0 B14R2.8045 Cc1cc(c2cccc(c2n1)C)O 271570a_203496583355_100000757406 [0,0,0,0,0,0|2,0,1]=3 1 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O 271570a_203496583355_100000689329 [0,0,0,0,0,0|2,0,1]=3 2 B14R2.8045 Cc1cc(c2cccc(c2n1)O)O 271570a_203496583355_200011333620 [0,0,0,0,0,0|1,0,1]=2 3 B14R2.8045 Cc1cc(c2nccc(c2c1)O)C 271570a_203496583355_100011310474 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.8045 Cc1cc(nc2c1cccc2C)O 271570a_203496583355_100000008058 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.8045 Nc1nc2c(cccc2c(=O)[nH]1)O 271570a_203496583355_100010142784 [0,0,0,0,0,0|1,0,0]=1 6 B14R2.8045 O=c1[nH]c(=O)c2cccc(c2[nH]1)O 271570a_203496583355_100012357391 [0,0,0,0,0,0|1,0,1]=2 7 B14R2.8045 O=c1[nH]c(=O)c2ccnc(c2[nH]1)O 271570a_203496583355_209893295357 [0,0,0,0,0,0|2,0,1]=3 8 B14R2.8045 O=c1[nH]c2c(cccc2c(=O)o1)O 271570a_203496583355_100000695655 [0,0,0,0,0,0|2,0,1]=3 9 B14R2.8045 O=c1cc(c2cccc(c2[nH]1)O)O 271570a_203496583355_200010201894 [0,0,0,0,0,0|2,0,2]=4 10 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [1,0,0,0,0,0|1,0,0]=2 11 B13R2.162 Cc1ccc2cncc(c2c1)O 271570a_203496583355_100009817139 [1,0,0,0,0,0|3,0,0]=4 12 B13R2.162 Cc1ccc2nccc(c2c1)O 271570a_203496583355_100000751279 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.162 Cc1ccc2nccc(c2n1)O 271570a_203496583355_100009889967 [1,0,0,0,0,0|2,0,0]=3 14 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [1,0,0,0,0,0|3,0,0]=4 15 B13R2.162 Nc1ccc2cccc(c2n1)O 271570a_203496583355_100000687151 [1,0,0,0,0,0|2,0,0]=3 16 B13R2.162 Nc1ncc2cccc(c2n1)O 271570a_203496583355_200010988910 [1,0,0,0,0,0|1,0,1]=3 17 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [1,0,0,0,0,0|2,0,1]=4 18 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [1,0,0,0,0,0|3,0,0]=4 19 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [1,0,0,0,0,0|3,0,0]=4 20 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [1,0,0,0,0,0|2,0,0]=3 22 B13R2.162 Oc1ccc2cncc(c2n1)O 271570a_203496583355_100009812673 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.162 Oc1ccnc2c1nc(cc2)F 271570a_203496583355_100000719316 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.162 Oc1ncc2cccc(c2n1)O 271570a_203496583355_100010674811 [1,0,0,0,0,0|1,0,1]=3 25 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [1,0,0,0,0,0|1,0,1]=3 26 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [1,0,0,0,0,0|3,0,0]=4 28 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [1,0,0,0,0,0|1,0,2]=4 29 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [1,0,0,0,0,0|0,0,2]=3 30 B13R2.328 Cc1nc(nc2c1cccc2)O 271570a_203496583355_100000046098 [1,0,0,0,0,0|2,0,1]=4 31 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [1,0,0,0,0,0|3,0,0]=4 32 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [1,0,0,0,0,0|2,0,1]=4 33 B13R2.328 O=c1cc(nc2n1cccc2)O 271570a_203496583355_100000707704 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.342 Cc1cccc2c1nccc2O 271570a_203496583355_100000751276 [1,0,0,0,0,0|2,0,1]=4 35 B13R2.342 Cc1cccc2c1ncnc2O 271570a_203496583355_100000751292 [1,0,0,0,0,0|1,0,2]=4 36 B13R2.342 Cc1ccnc2c1cccc2O 271570a_203496583355_100010254272 [1,0,0,0,0,0|2,0,0]=3 37 B13R2.342 Cc1ccnc2c1nccc2O 271570a_203496583355_200013369187 [1,0,0,0,0,0|3,0,0]=4 38 B13R2.342 Cc1nccc2c1cccc2O 271570a_203496583355_100010137443 [1,0,0,0,0,0|2,0,1]=4 39 B13R2.342 Nc1cccc2c1cccc2O 271570a_203496583355_100009816864 [1,0,0,0,0,0|3,0,0]=4 40 B13R2.342 Nc1cccc2c1nccc2O 271570a_203496583355_100009892510 [1,0,0,0,0,0|2,0,1]=4 41 B13R2.342 Nc1ccnc2c1cccc2O 271570a_203496583355_100011620713 [1,0,0,0,0,0|2,0,0]=3 42 B13R2.342 Nc1nccc2c1cccc2O 271570a_203496583355_103549770558 [1,0,0,0,0,0|2,0,1]=4 43 B13R2.342 Nc1ncnc2c1cccc2O 271570a_203496583355_100010199759 [1,0,0,0,0,0|1,0,1]=3 44 B13R2.342 O=C1CCCc2c1cccc2O 271570a_203496583355_100000691372 [1,0,0,0,0,0|2,0,1]=4 45 B13R2.342 O=C1CCNc2c1cccc2O 271570a_203496583355_115082355814 [1,0,0,0,0,0|1,0,2]=4 46 B13R2.342 O=C1CCOc2c1cccc2O 271570a_203496583355_100000744318 [1,0,0,0,0,0|2,0,1]=4 47 B13R2.342 O=C1CCSc2c1cccc2O 271570a_203496583355_100011271337 [1,0,0,0,0,0|2,0,1]=4 48 B13R2.342 O=C1NCCc2c1cccc2O 271570a_203496583355_100000695023 [1,0,0,0,0,0|1,0,1]=3 49 B13R2.342 O=c1[nH]ccc2c1cccc2O 271570a_203496583355_100000703947 [1,0,0,0,0,0|1,0,0]=2 50 B13R2.342 O=c1[nH]cnc2c1cncc2O 271570a_203496583355_200010117198 [1,0,0,0,0,0|1,0,0]=2 51 B13R2.342 O=c1cc[nH]c2c1cccc2O 271570a_203496583355_100000749886 [1,0,0,0,0,0|1,0,1]=3 52 B13R2.342 Oc1cccc2c1cccc2F 271570a_203496583355_100009817034 [1,0,0,0,0,0|3,0,0]=4 53 B13R2.342 Oc1cccc2c1cccc2O 271570a_203496583355_100010003857 [1,0,0,0,0,0|2,0,1]=4 54 B13R2.342 Oc1cccc2c1ccnc2Cl 271570a_203496583355_100010080171 [1,0,0,0,0,0|2,0,1]=4 55 B13R2.342 Oc1ccnc2c1cccc2F 271570a_203496583355_100011934723 [1,0,0,0,0,0|2,0,1]=4 56 B13R2.342 Oc1ccnc2c1cccc2O 271570a_203496583355_100000703299 [1,0,0,0,0,0|1,0,1]=3 57 B13R2.342 Oc1ncnc2c1cccc2F 271570a_203496583355_100000693626 [1,0,0,0,0,0|1,0,2]=4 58 B13R2.342 Oc1ncnc2c1cccc2O 271570a_203496583355_100010201916 [1,0,0,0,0,0|0,0,2]=3 59 B15R2.2743 CSc1cc(c2cccc(c2n1)C)C 62a_100000008058_200000210301 [0,1,0,0,0,0|3,0,0]=4 60 B15R2.2743 CSc1cc(c2cccc(c2n1)C)C 62a_200000210301_100000008058 [0,1,0,0,0,0|3,0,0]=4 61 B15R2.2743 Cc1cc(nc2c1cccc2C)S[13CH3] 62a_100000008058_200025704644 [0,1,0,0,0,0|3,0,0]=4 62 B15R2.2743 Cc1cc(nc2c1cccc2C)S[13CH3] 62a_200025704644_100000008058 [0,1,0,0,0,0|3,0,0]=4 63 B15R2.20937 C=Cc1cccc2c1[nH]c(=O)[nH]c2=O 271570a_100011290941_100012357391 [0,1,0,0,0,0|2,0,1]=4 64 B15R2.20937 C=Cc1cccc2c1nc([nH]c2=O)N 271570a_100011290941_100010142784 [0,1,0,0,0,0|2,0,0]=3 65 B15R2.20937 C=Cc1cccc2c1nc(cc2O)C 271570a_100011290941_200011333620 [0,1,0,0,0,0|2,0,1]=4 66 B15R2.20937 COc1ccc[n+]2c1nc(cc2C)C 7a_200009827914_200000210301 [0,1,0,0,0,0|3,0,0]=4 67 B15R2.20937 COc1cccc2c1cc([nH]c2=O)O 271570a_203496583355_200010523595 [0,1,0,0,0,0|2,0,0]=3 68 B15R2.20937 COc1cccc2c1nc(cc2C)C 34a_100000719286_200000210301 [0,1,0,0,0,0|2,0,0]=3 69 B15R2.20937 COc1cccc2c1nc(cc2C)C 7a_100000719286_200000210301 [0,1,0,0,0,0|2,0,0]=3 70 B15R2.20937 COc1cccc2c1nc(cc2O)C 271570a_203496583355_100000689690 [0,1,0,0,0,0|1,0,1]=3 71 B15R2.20937 COc1cccc2c1nc(nc2O)C 271570a_203496583355_200010196080 [0,1,0,0,0,0|0,0,2]=3 72 B15R2.20937 CSc1cccc2c1nc(cc2O)C 62a_200000210301_200011333620 [0,1,0,0,0,0|1,1,1]=4 73 B15R2.20937 Cc1cc([n+]2cccc(c2n1)O[13CH3])C 7a_200009827914_200025704644 [0,1,0,0,0,0|3,0,0]=4 74 B15R2.20937 Cc1cc(c2cccc(c2n1)O[13CH3])C 34a_100000719286_200025704644 [0,1,0,0,0,0|2,0,0]=3 75 B15R2.20937 Cc1cc(c2cccc(c2n1)O[13CH3])C 7a_100000719286_200025704644 [0,1,0,0,0,0|2,0,0]=3 76 B15R2.20937 Cc1cc(c2cccc(c2n1)S[13CH3])O 62a_200025704644_200011333620 [0,1,0,0,0,0|1,1,1]=4 77 B15R2.22677 C=Cc1cc(nc2c1cccc2C)C 271570a_100011290941_100000757406 [0,1,0,0,0,0|3,0,0]=4 78 B15R2.22677 C=Cc1cc(nc2c1cccc2F)C 271570a_100011290941_100000689329 [0,1,0,0,0,0|3,0,0]=4 79 B15R2.22677 CNc1cc(nc2c1cccc2F)C 27a_100102657272_100000689329 [0,1,0,0,0,0|3,0,0]=4 80 B15R2.22677 COc1cc(nc2c1cccc2C)C 34a_100000689609_200000210301 [0,1,0,0,0,0|2,0,1]=4 81 B15R2.22677 COc1cc(nc2c1cccc2Cl)C 34a_200000182167_200000210301 [0,1,0,0,0,0|2,0,1]=4 82 B15R2.22677 COc1cc(nc2c1cccc2F)C 34a_100000689687_200000210301 [0,1,0,0,0,0|2,0,1]=4 83 B15R2.22677 CSc1cc(nc2c1cccc2C)C 62a_200000210301_100000757406 [0,1,0,0,0,0|2,1,0]=4 84 B15R2.22677 CSc1cc(nc2c1cccc2F)C 62a_100000689329_200000210301 [0,1,0,0,0,0|2,1,0]=4 85 B15R2.22677 CSc1cc(nc2c1cccc2F)C 62a_200000210301_100000689329 [0,1,0,0,0,0|2,1,0]=4 86 B15R2.22677 Cc1cc(c2cccc(c2n1)C)O[13CH3] 34a_100000689609_200025704644 [0,1,0,0,0,0|2,0,1]=4 87 B15R2.22677 Cc1cc(c2cccc(c2n1)C)S[13CH3] 62a_200025704644_100000757406 [0,1,0,0,0,0|2,1,0]=4 88 B15R2.22677 Cc1cc(c2cccc(c2n1)Cl)O[13CH3] 34a_200000182167_200025704644 [0,1,0,0,0,0|2,0,1]=4 89 B15R2.22677 Cc1cc(c2cccc(c2n1)F)O[13CH3] 34a_100000689687_200025704644 [0,1,0,0,0,0|2,0,1]=4 90 B15R2.22677 Cc1cc(c2cccc(c2n1)F)S[13CH3] 62a_100000689329_200025704644 [0,1,0,0,0,0|2,1,0]=4 91 B15R2.22677 Cc1cc(c2cccc(c2n1)F)S[13CH3] 62a_200025704644_100000689329 [0,1,0,0,0,0|2,1,0]=4 92 B15R2.59732 Cc1cc(c2[nH]c(=O)oc(=O)c2c1)O 271570a_203496583355_100000216488 [0,1,0,0,0,0|2,0,1]=4 93 B15R2.59732 Cc1cc(c2cc(cc(c2n1)F)F)O 271570a_203496583355_100011333840 [0,1,0,0,0,0|2,0,1]=4 94 B15R2.59732 Cc1nc2c(cc(cc2c(=O)[nH]1)F)O 271570a_203496583355_100011015873 [0,1,0,0,0,0|0,0,0]=1 95 B15R2.59732 O=c1[nH]c2c(cc(cc2c(=O)o1)Cl)O 271570a_203496583355_100011102812 [0,1,0,0,0,0|2,0,1]=4 96 B15R2.59732 O=c1[nH]c2c(cc(cc2c(=O)o1)F)O 271570a_203496583355_100011810390 [0,1,0,0,0,0|2,0,1]=4 97 B15R2.63910 Cc1cc(=O)c2ccc(c(c2[nH]1)C)O 271570a_203496583355_100012349997 [0,1,0,0,0,0|2,0,1]=4 98 B13R1.12 C=CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210623 [0,0,1,0,0,0|2,0,1]=4 99 B13R1.12 C=CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210623 [0,0,1,0,0,0|2,0,1]=4 100 B13R1.12 C=CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210623 [0,0,1,0,0,0|2,0,1]=4 101 B13R1.12 C=CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210623 [0,0,1,0,0,0|2,0,1]=4 102 B13R1.12 C=CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210623 [0,0,1,0,0,0|2,0,1]=4 103 B13R1.12 C=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210623 [0,0,1,0,0,0|2,0,1]=4 104 B13R1.12 CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210303 [0,0,1,0,0,0|2,0,1]=4 105 B13R1.12 CCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210303 [0,0,1,0,0,0|2,0,1]=4 106 B13R1.12 CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210303 [0,0,1,0,0,0|2,0,1]=4 107 B13R1.12 CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210303 [0,0,1,0,0,0|2,0,1]=4 108 B13R1.12 CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210303 [0,0,1,0,0,0|2,0,1]=4 109 B13R1.12 CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210303 [0,0,1,0,0,0|2,0,1]=4 110 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 11a_100015525214_100012360534 [0,0,1,0,0,0|2,0,1]=4 111 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 240690a_100015525214_100012360534 [0,0,1,0,0,0|2,0,1]=4 112 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 527a_100015525214_100012360534 [0,0,1,0,0,0|2,0,1]=4 113 B13R1.12 CCNC(=O)c1cccc(c1Br)C 11a_100015525214_100000692419 [0,0,1,0,0,0|2,0,1]=4 114 B13R1.12 CCNC(=O)c1cccc(c1Br)C 240690a_100015525214_100000692419 [0,0,1,0,0,0|2,0,1]=4 115 B13R1.12 CCNC(=O)c1cccc(c1Br)C 527a_100015525214_100000692419 [0,0,1,0,0,0|2,0,1]=4 116 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 11a_100015525214_100012339722 [0,0,1,0,0,0|2,0,1]=4 117 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 240690a_100015525214_100012339722 [0,0,1,0,0,0|2,0,1]=4 118 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 527a_100015525214_100012339722 [0,0,1,0,0,0|2,0,1]=4 119 B13R1.12 CCNC(=O)c1cccc(c1Br)F 11a_100015525214_100011217547 [0,0,1,0,0,0|2,0,1]=4 120 B13R1.12 CCNC(=O)c1cccc(c1Br)F 240690a_100015525214_100011217547 [0,0,1,0,0,0|2,0,1]=4 121 B13R1.12 CCNC(=O)c1cccc(c1Br)F 527a_100015525214_100011217547 [0,0,1,0,0,0|2,0,1]=4 122 B13R1.12 CCNC(=O)c1cccc(c1Br)I 11a_100015525214_100010232522 [0,0,1,0,0,0|2,0,1]=4 123 B13R1.12 CCNC(=O)c1cccc(c1Br)I 240690a_100015525214_100010232522 [0,0,1,0,0,0|2,0,1]=4 124 B13R1.12 CCNC(=O)c1cccc(c1Br)I 527a_100015525214_100010232522 [0,0,1,0,0,0|2,0,1]=4 125 B13R1.12 CCNC(=O)c1cccc(c1Br)O 240690a_100015525214_100010230362 [0,0,1,0,0,0|1,0,1]=3 126 B13R1.12 CCNC(=O)c1cccc(c1Br)O 527a_100015525214_100010230362 [0,0,1,0,0,0|1,0,1]=3 127 B13R1.12 CCNC(=O)c1cccc(c1C)Br 11a_100015525214_100000760464 [0,0,1,0,0,0|2,0,1]=4 128 B13R1.12 CCNC(=O)c1cccc(c1C)Br 240690a_100015525214_100000760464 [0,0,1,0,0,0|2,0,1]=4 129 B13R1.12 CCNC(=O)c1cccc(c1C)Br 527a_100015525214_100000760464 [0,0,1,0,0,0|2,0,1]=4 130 B13R1.12 CCNC(=O)c1cccc(c1C)C 11a_100015525214_100000183679 [0,0,1,0,0,0|2,0,1]=4 131 B13R1.12 CCNC(=O)c1cccc(c1C)C 240690a_100015525214_100000183679 [0,0,1,0,0,0|2,0,1]=4 132 B13R1.12 CCNC(=O)c1cccc(c1C)C 527a_100015525214_100000183679 [0,0,1,0,0,0|2,0,1]=4 133 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 11a_100015525214_100000690184 [0,0,1,0,0,0|2,0,1]=4 134 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 240690a_100015525214_100000690184 [0,0,1,0,0,0|2,0,1]=4 135 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 527a_100015525214_100000690184 [0,0,1,0,0,0|2,0,1]=4 136 B13R1.12 CCNC(=O)c1cccc(c1C)F 11a_100015525214_100011218272 [0,0,1,0,0,0|2,0,1]=4 137 B13R1.12 CCNC(=O)c1cccc(c1C)F 240690a_100015525214_100011218272 [0,0,1,0,0,0|2,0,1]=4 138 B13R1.12 CCNC(=O)c1cccc(c1C)F 527a_100015525214_100011218272 [0,0,1,0,0,0|2,0,1]=4 139 B13R1.12 CCNC(=O)c1cccc(c1C)I 11a_100015525214_100000751865 [0,0,1,0,0,0|2,0,1]=4 140 B13R1.12 CCNC(=O)c1cccc(c1C)I 240690a_100015525214_100000751865 [0,0,1,0,0,0|2,0,1]=4 141 B13R1.12 CCNC(=O)c1cccc(c1C)I 527a_100015525214_100000751865 [0,0,1,0,0,0|2,0,1]=4 142 B13R1.12 CCNC(=O)c1cccc(c1C)O 240690a_100015525214_100000766327 [0,0,1,0,0,0|1,0,1]=3 143 B13R1.12 CCNC(=O)c1cccc(c1C)O 527a_100015525214_100000766327 [0,0,1,0,0,0|1,0,1]=3 144 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 11a_100015525214_100000760540 [0,0,1,0,0,0|2,0,1]=4 145 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 240690a_100015525214_100000760540 [0,0,1,0,0,0|2,0,1]=4 146 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 527a_100015525214_100000760540 [0,0,1,0,0,0|2,0,1]=4 147 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 11a_100015525214_100000693142 [0,0,1,0,0,0|2,0,1]=4 148 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 240690a_100015525214_100000693142 [0,0,1,0,0,0|2,0,1]=4 149 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 527a_100015525214_100000693142 [0,0,1,0,0,0|2,0,1]=4 150 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 11a_100015525214_100000183631 [0,0,1,0,0,0|2,0,1]=4 151 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 240690a_100015525214_100000183631 [0,0,1,0,0,0|2,0,1]=4 152 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 527a_100015525214_100000183631 [0,0,1,0,0,0|2,0,1]=4 153 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 11a_100015525214_100000759904 [0,0,1,0,0,0|2,0,1]=4 154 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 240690a_100015525214_100000759904 [0,0,1,0,0,0|2,0,1]=4 155 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 527a_100015525214_100000759904 [0,0,1,0,0,0|2,0,1]=4 156 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 11a_100015525214_100010176783 [0,0,1,0,0,0|2,0,1]=4 157 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 240690a_100015525214_100010176783 [0,0,1,0,0,0|2,0,1]=4 158 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 527a_100015525214_100010176783 [0,0,1,0,0,0|2,0,1]=4 159 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 240690a_100015525214_100000092362 [0,0,1,0,0,0|1,0,1]=3 160 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 527a_100015525214_100000092362 [0,0,1,0,0,0|1,0,1]=3 161 B13R1.12 CCNC(=O)c1cccc(c1F)Br 11a_100015525214_100000756403 [0,0,1,0,0,0|2,0,1]=4 162 B13R1.12 CCNC(=O)c1cccc(c1F)Br 240690a_100015525214_100000756403 [0,0,1,0,0,0|2,0,1]=4 163 B13R1.12 CCNC(=O)c1cccc(c1F)Br 527a_100015525214_100000756403 [0,0,1,0,0,0|2,0,1]=4 164 B13R1.12 CCNC(=O)c1cccc(c1F)C 11a_100015525214_100000766181 [0,0,1,0,0,0|2,0,1]=4 165 B13R1.12 CCNC(=O)c1cccc(c1F)C 240690a_100015525214_100000766181 [0,0,1,0,0,0|2,0,1]=4 166 B13R1.12 CCNC(=O)c1cccc(c1F)C 527a_100015525214_100000766181 [0,0,1,0,0,0|2,0,1]=4 167 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 11a_100015525214_100000688816 [0,0,1,0,0,0|2,0,1]=4 168 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 240690a_100015525214_100000688816 [0,0,1,0,0,0|2,0,1]=4 169 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 527a_100015525214_100000688816 [0,0,1,0,0,0|2,0,1]=4 170 B13R1.12 CCNC(=O)c1cccc(c1F)F 11a_100015525214_100000748134 [0,0,1,0,0,0|2,0,1]=4 171 B13R1.12 CCNC(=O)c1cccc(c1F)F 240690a_100015525214_100000748134 [0,0,1,0,0,0|2,0,1]=4 172 B13R1.12 CCNC(=O)c1cccc(c1F)F 527a_100015525214_100000748134 [0,0,1,0,0,0|2,0,1]=4 173 B13R1.12 CCNC(=O)c1cccc(c1F)I 11a_100015525214_100010185205 [0,0,1,0,0,0|2,0,1]=4 174 B13R1.12 CCNC(=O)c1cccc(c1F)I 240690a_100015525214_100010185205 [0,0,1,0,0,0|2,0,1]=4 175 B13R1.12 CCNC(=O)c1cccc(c1F)I 527a_100015525214_100010185205 [0,0,1,0,0,0|2,0,1]=4 176 B13R1.12 CCNC(=O)c1cccc(c1F)O 240690a_100015525214_100000037433 [0,0,1,0,0,0|1,0,1]=3 177 B13R1.12 CCNC(=O)c1cccc(c1F)O 527a_100015525214_100000037433 [0,0,1,0,0,0|1,0,1]=3 178 B13R1.12 CCNC(=O)c1cccc(c1I)Br 11a_100015525214_100000688019 [0,0,1,0,0,0|2,0,1]=4 179 B13R1.12 CCNC(=O)c1cccc(c1I)Br 240690a_100015525214_100000688019 [0,0,1,0,0,0|2,0,1]=4 180 B13R1.12 CCNC(=O)c1cccc(c1I)Br 527a_100015525214_100000688019 [0,0,1,0,0,0|2,0,1]=4 181 B13R1.12 CCNC(=O)c1cccc(c1I)C 11a_100015525214_100000739377 [0,0,1,0,0,0|2,0,1]=4 182 B13R1.12 CCNC(=O)c1cccc(c1I)C 240690a_100015525214_100000739377 [0,0,1,0,0,0|2,0,1]=4 183 B13R1.12 CCNC(=O)c1cccc(c1I)C 527a_100015525214_100000739377 [0,0,1,0,0,0|2,0,1]=4 184 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 11a_100015525214_100010176784 [0,0,1,0,0,0|2,0,1]=4 185 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 240690a_100015525214_100010176784 [0,0,1,0,0,0|2,0,1]=4 186 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 527a_100015525214_100010176784 [0,0,1,0,0,0|2,0,1]=4 187 B13R1.12 CCNC(=O)c1cccc(c1I)F 11a_100015525214_100000690930 [0,0,1,0,0,0|2,0,1]=4 188 B13R1.12 CCNC(=O)c1cccc(c1I)F 240690a_100015525214_100000690930 [0,0,1,0,0,0|2,0,1]=4 189 B13R1.12 CCNC(=O)c1cccc(c1I)F 527a_100015525214_100000690930 [0,0,1,0,0,0|2,0,1]=4 190 B13R1.12 CCNC(=O)c1cccc(c1I)O 527a_100015525214_100010084636 [0,0,1,0,0,0|1,0,1]=3 191 B13R1.12 CCNC(=O)c1cccc(c1O)Br 240690a_100015525214_100000752940 [0,0,1,0,0,0|2,0,1]=4 192 B13R1.12 CCNC(=O)c1cccc(c1O)Br 527a_100015525214_100000752940 [0,0,1,0,0,0|2,0,1]=4 193 B13R1.12 CCNC(=O)c1cccc(c1O)C 240690a_100015525214_100000183896 [0,0,1,0,0,0|2,0,1]=4 194 B13R1.12 CCNC(=O)c1cccc(c1O)C 527a_100015525214_100000183896 [0,0,1,0,0,0|2,0,1]=4 195 B13R1.12 CCNC(=O)c1cccc(c1O)Cl 240690a_100015525214_100000742801 [0,0,1,0,0,0|2,0,1]=4 196 B13R1.12 CCNC(=O)c1cccc(c1O)Cl 527a_100015525214_100000742801 [0,0,1,0,0,0|2,0,1]=4 197 B13R1.12 CCNC(=O)c1cccc(c1O)F 240690a_100015525214_100011217230 [0,0,1,0,0,0|2,0,1]=4 198 B13R1.12 CCNC(=O)c1cccc(c1O)F 527a_100015525214_100011217230 [0,0,1,0,0,0|2,0,1]=4 199 B13R1.12 CCNC(=O)c1cccc(c1O)O 527a_100015525214_100000690420 [0,0,1,0,0,0|1,0,1]=3 200 B13R1.12 CCOC(=O)c1cccc(c1C)O 271570a_203496583355_100012298221 [0,0,1,0,0,0|2,0,1]=4 201 B13R1.12 CCOC(=O)c1cccc(c1F)O 271570a_203496583355_100012350793 [0,0,1,0,0,0|2,0,1]=4 202 B13R1.12 CCOC(=O)c1cccc(c1N)O 271570a_203496583355_200011356557 [0,0,1,0,0,0|1,0,2]=4 203 B13R1.12 CNNC(=O)c1cccc(c1Br)Br 22a_100016993582_100012360534 [0,0,1,0,0,0|3,0,0]=4 204 B13R1.12 CNNC(=O)c1cccc(c1Br)C 22a_100016993582_100000692419 [0,0,1,0,0,0|3,0,0]=4 205 B13R1.12 CNNC(=O)c1cccc(c1Br)Cl 22a_100016993582_100012339722 [0,0,1,0,0,0|3,0,0]=4 206 B13R1.12 CNNC(=O)c1cccc(c1Br)F 22a_100016993582_100011217547 [0,0,1,0,0,0|3,0,0]=4 207 B13R1.12 CNNC(=O)c1cccc(c1Br)I 22a_100016993582_100010232522 [0,0,1,0,0,0|3,0,0]=4 208 B13R1.12 CNNC(=O)c1cccc(c1Br)O 22a_100016993582_100010230362 [0,0,1,0,0,0|2,0,0]=3 209 B13R1.12 CNNC(=O)c1cccc(c1C)Br 22a_100016993582_100000760464 [0,0,1,0,0,0|3,0,0]=4 210 B13R1.12 CNNC(=O)c1cccc(c1C)C 22a_100016993582_100000183679 [0,0,1,0,0,0|3,0,0]=4 211 B13R1.12 CNNC(=O)c1cccc(c1C)Cl 22a_100016993582_100000690184 [0,0,1,0,0,0|3,0,0]=4 212 B13R1.12 CNNC(=O)c1cccc(c1C)F 22a_100016993582_100011218272 [0,0,1,0,0,0|3,0,0]=4 213 B13R1.12 CNNC(=O)c1cccc(c1C)I 22a_100016993582_100000751865 [0,0,1,0,0,0|3,0,0]=4 214 B13R1.12 CNNC(=O)c1cccc(c1C)O 22a_100016993582_100000766327 [0,0,1,0,0,0|2,0,0]=3 215 B13R1.12 CNNC(=O)c1cccc(c1Cl)Br 22a_100016993582_100000760540 [0,0,1,0,0,0|3,0,0]=4 216 B13R1.12 CNNC(=O)c1cccc(c1Cl)C 22a_100016993582_100000693142 [0,0,1,0,0,0|3,0,0]=4 217 B13R1.12 CNNC(=O)c1cccc(c1Cl)Cl 22a_100016993582_100000183631 [0,0,1,0,0,0|3,0,0]=4 218 B13R1.12 CNNC(=O)c1cccc(c1Cl)F 22a_100016993582_100000759904 [0,0,1,0,0,0|3,0,0]=4 219 B13R1.12 CNNC(=O)c1cccc(c1Cl)I 22a_100016993582_100010176783 [0,0,1,0,0,0|3,0,0]=4 220 B13R1.12 CNNC(=O)c1cccc(c1Cl)O 22a_100016993582_100000092362 [0,0,1,0,0,0|2,0,0]=3 221 B13R1.12 CNNC(=O)c1cccc(c1F)Br 22a_100016993582_100000756403 [0,0,1,0,0,0|3,0,0]=4 222 B13R1.12 CNNC(=O)c1cccc(c1F)C 22a_100016993582_100000766181 [0,0,1,0,0,0|3,0,0]=4 223 B13R1.12 CNNC(=O)c1cccc(c1F)Cl 22a_100016993582_100000688816 [0,0,1,0,0,0|3,0,0]=4 224 B13R1.12 CNNC(=O)c1cccc(c1F)F 22a_100016993582_100000748134 [0,0,1,0,0,0|3,0,0]=4 225 B13R1.12 CNNC(=O)c1cccc(c1F)I 22a_100016993582_100010185205 [0,0,1,0,0,0|3,0,0]=4 226 B13R1.12 CNNC(=O)c1cccc(c1F)O 22a_100016993582_100000037433 [0,0,1,0,0,0|2,0,0]=3 227 B13R1.12 CNNC(=O)c1cccc(c1I)Br 22a_100016993582_100000688019 [0,0,1,0,0,0|3,0,0]=4 228 B13R1.12 CNNC(=O)c1cccc(c1I)C 22a_100016993582_100000739377 [0,0,1,0,0,0|3,0,0]=4 229 B13R1.12 CNNC(=O)c1cccc(c1I)Cl 22a_100016993582_100010176784 [0,0,1,0,0,0|3,0,0]=4 230 B13R1.12 CNNC(=O)c1cccc(c1I)F 22a_100016993582_100000690930 [0,0,1,0,0,0|3,0,0]=4 231 B13R1.12 CNNC(=O)c1cccc(c1I)O 22a_100016993582_100010084636 [0,0,1,0,0,0|2,0,0]=3 232 B13R1.12 CNNC(=O)c1cccc(c1O)Br 22a_100016993582_100000752940 [0,0,1,0,0,0|3,0,0]=4 233 B13R1.12 CNNC(=O)c1cccc(c1O)C 22a_100016993582_100000183896 [0,0,1,0,0,0|3,0,0]=4 234 B13R1.12 CNNC(=O)c1cccc(c1O)Cl 22a_100016993582_100000742801 [0,0,1,0,0,0|3,0,0]=4 235 B13R1.12 CNNC(=O)c1cccc(c1O)F 22a_100016993582_100011217230 [0,0,1,0,0,0|3,0,0]=4 236 B13R1.12 CNNC(=O)c1cccc(c1O)O 22a_100016993582_100000690420 [0,0,1,0,0,0|2,0,0]=3 237 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000748629 [0,0,1,0,0,0|3,0,0]=4 238 B13R1.147 C=C(C)CC(=O)c1cccc(c1)C 1458a_100000189346_100000748629 [0,0,1,0,0,0|3,0,0]=4 239 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000748629 [0,0,1,0,0,0|3,0,0]=4 240 B13R1.147 C=C(C)CC(=O)c1cccc(c1)F 1458a_100000210950_100000748629 [0,0,1,0,0,0|3,0,0]=4 241 B13R1.147 C=C(C)CC(=O)c1cccc(c1)I 1458a_100000184098_100000748629 [0,0,1,0,0,0|3,0,0]=4 242 B13R1.147 C=C(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000748629 [0,0,1,0,0,0|2,0,0]=3 243 B13R1.147 C=C(F)CC(=O)c1cccc(c1)O 1458a_100000183914_100009893438 [0,0,1,0,0,0|2,0,1]=4 244 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Br 1458a_100000070787_100000212080 [0,0,1,0,0,0|3,0,0]=4 245 B13R1.147 CC(=O)CC(=O)c1cccc(c1)C 1458a_100000070787_100000739480 [0,0,1,0,0,0|3,0,0]=4 246 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000070787_100000211444 [0,0,1,0,0,0|3,0,0]=4 247 B13R1.147 CC(=O)CC(=O)c1cccc(c1)F 1458a_100000070787_100000215616 [0,0,1,0,0,0|3,0,0]=4 248 B13R1.147 CC(=O)CC(=O)c1cccc(c1)O 1458a_100000070787_100009813753 [0,0,1,0,0,0|2,0,0]=3 249 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 240690a_100000740644_100015343762 [0,0,1,0,0,0|2,0,1]=4 250 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 527a_100000740644_100103153847 [0,0,1,0,0,0|2,0,1]=4 251 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000210624 [0,0,1,0,0,0|2,0,1]=4 252 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 271570a_203496583355_100000723889 [0,0,1,0,0,0|2,0,1]=4 253 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 11a_100138425928_100000210664 [0,0,1,0,0,0|2,0,1]=4 254 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 1626a_100138425928_100000210664 [0,0,1,0,0,0|2,0,1]=4 255 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 240690a_100138425928_100000210664 [0,0,1,0,0,0|2,0,1]=4 256 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 527a_100138425928_100000210664 [0,0,1,0,0,0|2,0,1]=4 257 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 11a_100138425928_100000210390 [0,0,1,0,0,0|2,0,1]=4 258 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 1626a_100138425928_100000210390 [0,0,1,0,0,0|2,0,1]=4 259 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 240690a_100138425928_100000210390 [0,0,1,0,0,0|2,0,1]=4 260 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 527a_100138425928_100000210390 [0,0,1,0,0,0|2,0,1]=4 261 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 11a_100138425928_100000210950 [0,0,1,0,0,0|2,0,1]=4 262 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 1626a_100138425928_100000210950 [0,0,1,0,0,0|2,0,1]=4 263 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 240690a_100138425928_100000210950 [0,0,1,0,0,0|2,0,1]=4 264 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 527a_100138425928_100000210950 [0,0,1,0,0,0|2,0,1]=4 265 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 11a_100138425928_100000184098 [0,0,1,0,0,0|2,0,1]=4 266 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 1626a_100138425928_100000184098 [0,0,1,0,0,0|2,0,1]=4 267 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 240690a_100138425928_100000184098 [0,0,1,0,0,0|2,0,1]=4 268 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 527a_100138425928_100000184098 [0,0,1,0,0,0|2,0,1]=4 269 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 240690a_100138425928_100000183914 [0,0,1,0,0,0|1,0,1]=3 270 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 271570a_203496583355_200000152632 [0,0,1,0,0,0|1,0,1]=3 271 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 527a_100138425928_100000183914 [0,0,1,0,0,0|1,0,1]=3 272 B13R1.147 CC(C)NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229805 [0,0,1,0,0,0|2,0,1]=4 273 B13R1.147 CC(C)NC(=O)c1cncc(c1)O 271570a_203496583355_200000152636 [0,0,1,0,0,0|2,0,1]=4 274 B13R1.147 CC(O)CC(=O)c1cccc(c1)O 1458a_100000183914_100011218427 [0,0,1,0,0,0|2,0,1]=4 275 B13R1.147 CN(C)CC(=O)c1cccc(c1)O 269982a_100102631434_100009813753 [0,0,1,0,0,0|3,0,0]=4 276 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 11a_100138425928_100000189346 [0,0,1,0,0,0|2,0,1]=4 277 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 1626a_100138425928_100000189346 [0,0,1,0,0,0|2,0,1]=4 278 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 240690a_100138425928_100000189346 [0,0,1,0,0,0|2,0,1]=4 279 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 527a_100138425928_100000189346 [0,0,1,0,0,0|2,0,1]=4 280 B13R1.147 NC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000187820 [0,0,1,0,0,0|2,0,1]=4 281 B13R1.147 O=C([O-])CC(=O)c1cccc(c1)O 1458a_100000183914_100020667443 [0,0,1,0,0,0|3,0,0]=4 282 B13R1.369 C/C=C/CSc1cnc([nH]c1=O)C 62a_100011999157_100102629194 [0,0,1,0,0,0|2,0,1]=4 283 B13R1.369 C/C=C/CSc1cnc([nH]c1=O)C 62a_100102629194_100011999157 [0,0,1,0,0,0|2,0,1]=4 284 B13R1.369 CC=CCSc1cnc([nH]c1=O)C 62a_100000070051_100011999157 [0,0,1,0,0,0|2,0,1]=4 285 B13R1.369 CC=CCSc1cnc([nH]c1=O)C 62a_100011999157_100000070051 [0,0,1,0,0,0|2,0,1]=4 286 B13R1.369 CCCC=Cc1cnc([nH]c1=O)C 271570a_100016258520_100011999157 [0,0,1,0,0,0|1,0,2]=4 287 B13R1.369 CCOC=Cc1cnc([nH]c1=O)C 271570a_100016256518_100011999157 [0,0,1,0,0,0|2,0,1]=4 288 B13R1.369 COCC=Cc1cnc([nH]c1=O)C 271570a_100016286323_100011999157 [0,0,1,0,0,0|2,0,1]=4 289 B13R1.470 CN(CC=O)Cc1ccccc1O 2230a_100015189988_200015260668 [0,0,1,0,0,0|3,0,0]=4 290 B13R1.470 CN(CC=O)Cc1ccccc1O 269982a_100015189988_200015260668 [0,0,1,0,0,0|3,0,0]=4 291 B13R1.2135 CC(=Cc1c(cccc1C=O)F)C 271570a_100102525489_100011998484 [0,0,1,0,0,0|3,0,0]=4 292 B13R1.2135 CC(=Cc1c(cccc1C=O)O)C 271570a_100102525489_100009816417 [0,0,1,0,0,0|2,0,0]=3 293 B13R1.2135 CC(=O)Cc1c(cccc1C=O)F 1458a_100000070787_100010132767 [0,0,1,0,0,0|3,0,0]=4 294 B13R1.2135 CC(C)Sc1c(cccc1C=O)O 62a_100000210206_100009816417 [0,0,1,0,0,0|2,0,1]=4 295 B13R1.2135 CC(C)Sc1c(cccc1C=O)O 62a_100009816417_100000210206 [0,0,1,0,0,0|2,0,1]=4 296 B13R1.4012 CC=Cc1c(cccc1C(=O)C)F 271570a_100016259895_100012362612 [0,0,1,0,0,0|3,0,0]=4 297 B13R1.4012 CC=Cc1c(cccc1C(=O)N)C 271570a_100016259895_200011409216 [0,0,1,0,0,0|2,0,0]=3 298 B13R1.4012 CC=Cc1c(cccc1C(=O)N)F 271570a_100016259895_200012351544 [0,0,1,0,0,0|2,0,0]=3 299 B13R1.4012 CCNc1c(cccc1C(=O)N)C 34a_100000223273_100000210202 [0,0,1,0,0,0|1,0,2]=4 300 B13R1.4012 CCNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000210202 [0,0,1,0,0,0|1,0,2]=4 301 B13R1.4012 CCNc1c(cccc1C(=O)N)F 34a_100011722151_100000210202 [0,0,1,0,0,0|1,0,2]=4 302 B13R1.4012 CCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100000210202 [0,0,1,0,0,0|2,0,1]=4 303 B13R1.4012 CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100000210202 [0,0,1,0,0,0|2,0,1]=4 304 B13R1.4012 CCOc1c(cccc1C(=O)N)F 34a_100009886295_100000210202 [0,0,1,0,0,0|2,0,1]=4 