B16R1.414 COc1cc(cc(c1OC)Br)COC(C)C 34a_200000215730_100000210206 [0,0,1,0,0,1|2,0,0]=4 234 B16R1.414 COc1cc(cc(c1OC)Cl)CNC(C)C 207a_100138425928_100000184546 [0,0,1,0,0,1|2,0,0]=4 235 B16R1.414 COc1cc(cc(c1OC)I)CNC(C)C 207a_100138425928_100000188315 [0,0,1,0,0,1|2,0,0]=4 236 B16R1.423 COc1cc(cc(c1Br)OC)CNC(C)C 207a_100138425928_100009814401 [0,0,1,0,0,1|2,0,0]=4 237 B16R1.423 COc1cc(cc(c1Br)OC)COC(C)C 34a_100010169844_100000210206 [0,0,1,0,0,1|2,0,0]=4 238 B16R1.423 COc1cc(cc(c1Br)OC)COC(C)C 7a_100010169844_100000210206 [0,0,1,0,0,1|2,0,0]=4 239 B16R1.423 COc1cc(cc(c1C)OC)CNC(C)C 207a_100138425928_200012186444 [0,0,1,0,0,1|2,0,0]=4 240 B16R1.423 COc1cc(cc(c1Cl)OC)NCC(C)C 34a_100009986809_100000210624 [0,0,1,0,0,1|2,0,0]=4 241 B16R1.423 COc1cc(cc(c1Cl)OC)NCC(C)O 34a_100009986809_100011218427 [0,0,1,0,0,1|2,0,0]=4 242 B16R1.423 COc1cc(cc(c1Cl)OC)NC[C@@H](C)O 34a_100009986809_100009817552 [0,0,1,0,0,1|2,0,0]=4 243 B16R1.423 COc1cc(cc(c1F)OC)CNC(C)C 207a_100138425928_200009839898 [0,0,1,0,0,1|2,0,0]=4 244 B16R1.423 COc1cc(cc(c1F)OC)SCC(C)C 62a_100000210624_100015304952 [0,0,1,0,0,1|2,0,0]=4 245 B16R1.423 COc1cc(cc(c1F)OC)SCC(C)C 62a_100015304952_100000210760 [0,0,1,0,0,1|2,0,0]=4 246 B16R1.423 COc1cc(cc(c1F)OC)SCC(C)O 62a_100011218427_100015304952 [0,0,1,0,0,1|2,0,0]=4 247 B16R1.423 COc1cc(cc(c1F)OC)SCC(C)O 62a_100015304952_100011218427 [0,0,1,0,0,1|2,0,0]=4 248 B16R1.423 COc1cc(cc(c1F)OC)SC[C@@H](C)O 62a_100009817552_100015304952 [0,0,1,0,0,1|2,0,0]=4 249 B16R1.423 COc1cc(cc(c1F)OC)SC[C@@H](C)O 62a_100015304952_100009817552 [0,0,1,0,0,1|2,0,0]=4 250 B16R1.423 COc1cc(cc(c1O)OC)C=CC(C)C 271570a_100016257149_100000691893 [0,0,1,0,0,1|1,0,1]=4 251 B16R1.423 COc1cc(cc(c1O)OC)C=CC(C)O 271570a_200011019289_100000691893 [0,0,1,0,0,1|1,0,1]=4 252 B16R1.423 COc1cc(cc(c1O)OC)CCC(=O)C 1458a_100000024749_200000210301 [0,0,1,0,0,1|1,0,1]=4 253 B16R1.423 COc1cc(cc(c1O)OC)CCC(=O)[13CH3] 1458a_100000024749_200025704644 [0,0,1,0,0,1|1,0,1]=4 254 B16R1.9381 CCOc1ccc(cc1OC)CNC(C)C 207a_100138425928_100000169853 [0,0,1,0,0,1|2,0,0]=4 255 B16R1.9381 CCOc1ccc(cc1OC)CNC(C)C 2230a_200000739100_100000210206 [0,0,1,0,0,1|2,0,0]=4 256 B16R1.9381 CCOc1ccc(cc1OC)CNC(C)C 34a_200000739100_100000210206 [0,0,1,0,0,1|2,0,0]=4 257 B16R1.9381 CCOc1ccc(cc1OC)COC(C)C 34a_100000184821_100000210206 [0,0,1,0,0,1|2,0,0]=4 258 B16R1.9381 CCOc1ccc(cc1OC)NCC(C)C 2230a_100000184985_100000210760 [0,0,1,0,0,1|2,0,0]=4 259 B16R1.9381 CCOc1ccc(cc1OC)NCC(C)C 34a_100000184985_100000210624 [0,0,1,0,0,1|2,0,0]=4 260 B16R1.9381 CCOc1ccc(cc1OC)NCC(C)O 2230a_100000184985_100011218427 [0,0,1,0,0,1|2,0,0]=4 261 B16R1.9381 CCOc1ccc(cc1OC)NCC(C)O 34a_100000184985_100011218427 [0,0,1,0,0,1|2,0,0]=4 262 B16R1.9381 CCOc1ccc(cc1OC)NC[C@@H](C)O 2230a_100000184985_100009817552 [0,0,1,0,0,1|2,0,0]=4 263 B16R1.9381 CCOc1ccc(cc1OC)NC[C@@H](C)O 34a_100000184985_100009817552 [0,0,1,0,0,1|2,0,0]=4 264 B16R2.3814 CNCc1cc(c2c(c1)OCCO2)OC 207a_100102657272_100000010823 [1,0,0,0,0,1|1,0,0]=3 265 B16R2.3814 CNCc1cc(c2c(c1)OCCO2)OC 270004a_106832991635_100000010823 [1,0,0,0,0,1|1,0,0]=3 266 B16R2.24931 CC(C)NCc1cc(c2c(c1)OCO2)Br 207a_100138425928_100000682445 [1,0,0,0,0,1|2,0,0]=4 267 B16R2.24931 CC(C)NCc1cc(c2c(c1)OCO2)Cl 207a_100138425928_100000016197 [1,0,0,0,0,1|2,0,0]=4 268 B16R2.24931 CC(C)OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_100000210206 [1,0,0,0,0,1|2,0,0]=4 269 B16R2.24931 CC(C)OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_100000210206 [1,0,0,0,0,1|2,0,0]=4 270 B16R2.1579 COc1cc2c(cc1CN(C)C)OCO2 270004a_100102631434_100000186743 [0,0,0,0,1,1|2,0,0]=4 271 B16R2.1579 COc1cc2c(cc1NC(C)C)OCO2 2230a_200000088178_100000210206 [0,0,0,0,1,1|2,0,0]=4 272 B16R2.1579 COc1cc2c(cc1NC(C)C)OCO2 34a_200000088178_100000210206 [0,0,0,0,1,1|2,0,0]=4 273 B16R2.40082 COc1cc(cc2c1OCCO2)C(=O)C 1458a_100000198598_200000210301 [0,0,0,0,1,1|1,0,1]=4 274 B16R2.40082 COc1cc(cc2c1OCCO2)C(=O)[13CH3] 1458a_100000198598_200025704644 [0,0,0,0,1,1|1,0,1]=4 275 B18R2.113833 COc1cc(cc2c1OCCO2)CNC(C)C 207a_100138425928_100000010823 [0,0,0,0,0,2|1,0,0]=3 276 B18R2.113907 C=C(C)CNCc1cc(c2c(c1)OCO2)OC 2230a_100025755791_100000748629 [0,0,0,0,0,2|1,0,1]=4 277 B18R2.113907 C=C(C)CNCc1cc(c2c(c1)OCO2)OC 34a_100025755791_100000748629 [0,0,0,0,0,2|1,0,1]=4 278 B18R2.113907 COc1cc(cc2c1OCO2)C=NNC(C)C 4a_100000741168_100000185029 [0,0,0,0,0,2|1,0,1]=4 279 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(=O)N 2230a_100025755791_100000747473 [0,0,0,0,0,2|1,0,1]=4 280 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(=O)N 34a_100025755791_100000187820 [0,0,0,0,0,2|1,0,1]=4 281 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(C)C 207a_100000210953_100000185029 [0,0,0,0,0,2|1,0,0]=3 282 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(C)C 2230a_100025755791_100000210760 [0,0,0,0,0,2|1,0,0]=3 283 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(C)C 270004a_100025755791_100000210432 [0,0,0,0,0,2|1,0,0]=3 284 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(C)C 34a_100025755791_100000210624 [0,0,0,0,0,2|1,0,0]=3 285 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(C)O 207a_100000210904_100000185029 [0,0,0,0,0,2|1,0,0]=3 286 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(C)O 2230a_100025755791_100011218427 [0,0,0,0,0,2|1,0,0]=3 287 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(C)O 34a_100025755791_100011218427 [0,0,0,0,0,2|1,0,0]=3 288 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(F)F 207a_100000765723_100000185029 [0,0,0,0,0,2|2,0,0]=4 289 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(F)F 2230a_100025755791_100011934356 [0,0,0,0,0,2|2,0,0]=4 290 B18R2.113907 COc1cc(cc2c1OCO2)CNCC(F)F 34a_100025755791_100011934356 [0,0,0,0,0,2|2,0,0]=4 291 B18R2.113907 COc1cc(cc2c1OCO2)CNC[C@@H](C)O 2230a_100025755791_100009817552 [0,0,0,0,0,2|1,0,0]=3 292 B18R2.113907 COc1cc(cc2c1OCO2)CNC[C@@H](C)O 34a_100025755791_100009817552 [0,0,0,0,0,2|1,0,0]=3