305 B13R1.4012 CCOc1c(cccc1C(=O)N)F 7a_100009886295_100000210202 [0,0,1,0,0,0|2,0,1]=4 306 B13R1.4012 CCSc1c(cccc1C(=O)N)C 62a_100000210202_200011409216 [0,0,1,0,0,0|2,0,1]=4 307 B13R1.4012 CCSc1c(cccc1C(=O)N)C 62a_200011409216_100000210202 [0,0,1,0,0,0|2,0,1]=4 308 B13R1.4012 CCSc1c(cccc1C(=O)N)F 62a_100000210202_200012351544 [0,0,1,0,0,0|2,0,1]=4 309 B13R1.4012 CCSc1c(cccc1C(=O)N)F 62a_200012351544_100000210202 [0,0,1,0,0,0|2,0,1]=4 310 B13R2.3742 O=c1[nH]c(=O)c2scc(c2[nH]1)O 271570a_203496583355_100010246816 [0,0,0,0,1,0|2,0,1]=4 311 B13R2.4825 CC1Cc2c(cccc2C1=O)O 271570a_203496583355_200012356775 [0,0,0,0,1,0|1,0,1]=3 312 B13R2.4825 CN1Cc2c(cccc2C1=O)O 271570a_203496583355_100009817108 [0,0,0,0,1,0|2,0,0]=3 313 B13R2.4825 Cc1c2cccc(c2nn1C)O 271570a_203496583355_100010255105 [0,0,0,0,1,0|2,0,0]=3 314 B13R2.4825 O=C1Nc2c(cccc2C1=O)O 271570a_203496583355_100000183292 [0,0,0,0,1,0|1,0,1]=3 315 B13R2.4857 O=C1NC(=O)c2c1cccc2O 271570a_203496583355_100010194295 [0,0,0,0,1,0|1,0,0]=2 316 B13R2.4857 O=C1OC(=O)c2c1cccc2O 271570a_203496583355_100010195870 [0,0,0,0,1,0|2,0,0]=3 317 B12R1.17 C=CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210623 [1,0,1,0,0,0|1,0,1]=4 318 B12R1.17 CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210303 [1,0,1,0,0,0|1,0,1]=4 319 B12R1.17 CCNC(=O)c1cc(ccn1)O 271570a_203496583355_100000194128 [1,0,1,0,0,0|1,0,1]=4 320 B12R1.17 CCNC(=O)c1cccc(c1)Br 11a_100015525214_100000210664 [1,0,1,0,0,0|1,0,1]=4 321 B12R1.17 CCNC(=O)c1cccc(c1)Br 240690a_100015525214_100000210664 [1,0,1,0,0,0|1,0,1]=4 322 B12R1.17 CCNC(=O)c1cccc(c1)Br 527a_100015525214_100000210664 [1,0,1,0,0,0|1,0,1]=4 323 B12R1.17 CCNC(=O)c1cccc(c1)C 11a_100015525214_100000189346 [1,0,1,0,0,0|1,0,1]=4 324 B12R1.17 CCNC(=O)c1cccc(c1)C 240690a_100015525214_100000189346 [1,0,1,0,0,0|1,0,1]=4 325 B12R1.17 CCNC(=O)c1cccc(c1)C 527a_100015525214_100000189346 [1,0,1,0,0,0|1,0,1]=4 326 B12R1.17 CCNC(=O)c1cccc(c1)Cl 11a_100015525214_100000210390 [1,0,1,0,0,0|1,0,1]=4 327 B12R1.17 CCNC(=O)c1cccc(c1)Cl 240690a_100015525214_100000210390 [1,0,1,0,0,0|1,0,1]=4 328 B12R1.17 CCNC(=O)c1cccc(c1)Cl 527a_100015525214_100000210390 [1,0,1,0,0,0|1,0,1]=4 329 B12R1.17 CCNC(=O)c1cccc(c1)F 11a_100015525214_100000210950 [1,0,1,0,0,0|1,0,1]=4 330 B12R1.17 CCNC(=O)c1cccc(c1)F 240690a_100015525214_100000210950 [1,0,1,0,0,0|1,0,1]=4 331 B12R1.17 CCNC(=O)c1cccc(c1)F 527a_100015525214_100000210950 [1,0,1,0,0,0|1,0,1]=4 332 B12R1.17 CCNC(=O)c1cccc(c1)I 11a_100015525214_100000184098 [1,0,1,0,0,0|1,0,1]=4 333 B12R1.17 CCNC(=O)c1cccc(c1)I 240690a_100015525214_100000184098 [1,0,1,0,0,0|1,0,1]=4 334 B12R1.17 CCNC(=O)c1cccc(c1)I 527a_100015525214_100000184098 [1,0,1,0,0,0|1,0,1]=4 335 B12R1.17 CCNC(=O)c1cccc(c1)O 240690a_100015525214_100000183914 [1,0,1,0,0,0|0,0,1]=3 336 B12R1.17 CCNC(=O)c1cccc(c1)O 271570a_203496583355_100000155180 [1,0,1,0,0,0|0,0,1]=3 337 B12R1.17 CCNC(=O)c1cccc(c1)O 527a_100015525214_100000183914 [1,0,1,0,0,0|0,0,1]=3 338 B12R1.17 CCNC(=O)c1ccnc(c1)O 271570a_203496583355_100000229823 [1,0,1,0,0,0|1,0,1]=4 339 B12R1.17 CCNC(=O)c1cncc(c1)O 271570a_203496583355_200000155184 [1,0,1,0,0,0|1,0,1]=4 340 B12R1.17 CCOC(=O)c1cccc(c1)O 271570a_203496583355_100000170211 [1,0,1,0,0,0|1,0,1]=4 341 B12R1.17 CNCC(=O)c1cccc(c1)O 34a_100102657272_100009813753 [1,0,1,0,0,0|2,0,0]=4 342 B12R1.17 CNCC(=O)c1cccc(c1)O 7a_106832991635_100009813753 [1,0,1,0,0,0|2,0,0]=4 343 B12R1.17 CNNC(=O)c1cccc(c1)Br 22a_100016993582_100000210664 [1,0,1,0,0,0|2,0,0]=4 344 B12R1.17 CNNC(=O)c1cccc(c1)C 22a_100016993582_100000189346 [1,0,1,0,0,0|2,0,0]=4 345 B12R1.17 CNNC(=O)c1cccc(c1)Cl 22a_100016993582_100000210390 [1,0,1,0,0,0|2,0,0]=4 346 B12R1.17 CNNC(=O)c1cccc(c1)F 22a_100016993582_100000210950 [1,0,1,0,0,0|2,0,0]=4 347 B12R1.17 CNNC(=O)c1cccc(c1)I 22a_100016993582_100000184098 [1,0,1,0,0,0|2,0,0]=4 348 B12R1.17 CNNC(=O)c1cccc(c1)O 22a_100016993582_100000183914 [1,0,1,0,0,0|1,0,0]=3 349 B12R1.17 COCC(=O)c1cccc(c1)O 34a_100138415774_100009813753 [1,0,1,0,0,0|2,0,0]=4 350 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_100009813753_200000210301 [1,0,1,0,0,0|2,0,0]=4 351 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_200000210301_100009813753 [1,0,1,0,0,0|2,0,0]=4 352 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_100009813753_200025704644 [1,0,1,0,0,0|2,0,0]=4 353 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_200025704644_100009813753 [1,0,1,0,0,0|2,0,0]=4 354 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [1,0,1,0,0,0|1,0,1]=4 355 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [1,0,1,0,0,0|1,0,1]=4 356 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [1,0,1,0,0,0|1,0,1]=4 357 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [1,0,1,0,0,0|1,0,1]=4 358 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [1,0,1,0,0,0|1,0,1]=4 359 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [1,0,1,0,0,0|1,0,1]=4 360 B12R1.24 CNC(=O)c1cccc(c1Br)Br 11a_106832991635_100012360534 [1,0,1,0,0,0|2,0,0]=4 361 B12R1.24 CNC(=O)c1cccc(c1Br)Br 1626a_100102657272_100012360534 [1,0,1,0,0,0|2,0,0]=4 362 B12R1.24 CNC(=O)c1cccc(c1Br)Br 240690a_100102657272_100012360534 [1,0,1,0,0,0|2,0,0]=4 363 B12R1.24 CNC(=O)c1cccc(c1Br)Br 527a_100102657272_100012360534 [1,0,1,0,0,0|2,0,0]=4 364 B12R1.24 CNC(=O)c1cccc(c1Br)C 11a_106832991635_100000692419 [1,0,1,0,0,0|2,0,0]=4 365 B12R1.24 CNC(=O)c1cccc(c1Br)C 1626a_100102657272_100000692419 [1,0,1,0,0,0|2,0,0]=4 366 B12R1.24 CNC(=O)c1cccc(c1Br)C 240690a_100102657272_100000692419 [1,0,1,0,0,0|2,0,0]=4 367 B12R1.24 CNC(=O)c1cccc(c1Br)C 527a_100102657272_100000692419 [1,0,1,0,0,0|2,0,0]=4 368 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 11a_106832991635_100012339722 [1,0,1,0,0,0|2,0,0]=4 369 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 1626a_100102657272_100012339722 [1,0,1,0,0,0|2,0,0]=4 370 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 240690a_100102657272_100012339722 [1,0,1,0,0,0|2,0,0]=4 371 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 527a_100102657272_100012339722 [1,0,1,0,0,0|2,0,0]=4 372 B12R1.24 CNC(=O)c1cccc(c1Br)F 11a_106832991635_100011217547 [1,0,1,0,0,0|2,0,0]=4 373 B12R1.24 CNC(=O)c1cccc(c1Br)F 1626a_100102657272_100011217547 [1,0,1,0,0,0|2,0,0]=4 374 B12R1.24 CNC(=O)c1cccc(c1Br)F 240690a_100102657272_100011217547 [1,0,1,0,0,0|2,0,0]=4 375 B12R1.24 CNC(=O)c1cccc(c1Br)F 527a_100102657272_100011217547 [1,0,1,0,0,0|2,0,0]=4 376 B12R1.24 CNC(=O)c1cccc(c1Br)I 11a_106832991635_100010232522 [1,0,1,0,0,0|2,0,0]=4 377 B12R1.24 CNC(=O)c1cccc(c1Br)I 1626a_100102657272_100010232522 [1,0,1,0,0,0|2,0,0]=4 378 B12R1.24 CNC(=O)c1cccc(c1Br)I 240690a_100102657272_100010232522 [1,0,1,0,0,0|2,0,0]=4 379 B12R1.24 CNC(=O)c1cccc(c1Br)I 527a_100102657272_100010232522 [1,0,1,0,0,0|2,0,0]=4 380 B12R1.24 CNC(=O)c1cccc(c1Br)O 240690a_100102657272_100010230362 [1,0,1,0,0,0|1,0,0]=3 381 B12R1.24 CNC(=O)c1cccc(c1Br)O 527a_100102657272_100010230362 [1,0,1,0,0,0|1,0,0]=3 382 B12R1.24 CNC(=O)c1cccc(c1C)Br 11a_106832991635_100000760464 [1,0,1,0,0,0|2,0,0]=4 383 B12R1.24 CNC(=O)c1cccc(c1C)Br 1626a_100102657272_100000760464 [1,0,1,0,0,0|2,0,0]=4 384 B12R1.24 CNC(=O)c1cccc(c1C)Br 240690a_100102657272_100000760464 [1,0,1,0,0,0|2,0,0]=4 385 B12R1.24 CNC(=O)c1cccc(c1C)Br 527a_100102657272_100000760464 [1,0,1,0,0,0|2,0,0]=4 386 B12R1.24 CNC(=O)c1cccc(c1C)C 11a_106832991635_100000183679 [1,0,1,0,0,0|2,0,0]=4 387 B12R1.24 CNC(=O)c1cccc(c1C)C 1626a_100102657272_100000183679 [1,0,1,0,0,0|2,0,0]=4 388 B12R1.24 CNC(=O)c1cccc(c1C)C 240690a_100102657272_100000183679 [1,0,1,0,0,0|2,0,0]=4 389 B12R1.24 CNC(=O)c1cccc(c1C)C 527a_100102657272_100000183679 [1,0,1,0,0,0|2,0,0]=4 390 B12R1.24 CNC(=O)c1cccc(c1C)Cl 11a_106832991635_100000690184 [1,0,1,0,0,0|2,0,0]=4 391 B12R1.24 CNC(=O)c1cccc(c1C)Cl 1626a_100102657272_100000690184 [1,0,1,0,0,0|2,0,0]=4 392 B12R1.24 CNC(=O)c1cccc(c1C)Cl 240690a_100102657272_100000690184 [1,0,1,0,0,0|2,0,0]=4 393 B12R1.24 CNC(=O)c1cccc(c1C)Cl 527a_100102657272_100000690184 [1,0,1,0,0,0|2,0,0]=4 394 B12R1.24 CNC(=O)c1cccc(c1C)F 11a_106832991635_100011218272 [1,0,1,0,0,0|2,0,0]=4 395 B12R1.24 CNC(=O)c1cccc(c1C)F 1626a_100102657272_100011218272 [1,0,1,0,0,0|2,0,0]=4 396 B12R1.24 CNC(=O)c1cccc(c1C)F 240690a_100102657272_100011218272 [1,0,1,0,0,0|2,0,0]=4 397 B12R1.24 CNC(=O)c1cccc(c1C)F 527a_100102657272_100011218272 [1,0,1,0,0,0|2,0,0]=4 398 B12R1.24 CNC(=O)c1cccc(c1C)I 11a_106832991635_100000751865 [1,0,1,0,0,0|2,0,0]=4 399 B12R1.24 CNC(=O)c1cccc(c1C)I 1626a_100102657272_100000751865 [1,0,1,0,0,0|2,0,0]=4 400 B12R1.24 CNC(=O)c1cccc(c1C)I 240690a_100102657272_100000751865 [1,0,1,0,0,0|2,0,0]=4 401 B12R1.24 CNC(=O)c1cccc(c1C)I 527a_100102657272_100000751865 [1,0,1,0,0,0|2,0,0]=4 402 B12R1.24 CNC(=O)c1cccc(c1C)O 240690a_100102657272_100000766327 [1,0,1,0,0,0|1,0,0]=3 403 B12R1.24 CNC(=O)c1cccc(c1C)O 527a_100102657272_100000766327 [1,0,1,0,0,0|1,0,0]=3 404 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 11a_106832991635_100000760540 [1,0,1,0,0,0|2,0,0]=4 405 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 1626a_100102657272_100000760540 [1,0,1,0,0,0|2,0,0]=4 406 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 240690a_100102657272_100000760540 [1,0,1,0,0,0|2,0,0]=4 407 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 527a_100102657272_100000760540 [1,0,1,0,0,0|2,0,0]=4 408 B12R1.24 CNC(=O)c1cccc(c1Cl)C 11a_106832991635_100000693142 [1,0,1,0,0,0|2,0,0]=4 409 B12R1.24 CNC(=O)c1cccc(c1Cl)C 1626a_100102657272_100000693142 [1,0,1,0,0,0|2,0,0]=4 410 B12R1.24 CNC(=O)c1cccc(c1Cl)C 240690a_100102657272_100000693142 [1,0,1,0,0,0|2,0,0]=4 411 B12R1.24 CNC(=O)c1cccc(c1Cl)C 527a_100102657272_100000693142 [1,0,1,0,0,0|2,0,0]=4 412 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 11a_106832991635_100000183631 [1,0,1,0,0,0|2,0,0]=4 413 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 1626a_100102657272_100000183631 [1,0,1,0,0,0|2,0,0]=4 414 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 240690a_100102657272_100000183631 [1,0,1,0,0,0|2,0,0]=4 415 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 527a_100102657272_100000183631 [1,0,1,0,0,0|2,0,0]=4 416 B12R1.24 CNC(=O)c1cccc(c1Cl)F 11a_106832991635_100000759904 [1,0,1,0,0,0|2,0,0]=4 417 B12R1.24 CNC(=O)c1cccc(c1Cl)F 1626a_100102657272_100000759904 [1,0,1,0,0,0|2,0,0]=4 418 B12R1.24 CNC(=O)c1cccc(c1Cl)F 240690a_100102657272_100000759904 [1,0,1,0,0,0|2,0,0]=4 419 B12R1.24 CNC(=O)c1cccc(c1Cl)F 527a_100102657272_100000759904 [1,0,1,0,0,0|2,0,0]=4 420 B12R1.24 CNC(=O)c1cccc(c1Cl)I 11a_106832991635_100010176783 [1,0,1,0,0,0|2,0,0]=4 421 B12R1.24 CNC(=O)c1cccc(c1Cl)I 1626a_100102657272_100010176783 [1,0,1,0,0,0|2,0,0]=4 422 B12R1.24 CNC(=O)c1cccc(c1Cl)I 240690a_100102657272_100010176783 [1,0,1,0,0,0|2,0,0]=4 423 B12R1.24 CNC(=O)c1cccc(c1Cl)I 527a_100102657272_100010176783 [1,0,1,0,0,0|2,0,0]=4 424 B12R1.24 CNC(=O)c1cccc(c1Cl)O 240690a_100102657272_100000092362 [1,0,1,0,0,0|1,0,0]=3 425 B12R1.24 CNC(=O)c1cccc(c1Cl)O 527a_100102657272_100000092362 [1,0,1,0,0,0|1,0,0]=3 426 B12R1.24 CNC(=O)c1cccc(c1F)Br 11a_106832991635_100000756403 [1,0,1,0,0,0|2,0,0]=4 427 B12R1.24 CNC(=O)c1cccc(c1F)Br 1626a_100102657272_100000756403 [1,0,1,0,0,0|2,0,0]=4 428 B12R1.24 CNC(=O)c1cccc(c1F)Br 240690a_100102657272_100000756403 [1,0,1,0,0,0|2,0,0]=4 429 B12R1.24 CNC(=O)c1cccc(c1F)Br 527a_100102657272_100000756403 [1,0,1,0,0,0|2,0,0]=4 430 B12R1.24 CNC(=O)c1cccc(c1F)C 11a_106832991635_100000766181 [1,0,1,0,0,0|2,0,0]=4 431 B12R1.24 CNC(=O)c1cccc(c1F)C 1626a_100102657272_100000766181 [1,0,1,0,0,0|2,0,0]=4 432 B12R1.24 CNC(=O)c1cccc(c1F)C 240690a_100102657272_100000766181 [1,0,1,0,0,0|2,0,0]=4 433 B12R1.24 CNC(=O)c1cccc(c1F)C 527a_100102657272_100000766181 [1,0,1,0,0,0|2,0,0]=4 434 B12R1.24 CNC(=O)c1cccc(c1F)Cl 11a_106832991635_100000688816 [1,0,1,0,0,0|2,0,0]=4 435 B12R1.24 CNC(=O)c1cccc(c1F)Cl 1626a_100102657272_100000688816 [1,0,1,0,0,0|2,0,0]=4 436 B12R1.24 CNC(=O)c1cccc(c1F)Cl 240690a_100102657272_100000688816 [1,0,1,0,0,0|2,0,0]=4 437 B12R1.24 CNC(=O)c1cccc(c1F)Cl 527a_100102657272_100000688816 [1,0,1,0,0,0|2,0,0]=4 438 B12R1.24 CNC(=O)c1cccc(c1F)F 11a_106832991635_100000748134 [1,0,1,0,0,0|2,0,0]=4 439 B12R1.24 CNC(=O)c1cccc(c1F)F 1626a_100102657272_100000748134 [1,0,1,0,0,0|2,0,0]=4 440 B12R1.24 CNC(=O)c1cccc(c1F)F 240690a_100102657272_100000748134 [1,0,1,0,0,0|2,0,0]=4 441 B12R1.24 CNC(=O)c1cccc(c1F)F 527a_100102657272_100000748134 [1,0,1,0,0,0|2,0,0]=4 442 B12R1.24 CNC(=O)c1cccc(c1F)I 11a_106832991635_100010185205 [1,0,1,0,0,0|2,0,0]=4 443 B12R1.24 CNC(=O)c1cccc(c1F)I 1626a_100102657272_100010185205 [1,0,1,0,0,0|2,0,0]=4 444 B12R1.24 CNC(=O)c1cccc(c1F)I 240690a_100102657272_100010185205 [1,0,1,0,0,0|2,0,0]=4 445 B12R1.24 CNC(=O)c1cccc(c1F)I 527a_100102657272_100010185205 [1,0,1,0,0,0|2,0,0]=4 446 B12R1.24 CNC(=O)c1cccc(c1F)O 240690a_100102657272_100000037433 [1,0,1,0,0,0|1,0,0]=3 447 B12R1.24 CNC(=O)c1cccc(c1F)O 527a_100102657272_100000037433 [1,0,1,0,0,0|1,0,0]=3 448 B12R1.24 CNC(=O)c1cccc(c1I)Br 11a_106832991635_100000688019 [1,0,1,0,0,0|2,0,0]=4 449 B12R1.24 CNC(=O)c1cccc(c1I)Br 1626a_100102657272_100000688019 [1,0,1,0,0,0|2,0,0]=4 450 B12R1.24 CNC(=O)c1cccc(c1I)Br 240690a_100102657272_100000688019 [1,0,1,0,0,0|2,0,0]=4 451 B12R1.24 CNC(=O)c1cccc(c1I)Br 527a_100102657272_100000688019 [1,0,1,0,0,0|2,0,0]=4 452 B12R1.24 CNC(=O)c1cccc(c1I)C 11a_106832991635_100000739377 [1,0,1,0,0,0|2,0,0]=4 453 B12R1.24 CNC(=O)c1cccc(c1I)C 1626a_100102657272_100000739377 [1,0,1,0,0,0|2,0,0]=4 454 B12R1.24 CNC(=O)c1cccc(c1I)C 240690a_100102657272_100000739377 [1,0,1,0,0,0|2,0,0]=4 455 B12R1.24 CNC(=O)c1cccc(c1I)C 527a_100102657272_100000739377 [1,0,1,0,0,0|2,0,0]=4 456 B12R1.24 CNC(=O)c1cccc(c1I)Cl 11a_106832991635_100010176784 [1,0,1,0,0,0|2,0,0]=4 457 B12R1.24 CNC(=O)c1cccc(c1I)Cl 1626a_100102657272_100010176784 [1,0,1,0,0,0|2,0,0]=4 458 B12R1.24 CNC(=O)c1cccc(c1I)Cl 240690a_100102657272_100010176784 [1,0,1,0,0,0|2,0,0]=4 459 B12R1.24 CNC(=O)c1cccc(c1I)Cl 527a_100102657272_100010176784 [1,0,1,0,0,0|2,0,0]=4 460 B12R1.24 CNC(=O)c1cccc(c1I)F 11a_106832991635_100000690930 [1,0,1,0,0,0|2,0,0]=4 461 B12R1.24 CNC(=O)c1cccc(c1I)F 1626a_100102657272_100000690930 [1,0,1,0,0,0|2,0,0]=4 462 B12R1.24 CNC(=O)c1cccc(c1I)F 240690a_100102657272_100000690930 [1,0,1,0,0,0|2,0,0]=4 463 B12R1.24 CNC(=O)c1cccc(c1I)F 527a_100102657272_100000690930 [1,0,1,0,0,0|2,0,0]=4 464 B12R1.24 CNC(=O)c1cccc(c1I)O 527a_100102657272_100010084636 [1,0,1,0,0,0|1,0,0]=3 465 B12R1.24 CNC(=O)c1cccc(c1O)Br 240690a_100102657272_100000752940 [1,0,1,0,0,0|2,0,0]=4 466 B12R1.24 CNC(=O)c1cccc(c1O)Br 527a_100102657272_100000752940 [1,0,1,0,0,0|2,0,0]=4 467 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [1,0,1,0,0,0|2,0,0]=4 468 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [1,0,1,0,0,0|2,0,0]=4 469 B12R1.24 CNC(=O)c1cccc(c1O)Cl 240690a_100102657272_100000742801 [1,0,1,0,0,0|2,0,0]=4 470 B12R1.24 CNC(=O)c1cccc(c1O)Cl 527a_100102657272_100000742801 [1,0,1,0,0,0|2,0,0]=4 471 B12R1.24 CNC(=O)c1cccc(c1O)F 240690a_100102657272_100011217230 [1,0,1,0,0,0|2,0,0]=4 472 B12R1.24 CNC(=O)c1cccc(c1O)F 527a_100102657272_100011217230 [1,0,1,0,0,0|2,0,0]=4 473 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [1,0,1,0,0,0|1,0,0]=3 474 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [1,0,1,0,0,0|2,0,0]=4 475 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [1,0,1,0,0,0|2,0,0]=4 476 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [1,0,1,0,0,0|2,0,0]=4 477 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [1,0,1,0,0,0|1,0,1]=4 478 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [1,0,1,0,0,0|2,0,0]=4 479 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [1,0,1,0,0,0|2,0,0]=4 480 B12R1.24 Cc1c(cccc1C(=O)NN)O 271570a_203496583355_200012298103 [1,0,1,0,0,0|2,0,0]=4 481 B12R1.308 CCNC(=O)c1ccccc1Br 11a_100015525214_100000188424 [1,0,1,0,0,0|1,0,1]=4 482 B12R1.308 CCNC(=O)c1ccccc1Br 240690a_100015525214_100000188424 [1,0,1,0,0,0|1,0,1]=4 483 B12R1.308 CCNC(=O)c1ccccc1Br 527a_100015525214_100000188424 [1,0,1,0,0,0|1,0,1]=4 484 B12R1.308 CCNC(=O)c1ccccc1C 11a_100015525214_100000212026 [1,0,1,0,0,0|1,0,1]=4 485 B12R1.308 CCNC(=O)c1ccccc1C 240690a_100015525214_100000212026 [1,0,1,0,0,0|1,0,1]=4 486 B12R1.308 CCNC(=O)c1ccccc1C 527a_100015525214_100000212026 [1,0,1,0,0,0|1,0,1]=4 487 B12R1.308 CCNC(=O)c1ccccc1Cl 11a_100015525214_100000185844 [1,0,1,0,0,0|1,0,1]=4 488 B12R1.308 CCNC(=O)c1ccccc1Cl 240690a_100015525214_100000185844 [1,0,1,0,0,0|1,0,1]=4 489 B12R1.308 CCNC(=O)c1ccccc1Cl 527a_100015525214_100000185844 [1,0,1,0,0,0|1,0,1]=4 490 B12R1.308 CCNC(=O)c1ccccc1F 11a_100015525214_100000188656 [1,0,1,0,0,0|1,0,1]=4 491 B12R1.308 CCNC(=O)c1ccccc1F 240690a_100015525214_100000188656 [1,0,1,0,0,0|1,0,1]=4 492 B12R1.308 CCNC(=O)c1ccccc1F 527a_100015525214_100000188656 [1,0,1,0,0,0|1,0,1]=4 493 B12R1.308 CCNC(=O)c1ccccc1I 11a_100015525214_100000187884 [1,0,1,0,0,0|1,0,1]=4 494 B12R1.308 CCNC(=O)c1ccccc1I 240690a_100015525214_100000187884 [1,0,1,0,0,0|1,0,1]=4 495 B12R1.308 CCNC(=O)c1ccccc1I 527a_100015525214_100000187884 [1,0,1,0,0,0|1,0,1]=4 496 B12R1.308 CCNC(=O)c1ccccc1O 240690a_100015525214_100015234032 [1,0,1,0,0,0|1,0,1]=4 497 B12R1.308 CCNC(=O)c1ccccc1O 271570a_203496583355_200000155173 [1,0,1,0,0,0|1,0,1]=4 498 B12R1.308 CCNC(=O)c1ccccc1[O-] 240690a_100015525214_100009911694 [1,0,1,0,0,0|1,0,1]=4 499 B12R1.308 CCNC(=O)c1ccccc1[O-] 527a_100015525214_100009911694 [1,0,1,0,0,0|1,0,1]=4 500 B12R1.308 CNNC(=O)c1ccccc1Br 22a_100016993582_100000188424 [1,0,1,0,0,0|2,0,0]=4 501 B12R1.308 CNNC(=O)c1ccccc1C 22a_100016993582_100000212026 [1,0,1,0,0,0|2,0,0]=4 502 B12R1.308 CNNC(=O)c1ccccc1Cl 22a_100016993582_100000185844 [1,0,1,0,0,0|2,0,0]=4 503 B12R1.308 CNNC(=O)c1ccccc1F 22a_100016993582_100000188656 [1,0,1,0,0,0|2,0,0]=4 504 B12R1.308 CNNC(=O)c1ccccc1I 22a_100016993582_100000187884 [1,0,1,0,0,0|2,0,0]=4 505 B12R1.308 CNNC(=O)c1ccccc1O 22a_100016993582_100015234032 [1,0,1,0,0,0|2,0,0]=4 506 B12R1.308 CNNC(=O)c1ccccc1[O-] 22a_100016993582_100009911694 [1,0,1,0,0,0|2,0,0]=4 507 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [1,0,1,0,0,0|2,0,0]=4 508 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [1,0,1,0,0,0|2,0,0]=4 509 B12R1.107 CC(C)NC(=O)c1ccccc1 11a_100138425928_100000185807 [1,0,1,0,0,0|1,0,1]=4 510 B12R1.107 CC(C)NC(=O)c1ccccc1 1626a_100138425928_100000185807 [1,0,1,0,0,0|1,0,1]=4 511 B12R1.107 CC(C)NC(=O)c1ccccc1 240690a_100138425928_100000185807 [1,0,1,0,0,0|1,0,1]=4 512 B12R1.107 CC(C)NC(=O)c1ccccc1 527a_100138425928_100000185807 [1,0,1,0,0,0|1,0,1]=4 513 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [1,0,1,0,0,0|2,0,0]=4 514 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [1,0,1,0,0,0|1,0,1]=4 515 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [1,0,1,0,0,0|1,0,1]=4 516 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [1,0,1,0,0,0|1,0,1]=4 517 B12R1.69 C=CCSc1cnc([nH]c1=O)C 62a_100000210623_100011999157 [1,0,1,0,0,0|1,0,1]=4 518 B12R1.69 C=CCSc1cnc([nH]c1=O)C 62a_100011999157_100000210623 [1,0,1,0,0,0|1,0,1]=4 519 B12R1.75 CC(=Cc1ccccc1C=O)C 271570a_100102525489_100000211189 [1,0,1,0,0,0|2,0,0]=4 520 B12R1.75 CC(=O)Cc1ccccc1C=O 1458a_100000070787_200009853537 [1,0,1,0,0,0|2,0,0]=4 521 B12R1.1112 CC=Cc1c(cccc1C=O)F 271570a_100016259895_100011998484 [1,0,1,0,0,0|2,0,0]=4 522 B12R1.1112 CC=Cc1c(cccc1C=O)O 271570a_100016259895_100009816417 [1,0,1,0,0,0|1,0,0]=3 523 B12R1.1112 CCSc1c(cccc1C=O)O 62a_100000210202_100009816417 [1,0,1,0,0,0|1,0,1]=4 524 B12R1.1112 CCSc1c(cccc1C=O)O 62a_100009816417_100000210202 [1,0,1,0,0,0|1,0,1]=4 525 B12R1.87 C=Cc1c(cccc1C(=O)N)C 271570a_100011290941_200011409216 [1,0,1,0,0,0|1,0,1]=4 526 B12R1.87 C=Cc1c(cccc1C(=O)N)F 271570a_100011290941_200012351544 [1,0,1,0,0,0|1,0,1]=4 527 B12R1.87 CNc1c(cccc1C(=O)N)C 34a_100000223273_200000210301 [1,0,1,0,0,0|1,0,1]=4 528 B12R1.87 CNc1c(cccc1C(=O)N)Cl 34a_200011997947_200000210301 [1,0,1,0,0,0|1,0,1]=4 529 B12R1.87 CNc1c(cccc1C(=O)N)F 34a_100011722151_200000210301 [1,0,1,0,0,0|1,0,1]=4 530 B12R1.87 COc1c(cccc1C(=O)C)O 1458a_100000080799_200000210301 [1,0,1,0,0,0|2,0,0]=4 531 B12R1.87 COc1c(cccc1C(=O)C)O 271570a_203496583355_100010725610 [1,0,1,0,0,0|2,0,0]=4 532 B12R1.87 COc1c(cccc1C(=O)N)Cl 34a_100009868166_200000210301 [1,0,1,0,0,0|2,0,0]=4 533 B12R1.87 COc1c(cccc1C(=O)N)Cl 7a_100009868166_200000210301 [1,0,1,0,0,0|2,0,0]=4 534 B12R1.87 COc1c(cccc1C(=O)N)F 34a_100009886295_200000210301 [1,0,1,0,0,0|2,0,0]=4 535 B12R1.87 COc1c(cccc1C(=O)N)F 7a_100009886295_200000210301 [1,0,1,0,0,0|2,0,0]=4 536 B12R1.87 COc1c(cccc1C(=O)N)O 271570a_203496583355_100010146779 [1,0,1,0,0,0|1,0,0]=3 537 B12R1.87 COc1c(cccc1C(=O)[13CH3])O 1458a_100000080799_200025704644 [1,0,1,0,0,0|2,0,0]=4 538 B12R1.87 CSc1c(cccc1C(=O)N)C 62a_200000210301_200011409216 [1,0,1,0,0,0|2,0,0]=4 539 B12R1.87 CSc1c(cccc1C(=O)N)C 62a_200011409216_200000210301 [1,0,1,0,0,0|2,0,0]=4 540 B12R1.87 CSc1c(cccc1C(=O)N)F 62a_200000210301_200012351544 [1,0,1,0,0,0|2,0,0]=4 541 B12R1.87 CSc1c(cccc1C(=O)N)F 62a_200012351544_200000210301 [1,0,1,0,0,0|2,0,0]=4 542 B12R1.87 Cc1cccc(c1N[13CH3])C(=O)N 34a_100000223273_200025704644 [1,0,1,0,0,0|1,0,1]=4 543 B12R1.87 Cc1cccc(c1S[13CH3])C(=O)N 62a_200011409216_200025704644 [1,0,1,0,0,0|2,0,0]=4 544 B12R1.87 Cc1cccc(c1S[13CH3])C(=O)N 62a_200025704644_200011409216 [1,0,1,0,0,0|2,0,0]=4 545 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)Cl 34a_200011997947_200025704644 [1,0,1,0,0,0|1,0,1]=4 546 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)F 34a_100011722151_200025704644 [1,0,1,0,0,0|1,0,1]=4 547 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 34a_100009868166_200025704644 [1,0,1,0,0,0|2,0,0]=4 548 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 7a_100009868166_200025704644 [1,0,1,0,0,0|2,0,0]=4 549 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 34a_100009886295_200025704644 [1,0,1,0,0,0|2,0,0]=4 550 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 7a_100009886295_200025704644 [1,0,1,0,0,0|2,0,0]=4 551 B12R1.87 [13CH3]Sc1c(cccc1C(=O)N)F 62a_200012351544_200025704644 [1,0,1,0,0,0|2,0,0]=4 552 B12R1.87 [13CH3]Sc1c(cccc1C(=O)N)F 62a_200025704644_200012351544 [1,0,1,0,0,0|2,0,0]=4 553 B12R1.283 CC=Cc1ccccc1C(=O)C 271570a_100016259895_100000751169 [1,0,1,0,0,0|2,0,0]=4 554 B12R1.283 CC=Cc1ccccc1C(=O)N 271570a_100016259895_100000162227 [1,0,1,0,0,0|1,0,0]=3 555 B12R1.283 CC=Cc1cccnc1C(=O)N 271570a_100016259895_200012359670 [1,0,1,0,0,0|2,0,0]=4 556 B12R1.283 CC=Cc1ccncc1C(=O)N 271570a_100016259895_100000697804 [1,0,1,0,0,0|2,0,0]=4 557 B12R1.283 CC=Cc1cnccc1C(=O)N 271570a_100016259895_100010205435 [1,0,1,0,0,0|2,0,0]=4 558 B12R1.283 CC=Cc1ncccc1C(=O)N 271570a_100016259895_100000162199 [1,0,1,0,0,0|2,0,0]=4 559 B12R1.283 CCNc1ccccc1C(=O)N 34a_100000185089_100000210202 [1,0,1,0,0,0|0,0,2]=4 560 B12R1.283 CCOc1ccccc1C(=O)N 34a_100000192804_100000210202 [1,0,1,0,0,0|1,0,1]=4 561 B12R1.283 CCOc1ccccc1C(=O)N 7a_100000192804_100000210202 [1,0,1,0,0,0|1,0,1]=4 562 B12R1.283 CCSc1ccccc1C(=O)N 62a_100000162227_100000210202 [1,0,1,0,0,0|1,0,1]=4 563 B12R1.283 CCSc1ccccc1C(=O)N 62a_100000210202_100000162227 [1,0,1,0,0,0|1,0,1]=4 564 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [2,0,0,0,0,0|2,0,0]=4 565 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [2,0,0,0,0,0|1,0,1]=4 566 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [2,0,0,0,0,0|2,0,0]=4 567 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [2,0,0,0,0,0|1,0,1]=4 568 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [2,0,0,0,0,0|1,0,0]=3 569 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [2,0,0,0,0,0|2,0,0]=4 570 B12R2.1081 Oc1cccc2c1ncnc2 271570a_203496583355_100010246313 [2,0,0,0,0,0|0,0,1]=3 571 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [2,0,0,0,0,0|1,0,1]=4 572 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [2,0,0,0,0,0|2,0,0]=4 573 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [2,0,0,0,0,0|0,0,2]=4 574 B14R1.16 C/C=C/CC(=O)c1cccc(c1Br)O 1458a_100010230362_100102629194 [0,1,1,0,0,0|2,0,0]=4 575 B14R1.16 C/C=C/CC(=O)c1cccc(c1C)O 1458a_100000766327_100102629194 [0,1,1,0,0,0|2,0,0]=4 576 B14R1.16 C/C=C/CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100102629194 [0,1,1,0,0,0|2,0,0]=4 577 B14R1.16 C/C=C/CC(=O)c1cccc(c1F)O 1458a_100000037433_100102629194 [0,1,1,0,0,0|2,0,0]=4 578 B14R1.16 C/C=C/CC(=O)c1cccc(c1I)O 1458a_100010084636_100102629194 [0,1,1,0,0,0|2,0,0]=4 579 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)O 1458a_100000690420_100102629194 [0,1,1,0,0,0|2,0,0]=4 580 B14R1.16 C=CCNC(=O)c1cccc(c1Br)O 240690a_100020586998_100010230362 [0,1,1,0,0,0|1,0,1]=4 581 B14R1.16 C=CCNC(=O)c1cccc(c1Br)O 527a_100020586998_100010230362 [0,1,1,0,0,0|1,0,1]=4 582 B14R1.16 C=CCNC(=O)c1cccc(c1C)O 240690a_100020586998_100000766327 [0,1,1,0,0,0|1,0,1]=4 583 B14R1.16 C=CCNC(=O)c1cccc(c1C)O 527a_100020586998_100000766327 [0,1,1,0,0,0|1,0,1]=4 584 B14R1.16 C=CCNC(=O)c1cccc(c1Cl)O 240690a_100020586998_100000092362 [0,1,1,0,0,0|1,0,1]=4 585 B14R1.16 C=CCNC(=O)c1cccc(c1Cl)O 527a_100020586998_100000092362 [0,1,1,0,0,0|1,0,1]=4 586 B14R1.16 C=CCNC(=O)c1cccc(c1F)O 240690a_100020586998_100000037433 [0,1,1,0,0,0|1,0,1]=4 587 B14R1.16 C=CCNC(=O)c1cccc(c1F)O 527a_100020586998_100000037433 [0,1,1,0,0,0|1,0,1]=4 588 B14R1.16 C=CCNC(=O)c1cccc(c1I)O 527a_100020586998_100010084636 [0,1,1,0,0,0|1,0,1]=4 589 B14R1.16 C=CCNC(=O)c1cccc(c1O)O 527a_100020586998_100000690420 [0,1,1,0,0,0|1,0,1]=4 590 B14R1.16 CC=CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000070051 [0,1,1,0,0,0|2,0,0]=4 591 B14R1.16 CC=CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000070051 [0,1,1,0,0,0|2,0,0]=4 592 B14R1.16 CC=CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000070051 [0,1,1,0,0,0|2,0,0]=4 593 B14R1.16 CC=CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000070051 [0,1,1,0,0,0|2,0,0]=4 594 B14R1.16 CC=CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000070051 [0,1,1,0,0,0|2,0,0]=4 595 B14R1.16 CC=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000070051 [0,1,1,0,0,0|2,0,0]=4 596 B14R1.16 CC=NNC(=O)c1cccc(c1Br)C 4a_200012340524_200000210099 [0,1,1,0,0,0|2,0,0]=4 597 B14R1.16 CC=NNC(=O)c1cccc(c1C)Br 4a_200012298103_200000210099 [0,1,1,0,0,0|2,0,0]=4 598 B14R1.16 CC=NNC(=O)c1cccc(c1C)C 4a_100000189804_200000210099 [0,1,1,0,0,0|2,0,0]=4 599 B14R1.16 CC=NNC(=O)c1cccc(c1C)Cl 4a_200011996895_200000210099 [0,1,1,0,0,0|2,0,0]=4 600 B14R1.16 CC=NNC(=O)c1cccc(c1C)I 4a_200000050057_200000210099 [0,1,1,0,0,0|2,0,0]=4 601 B14R1.16 CC=NNC(=O)c1cccc(c1Cl)C 4a_100011996894_200000210099 [0,1,1,0,0,0|2,0,0]=4 602 B14R1.16 CC=NNC(=O)c1cccc(c1Cl)Cl 4a_200000189813_200000210099 [0,1,1,0,0,0|2,0,0]=4 603 B14R1.16 CC=NNC(=O)c1cccc(c1F)F 4a_100011219839_200000210099 [0,1,1,0,0,0|2,0,0]=4 604 B14R1.16 CCCNC(=O)c1cccc(c1Br)O 240690a_100020643023_100010230362 [0,1,1,0,0,0|1,0,1]=4 605 B14R1.16 CCCNC(=O)c1cccc(c1Br)O 527a_100020643023_100010230362 [0,1,1,0,0,0|1,0,1]=4 606 B14R1.16 CCCNC(=O)c1cccc(c1C)O 240690a_100020643023_100000766327 [0,1,1,0,0,0|1,0,1]=4 607 B14R1.16 CCCNC(=O)c1cccc(c1C)O 527a_100020643023_100000766327 [0,1,1,0,0,0|1,0,1]=4 608 B14R1.16 CCCNC(=O)c1cccc(c1Cl)O 240690a_100020643023_100000092362 [0,1,1,0,0,0|1,0,1]=4 609 B14R1.16 CCCNC(=O)c1cccc(c1Cl)O 527a_100020643023_100000092362 [0,1,1,0,0,0|1,0,1]=4 610 B14R1.16 CCCNC(=O)c1cccc(c1F)O 240690a_100020643023_100000037433 [0,1,1,0,0,0|1,0,1]=4 611 B14R1.16 CCCNC(=O)c1cccc(c1F)O 527a_100020643023_100000037433 [0,1,1,0,0,0|1,0,1]=4 612 B14R1.16 CCCNC(=O)c1cccc(c1I)O 527a_100020643023_100010084636 [0,1,1,0,0,0|1,0,1]=4 613 B14R1.16 CCCNC(=O)c1cccc(c1O)O 527a_100020643023_100000690420 [0,1,1,0,0,0|1,0,1]=4 614 B14R1.16 CCNNC(=O)c1cccc(c1Br)O 22a_100000756455_100010230362 [0,1,1,0,0,0|1,0,1]=4 615 B14R1.16 CCNNC(=O)c1cccc(c1C)O 22a_100000756455_100000766327 [0,1,1,0,0,0|1,0,1]=4 616 B14R1.16 CCNNC(=O)c1cccc(c1Cl)O 22a_100000756455_100000092362 [0,1,1,0,0,0|1,0,1]=4 617 B14R1.16 CCNNC(=O)c1cccc(c1F)O 22a_100000756455_100000037433 [0,1,1,0,0,0|1,0,1]=4 618 B14R1.16 CCNNC(=O)c1cccc(c1I)O 22a_100000756455_100010084636 [0,1,1,0,0,0|1,0,1]=4 619 B14R1.16 CCNNC(=O)c1cccc(c1O)O 22a_100000756455_100000690420 [0,1,1,0,0,0|1,0,1]=4 620 B14R1.16 Cc1c(cccc1C(=O)NCCF)O 240690a_100000724931_100000766327 [0,1,1,0,0,0|1,0,1]=4 621 B14R1.16 Cc1c(cccc1C(=O)NCCF)O 527a_100000724931_100000766327 [0,1,1,0,0,0|1,0,1]=4 622 B14R1.16 Cc1c(cccc1C(=O)NCCO)O 240690a_100000210304_100000766327 [0,1,1,0,0,0|1,0,1]=4 623 B14R1.16 Cc1c(cccc1C(=O)NCCO)O 527a_100000210304_100000766327 [0,1,1,0,0,0|1,0,1]=4 624 B14R1.16 O=C(NCCF)c1cccc(c1Br)O 240690a_100000724931_100010230362 [0,1,1,0,0,0|1,0,1]=4 625 B14R1.16 O=C(NCCF)c1cccc(c1Br)O 527a_100000724931_100010230362 [0,1,1,0,0,0|1,0,1]=4 626 B14R1.16 O=C(NCCF)c1cccc(c1Cl)O 240690a_100000724931_100000092362 [0,1,1,0,0,0|1,0,1]=4 627 B14R1.16 O=C(NCCF)c1cccc(c1Cl)O 527a_100000724931_100000092362 [0,1,1,0,0,0|1,0,1]=4 628 B14R1.16 O=C(NCCF)c1cccc(c1F)O 240690a_100000724931_100000037433 [0,1,1,0,0,0|1,0,1]=4 629 B14R1.16 O=C(NCCF)c1cccc(c1F)O 527a_100000724931_100000037433 [0,1,1,0,0,0|1,0,1]=4 630 B14R1.16 O=C(NCCF)c1cccc(c1I)O 527a_100000724931_100010084636 [0,1,1,0,0,0|1,0,1]=4 631 B14R1.16 O=C(NCCF)c1cccc(c1O)O 527a_100000724931_100000690420 [0,1,1,0,0,0|1,0,1]=4 632 B14R1.16 O=C(NCCO)c1cccc(c1Br)O 240690a_100000210304_100010230362 [0,1,1,0,0,0|1,0,1]=4 633 B14R1.16 O=C(NCCO)c1cccc(c1Br)O 527a_100000210304_100010230362 [0,1,1,0,0,0|1,0,1]=4 634 B14R1.16 O=C(NCCO)c1cccc(c1Cl)O 240690a_100000210304_100000092362 [0,1,1,0,0,0|1,0,1]=4 635 B14R1.16 O=C(NCCO)c1cccc(c1Cl)O 527a_100000210304_100000092362 [0,1,1,0,0,0|1,0,1]=4 636 B14R1.16 O=C(NCCO)c1cccc(c1F)O 240690a_100000210304_100000037433 [0,1,1,0,0,0|1,0,1]=4 637 B14R1.16 O=C(NCCO)c1cccc(c1F)O 527a_100000210304_100000037433 [0,1,1,0,0,0|1,0,1]=4 638 B14R1.16 O=C(NCCO)c1cccc(c1I)O 527a_100000210304_100010084636 [0,1,1,0,0,0|1,0,1]=4 639 B14R1.16 O=C(NCCO)c1cccc(c1O)O 527a_100000210304_100000690420 [0,1,1,0,0,0|1,0,1]=4 640 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)O 240690a_100000225621_100010230362 [0,1,1,0,0,0|1,0,1]=4 641 B14R1.18 CCN(C)C(=O)c1cccc(c1Br)O 527a_100000225621_100010230362 [0,1,1,0,0,0|1,0,1]=4 642 B14R1.18 CCN(C)C(=O)c1cccc(c1C)O 240690a_100000225621_100000766327 [0,1,1,0,0,0|1,0,1]=4 643 B14R1.18 CCN(C)C(=O)c1cccc(c1C)O 527a_100000225621_100000766327 [0,1,1,0,0,0|1,0,1]=4 644 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)O 240690a_100000225621_100000092362 [0,1,1,0,0,0|1,0,1]=4 645 B14R1.18 CCN(C)C(=O)c1cccc(c1Cl)O 527a_100000225621_100000092362 [0,1,1,0,0,0|1,0,1]=4 646 B14R1.18 CCN(C)C(=O)c1cccc(c1F)O 240690a_100000225621_100000037433 [0,1,1,0,0,0|1,0,1]=4 647 B14R1.18 CCN(C)C(=O)c1cccc(c1F)O 527a_100000225621_100000037433 [0,1,1,0,0,0|1,0,1]=4 648 B14R1.18 CCN(C)C(=O)c1cccc(c1I)O 527a_100000225621_100010084636 [0,1,1,0,0,0|1,0,1]=4 649 B14R1.18 CCN(C)C(=O)c1cccc(c1O)O 527a_100000225621_100000690420 [0,1,1,0,0,0|1,0,1]=4 650 B14R1.18 CON(C)C(=O)c1cccc(c1F)O 271570a_203496583355_200012769493 [0,1,1,0,0,0|2,0,0]=4 651 B14R1.152 C=C(C)CC(=O)c1cccc(c1Br)O 1458a_100010230362_100000748629 [0,1,1,0,0,0|2,0,0]=4 652 B14R1.152 C=C(C)CC(=O)c1cccc(c1C)O 1458a_100000766327_100000748629 [0,1,1,0,0,0|2,0,0]=4 653 B14R1.152 C=C(C)CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000748629 [0,1,1,0,0,0|2,0,0]=4 654 B14R1.152 C=C(C)CC(=O)c1cccc(c1F)O 1458a_100000037433_100000748629 [0,1,1,0,0,0|2,0,0]=4 655 B14R1.152 C=C(C)CC(=O)c1cccc(c1I)O 1458a_100010084636_100000748629 [0,1,1,0,0,0|2,0,0]=4 656 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)O 1458a_100000690420_100000748629 [0,1,1,0,0,0|2,0,0]=4 657 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)O 240690a_100138425928_100010230362 [0,1,1,0,0,0|1,0,1]=4 658 B14R1.152 CC(C)NC(=O)c1cccc(c1Br)O 527a_100138425928_100010230362 [0,1,1,0,0,0|1,0,1]=4 659 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)O 240690a_100138425928_100000092362 [0,1,1,0,0,0|1,0,1]=4 660 B14R1.152 CC(C)NC(=O)c1cccc(c1Cl)O 527a_100138425928_100000092362 [0,1,1,0,0,0|1,0,1]=4 661 B14R1.152 CC(C)NC(=O)c1cccc(c1F)O 240690a_100138425928_100000037433 [0,1,1,0,0,0|1,0,1]=4 662 B14R1.152 CC(C)NC(=O)c1cccc(c1F)O 527a_100138425928_100000037433 [0,1,1,0,0,0|1,0,1]=4 663 B14R1.152 CC(C)NC(=O)c1cccc(c1I)O 527a_100138425928_100010084636 [0,1,1,0,0,0|1,0,1]=4 664 B14R1.152 CC(C)NC(=O)c1cccc(c1O)O 527a_100138425928_100000690420 [0,1,1,0,0,0|1,0,1]=4 665 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)O 240690a_100138425928_100000766327 [0,1,1,0,0,0|1,0,1]=4 666 B14R1.152 Cc1c(cccc1C(=O)NC(C)C)O 527a_100138425928_100000766327 [0,1,1,0,0,0|1,0,1]=4 667 B14R1.618 CCNC(=O)c1cccc(c1Br)OC 11a_100015525214_100010245468 [0,1,1,0,0,0|1,0,1]=4 668 B14R1.618 CCNC(=O)c1cccc(c1Br)OC 240690a_100015525214_100010245468 [0,1,1,0,0,0|1,0,1]=4 669 B14R1.618 CCNC(=O)c1cccc(c1Br)OC 527a_100015525214_100010245468 [0,1,1,0,0,0|1,0,1]=4 670 B14R1.618 CCNC(=O)c1cccc(c1C)OC 11a_100015525214_100011217801 [0,1,1,0,0,0|1,0,1]=4 671 B14R1.618 CCNC(=O)c1cccc(c1C)OC 240690a_100015525214_100011217801 [0,1,1,0,0,0|1,0,1]=4 672 B14R1.618 CCNC(=O)c1cccc(c1C)OC 527a_100015525214_100011217801 [0,1,1,0,0,0|1,0,1]=4 673 B14R1.618 CCNC(=O)c1cccc(c1Cl)OC 11a_100015525214_100000068443 [0,1,1,0,0,0|1,0,1]=4 674 B14R1.618 CCNC(=O)c1cccc(c1Cl)OC 240690a_100015525214_100000068443 [0,1,1,0,0,0|1,0,1]=4 675 B14R1.618 CCNC(=O)c1cccc(c1Cl)OC 527a_100015525214_100000068443 [0,1,1,0,0,0|1,0,1]=4 676 B14R1.618 CCNC(=O)c1cccc(c1F)OC 11a_100015525214_100000766180 [0,1,1,0,0,0|1,0,1]=4 677 B14R1.618 CCNC(=O)c1cccc(c1F)OC 240690a_100015525214_100000766180 [0,1,1,0,0,0|1,0,1]=4 678 B14R1.618 CCNC(=O)c1cccc(c1F)OC 527a_100015525214_100000766180 [0,1,1,0,0,0|1,0,1]=4 679 B14R1.618 CCNC(=O)c1cccc(c1I)OC 11a_100015525214_100010075502 [0,1,1,0,0,0|1,0,1]=4 680 B14R1.618 CCNC(=O)c1cccc(c1I)OC 240690a_100015525214_100010075502 [0,1,1,0,0,0|1,0,1]=4 681 B14R1.618 CCNC(=O)c1cccc(c1I)OC 527a_100015525214_100010075502 [0,1,1,0,0,0|1,0,1]=4 682 B14R1.618 CCNC(=O)c1cccc(c1O)OC 240690a_100015525214_100000212136 [0,1,1,0,0,0|1,0,1]=4 683 B14R1.618 CCNC(=O)c1cccc(c1O)OC 527a_100015525214_100000212136 [0,1,1,0,0,0|1,0,1]=4 684 B14R1.618 CNNC(=O)c1cccc(c1Br)OC 22a_100016993582_100010245468 [0,1,1,0,0,0|2,0,0]=4 685 B14R1.618 CNNC(=O)c1cccc(c1C)OC 22a_100016993582_100011217801 [0,1,1,0,0,0|2,0,0]=4 686 B14R1.618 CNNC(=O)c1cccc(c1Cl)OC 22a_100016993582_100000068443 [0,1,1,0,0,0|2,0,0]=4 687 B14R1.618 CNNC(=O)c1cccc(c1F)OC 22a_100016993582_100000766180 [0,1,1,0,0,0|2,0,0]=4 688 B14R1.618 CNNC(=O)c1cccc(c1I)OC 22a_100016993582_100010075502 [0,1,1,0,0,0|2,0,0]=4 689 B14R1.618 CNNC(=O)c1cccc(c1O)OC 22a_100016993582_100000212136 [0,1,1,0,0,0|2,0,0]=4 690 B14R1.7255 CNNC(=O)c1cccc(c1OC)O 22a_100016993582_100000080799 [0,1,1,0,0,0|2,0,0]=4 691 B14R1.7265 CCNC(=O)c1ccc(c(c1Br)O)Br 240690a_100015525214_100016068111 [0,1,1,0,0,0|1,0,1]=4 692 B14R1.7265 CCNC(=O)c1ccc(c(c1Br)O)Br 527a_100015525214_100016068111 [0,1,1,0,0,0|1,0,1]=4 693 B14R1.7265 CCNC(=O)c1ccc(c(c1Cl)O)O 240690a_100015525214_100009910189 [0,1,1,0,0,0|1,0,1]=4 694 B14R1.7265 CCNC(=O)c1ccc(c(c1F)O)F 240690a_100015525214_100000084588 [0,1,1,0,0,0|1,0,1]=4 695 B14R1.7265 CNNC(=O)c1ccc(c(c1Br)O)Br 22a_100016993582_100016068111 [0,1,1,0,0,0|2,0,0]=4 696 B14R1.7265 CNNC(=O)c1ccc(c(c1Cl)O)O 22a_100016993582_100009910189 [0,1,1,0,0,0|2,0,0]=4 697 B14R1.7265 CNNC(=O)c1ccc(c(c1F)O)F 22a_100016993582_100000084588 [0,1,1,0,0,0|2,0,0]=4 698 B14R1.7281 CCNC(=O)c1c(ccc(c1F)O)F 240690a_100015525214_100000068660 [0,1,1,0,0,0|1,0,1]=4 699 B14R1.7281 CCNC(=O)c1c(ccc(c1F)O)F 527a_100015525214_100000068660 [0,1,1,0,0,0|1,0,1]=4 700 B14R1.7281 CNNC(=O)c1c(ccc(c1F)O)F 22a_100016993582_100000068660 [0,1,1,0,0,0|2,0,0]=4 701 B14R1.18985 CCNC(=O)c1cc(cc(c1C)O)Br 240690a_100015525214_100011101721 [0,1,1,0,0,0|1,0,1]=4 702 B14R1.18985 CCNC(=O)c1cc(cc(c1C)O)Br 527a_100015525214_100011101721 [0,1,1,0,0,0|1,0,1]=4 703 B14R1.18985 CNNC(=O)c1cc(cc(c1C)O)Br 22a_100016993582_100011101721 [0,1,1,0,0,0|2,0,0]=4 704 B14R1.11 C#CC(C)NC(=O)c1cccc(c1)O 240690a_100000707721_100000183914 [0,1,1,0,0,0|1,0,1]=4 705 B14R1.11 C#CC(C)NC(=O)c1cccc(c1)O 527a_100000707721_100000183914 [0,1,1,0,0,0|1,0,1]=4 706 B14R1.11 CC(C#N)NC(=O)c1cccc(c1)O 527a_100000737613_100000183914 [0,1,1,0,0,0|0,0,2]=4 707 B14R1.11 CCC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000747405 [0,1,1,0,0,0|2,0,0]=4 708 B14R1.11 CCC(=O)CC(=O)c1cccc(c1)O 1458a_100000210414_100009813753 [0,1,1,0,0,0|2,0,0]=4 709 B14R1.11 CCC(C)NC(=O)c1cccc(c1)O 240690a_100000209981_100000183914 [0,1,1,0,0,0|1,0,1]=4 710 B14R1.11 CCC(C)NC(=O)c1cccc(c1)O 527a_100000209981_100000183914 [0,1,1,0,0,0|1,0,1]=4 711 B14R1.11 CNC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000183359 [0,1,1,0,0,0|2,0,0]=4 712 B14R1.11 COC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000747449 [0,1,1,0,0,0|2,0,0]=4 713 B14R1.11 COC(=O)CC(=O)c1cccc(c1)O 271570a_203496583355_100012340505 [0,1,1,0,0,0|2,0,0]=4 714 B14R1.11 C[C@H](CF)NC(=O)c1cccc(c1)O 240690a_100102880703_100000183914 [0,1,1,0,0,0|1,0,1]=4 715 B14R1.11 C[C@H](CF)NC(=O)c1cccc(c1)O 527a_100102880703_100000183914 [0,1,1,0,0,0|1,0,1]=4 716 B14R1.11 C[C@H](CO)NC(=O)c1cccc(c1)O 240690a_100000737577_100000183914 [0,1,1,0,0,0|1,0,1]=4 717 B14R1.11 C[C@H](CO)NC(=O)c1cccc(c1)O 527a_100000737577_100000183914 [0,1,1,0,0,0|1,0,1]=4 718 B14R1.11 O=C(CO)CC(=O)c1cccc(c1)O 1458a_100000210174_100009813753 [0,1,1,0,0,0|2,0,0]=4 719 B14R1.74 C=C(C)CC(=O)c1cccc(c1)CO 1458a_100000746274_100000748629 [0,1,1,0,0,0|2,0,0]=4 720 B14R1.74 C=C(C)CC(=O)c1cccc(c1)OC 1458a_100000188888_100000748629 [0,1,1,0,0,0|2,0,0]=4 721 B14R1.74 CC(C)NC(=O)c1cccc(c1)CO 240690a_100138425928_100000746274 [0,1,1,0,0,0|1,0,1]=4 722 B14R1.74 COc1cccc(c1)C(=O)CC(=O)C 1458a_100000070787_100000211451 [0,1,1,0,0,0|2,0,0]=4 723 B14R1.74 COc1cccc(c1)C(=O)NC(C)C 11a_100138425928_100000188888 [0,1,1,0,0,0|1,0,1]=4 724 B14R1.74 COc1cccc(c1)C(=O)NC(C)C 1626a_100138425928_100000188888 [0,1,1,0,0,0|1,0,1]=4 725 B14R1.74 COc1cccc(c1)C(=O)NC(C)C 240690a_100138425928_100000188888 [0,1,1,0,0,0|1,0,1]=4 726 B14R1.74 COc1cccc(c1)C(=O)NC(C)C 527a_100138425928_100000188888 [0,1,1,0,0,0|1,0,1]=4 727 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000179758 [0,1,1,0,0,0|2,0,0]=4 728 B14R1.150 CC(C)N(C)C(=O)c1cccc(c1)O 240690a_200000211004_100000183914 [0,1,1,0,0,0|1,0,1]=4 729 B14R1.150 CC(C)N(C)C(=O)c1cccc(c1)O 527a_200000211004_100000183914 [0,1,1,0,0,0|1,0,1]=4 730 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000748629 [0,1,1,0,0,0|2,0,0]=4 731 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000748629 [0,1,1,0,0,0|2,0,0]=4 732 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000748629 [0,1,1,0,0,0|2,0,0]=4 733 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000748629 [0,1,1,0,0,0|2,0,0]=4 734 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000748629 [0,1,1,0,0,0|2,0,0]=4 735 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000748629 [0,1,1,0,0,0|2,0,0]=4 736 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000070787_100000183813 [0,1,1,0,0,0|2,0,0]=4 737 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)Br 240690a_100138425928_100000689001 [0,1,1,0,0,0|1,0,1]=4 738 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)Br 527a_100138425928_100000689001 [0,1,1,0,0,0|1,0,1]=4 739 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)Cl 240690a_100138425928_100011933997 [0,1,1,0,0,0|1,0,1]=4 740 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)Cl 527a_100138425928_100011933997 [0,1,1,0,0,0|1,0,1]=4 741 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)F 240690a_100138425928_100000035894 [0,1,1,0,0,0|1,0,1]=4 742 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359899 [0,1,1,0,0,0|1,0,1]=4 743 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)F 527a_100138425928_100000035894 [0,1,1,0,0,0|1,0,1]=4 744 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)I 1626a_100138425928_100000239334 [0,1,1,0,0,0|1,0,1]=4 745 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)I 240690a_100138425928_100000239334 [0,1,1,0,0,0|1,0,1]=4 746 B14R1.685 CC(C)NC(=O)c1ccc(c(c1)O)I 527a_100138425928_100000239334 [0,1,1,0,0,0|1,0,1]=4 747 B14R1.685 Cc1ccc(cc1O)C(=O)NC(C)C 240690a_100138425928_100000233767 [0,1,1,0,0,0|1,0,1]=4 748 B14R1.4252 C=C(C)CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000748629 [0,1,1,0,0,0|2,0,0]=4 749 B14R1.4252 C=C(C)CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000748629 [0,1,1,0,0,0|2,0,0]=4 750 B14R1.4252 C=C(C)CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000748629 [0,1,1,0,0,0|2,0,0]=4 751 B14R1.4252 C=C(C)CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000748629 [0,1,1,0,0,0|2,0,0]=4 752 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)Br)O 240690a_100138425928_100011934545 [0,1,1,0,0,0|1,0,1]=4 753 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)Br)O 527a_100138425928_100011934545 [0,1,1,0,0,0|1,0,1]=4 754 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)Cl)O 240690a_100138425928_100011997059 [0,1,1,0,0,0|1,0,1]=4 755 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)Cl)O 527a_100138425928_100011997059 [0,1,1,0,0,0|1,0,1]=4 756 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)F)O 11a_100138425928_100012017291 [0,1,1,0,0,0|1,0,1]=4 757 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)F)O 240690a_100138425928_100012017291 [0,1,1,0,0,0|1,0,1]=4 758 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)F)O 527a_100138425928_100012017291 [0,1,1,0,0,0|1,0,1]=4 759 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)O)O 240690a_100138425928_100000690292 [0,1,1,0,0,0|1,0,1]=4 760 B14R1.4252 CC(C)NC(=O)c1cc(cc(c1)O)O 527a_100138425928_100000690292 [0,1,1,0,0,0|1,0,1]=4 761 B14R1.4252 Cc1cc(cc(c1)C(=O)NC(C)C)O 240690a_100138425928_100000094094 [0,1,1,0,0,0|1,0,1]=4 762 B14R1.4252 Cc1cc(cc(c1)C(=O)NC(C)C)O 527a_100138425928_100000094094 [0,1,1,0,0,0|1,0,1]=4 763 B14R1.5966 CC(C)(C)NC(=O)c1cccc(c1)O 240690a_100000715429_100000183914 [0,1,1,0,0,0|1,0,1]=4 764 B14R1.5966 CC(C)(C)NC(=O)c1cccc(c1)O 271570a_203496583355_200000154201 [0,1,1,0,0,0|1,0,1]=4 765 B14R1.5966 CC(C)(C)NC(=O)c1cccc(c1)O 527a_100000715429_100000183914 [0,1,1,0,0,0|1,0,1]=4 766 B14R1.5966 CS(=O)(=O)NC(=O)c1cccc(c1)O 2740a_100000171171_100000183914 [0,1,1,0,0,0|2,0,0]=4 767 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000748629 [0,1,1,0,0,0|2,0,0]=4 768 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1C)O 1458a_100000687834_100000748629 [0,1,1,0,0,0|2,0,0]=4 769 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000748629 [0,1,1,0,0,0|2,0,0]=4 770 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1F)O 1458a_100000037260_100000748629 [0,1,1,0,0,0|2,0,0]=4 771 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1I)O 1458a_200009995701_100000748629 [0,1,1,0,0,0|2,0,0]=4 772 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100000748629 [0,1,1,0,0,0|2,0,0]=4 773 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)O 1458a_100000070787_100009814097 [0,1,1,0,0,0|2,0,0]=4 774 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)O 240690a_100138425928_100012352043 [0,1,1,0,0,0|1,0,1]=4 775 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Br)O 527a_100138425928_100012352043 [0,1,1,0,0,0|1,0,1]=4 776 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)O 240690a_100138425928_100000719527 [0,1,1,0,0,0|1,0,1]=4 777 B14R1.6052 CC(C)NC(=O)c1cc(ccc1Cl)O 527a_100138425928_100000719527 [0,1,1,0,0,0|1,0,1]=4 778 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)O 240690a_100138425928_100000037260 [0,1,1,0,0,0|1,0,1]=4 779 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)O 527a_100138425928_100000037260 [0,1,1,0,0,0|1,0,1]=4 780 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)O 1626a_100138425928_200009995701 [0,1,1,0,0,0|1,0,1]=4 781 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)O 240690a_100138425928_200009995701 [0,1,1,0,0,0|1,0,1]=4 782 B14R1.6052 CC(C)NC(=O)c1cc(ccc1I)O 527a_100138425928_200009995701 [0,1,1,0,0,0|1,0,1]=4 783 B14R1.6052 Cc1ccc(cc1C(=O)NC(C)C)O 240690a_100138425928_100000687834 [0,1,1,0,0,0|1,0,1]=4 784 B14R1.2196 CC(=C(C)c1c(cccc1C=O)O)C 271570a_200000049429_100009816417 [0,1,1,0,0,0|2,0,0]=4 785 B14R1.4109 CC(=Cc1c(ccc(c1C=O)O)O)C 271570a_100102525489_100010184888 [0,1,1,0,0,0|2,0,0]=4 786 B14R1.3101 CC=Cc1c(cccc1C(=O)OC)O 271570a_100016259895_200010230364 [0,1,1,0,0,0|2,0,0]=4 787 B14R2.142 C=Cc1ccc2cccc(c2n1)O 271570a_100011290941_100010153751 [1,1,0,0,0,0|1,0,1]=4 788 B14R2.142 C=Cc1ncc2cccc(c2n1)O 271570a_100011290941_100010674811 [1,1,0,0,0,0|0,0,2]=4 789 B14R2.142 CNc1ccc2cccc(c2c1)O 34a_100132313934_200000210301 [1,1,0,0,0,0|2,0,0]=4 790 B14R2.142 CNc1ccc2cccc(c2n1)C 27a_100102657272_100012002297 [1,1,0,0,0,0|2,0,0]=4 791 B14R2.142 CNc1ccc2cccc(c2n1)O 27a_100102657272_100010153751 [1,1,0,0,0,0|1,0,0]=3 792 B14R2.142 COc1cc2c(cccc2cn1)O 271570a_203496583355_100010126886 [1,1,0,0,0,0|1,0,1]=4 793 B14R2.142 COc1ccc2cccc(c2c1)O 271570a_203496583355_100010178974 [1,1,0,0,0,0|2,0,0]=4 794 B14R2.142 COc1ccc2nccc(c2n1)O 271570a_203496583355_100000090520 [1,1,0,0,0,0|2,0,0]=4 795 B14R2.142 CSc1ccc2cccc(c2c1)O 62a_200000210301_100010089991 [1,1,0,0,0,0|2,0,0]=4 796 B14R2.142 CSc1ccc2cccc(c2n1)C 62a_200000210301_100012002297 [1,1,0,0,0,0|2,0,0]=4 797 B14R2.142 CSc1ccc2cccc(c2n1)F 62a_200000210301_100012017632 [1,1,0,0,0,0|2,0,0]=4 798 B14R2.142 CSc1ccc2cccc(c2n1)O 62a_200000210301_100000013812 [1,1,0,0,0,0|1,0,0]=3 799 B14R2.142 CSc1ncc2cccc(c2n1)O 62a_200000210301_100010674811 [1,1,0,0,0,0|0,0,1]=3 800 B14R2.142 Cc1cccc2c1nc(cc2)S[13CH3] 62a_200025704644_100012002297 [1,1,0,0,0,0|2,0,0]=4 801 B14R2.142 [13CH3]Nc1ccc2cccc(c2c1)O 34a_100132313934_200025704644 [1,1,0,0,0,0|2,0,0]=4 802 B14R2.142 [13CH3]Sc1ccc2cccc(c2c1)O 62a_200025704644_100010089991 [1,1,0,0,0,0|2,0,0]=4 803 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)F 62a_200025704644_100012017632 [1,1,0,0,0,0|2,0,0]=4 804 B14R2.142 [13CH3]Sc1ccc2cccc(c2n1)O 62a_200025704644_100000013812 [1,1,0,0,0,0|1,0,0]=3 805 B14R2.142 [13CH3]Sc1ncc2cccc(c2n1)O 62a_200025704644_100010674811 [1,1,0,0,0,0|0,0,1]=3 806 B14R2.8751 Cc1ccc2c(ccc(c2n1)N)O 271570a_203496583355_100012970290 [1,1,0,0,0,0|2,0,0]=4 807 B14R2.11684 C=Cc1cccc2c1nc(cc2)C 271570a_100011290941_100011934484 [1,1,0,0,0,0|2,0,0]=4 808 B14R2.11684 CNc1cccc2c1nc(cc2)C 34a_100000019871_200000210301 [1,1,0,0,0,0|2,0,0]=4 809 B14R2.11684 COc1cccc2c1cc(cc2)C 34a_100000040781_200000210301 [1,1,0,0,0,0|2,0,0]=4 810 B14R2.11684 COc1cccc2c1cc(cc2)C 7a_100000040781_200000210301 [1,1,0,0,0,0|2,0,0]=4 811 B14R2.11684 COc1cccc2c1nc(cc2)Br 34a_100010153751_200000210301 [1,1,0,0,0,0|2,0,0]=4 812 B14R2.11684 COc1cccc2c1nc(cc2)Br 7a_100010153751_200000210301 [1,1,0,0,0,0|2,0,0]=4 813 B14R2.11684 COc1cccc2c1nc(cc2)C 34a_100000184714_200000210301 [1,1,0,0,0,0|1,0,0]=3 814 B14R2.11684 COc1cccc2c1nc(cc2)C 7a_100000184714_200000210301 [1,1,0,0,0,0|1,0,0]=3 815 B14R2.11684 COc1cccc2c1nc(cc2)Cl 34a_100000013812_200000210301 [1,1,0,0,0,0|2,0,0]=4 816 B14R2.11684 COc1cccc2c1nc(cc2)Cl 7a_100000013812_200000210301 [1,1,0,0,0,0|2,0,0]=4 817 B14R2.11684 COc1cccc2c1nc(cc2)N 34a_100000032106_200000210301 [1,1,0,0,0,0|2,0,0]=4 818 B14R2.11684 COc1cccc2c1nc(cc2)N 7a_100000032106_200000210301 [1,1,0,0,0,0|2,0,0]=4 819 B14R2.11684 COc1cccc2c1nc(cc2)O 271570a_203496583355_200011787714 [1,1,0,0,0,0|2,0,0]=4 820 B14R2.11684 COc1cccc2c1nc(nc2)Cl 34a_100010674811_200000210301 [1,1,0,0,0,0|1,0,1]=4 821 B14R2.11684 COc1cccc2c1nc(nc2)Cl 7a_100010674811_200000210301 [1,1,0,0,0,0|1,0,1]=4 822 B14R2.11684 COc1cccc2c1nc(nc2)O 271570a_203496583355_200000095598 [1,1,0,0,0,0|1,0,1]=4 823 B14R2.11684 CSc1cccc2c1nc(cc2)C 62a_200000210301_100011934484 [1,1,0,0,0,0|1,1,0]=4 824 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 34a_100000040781_200025704644 [1,1,0,0,0,0|2,0,0]=4 825 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 7a_100000040781_200025704644 [1,1,0,0,0,0|2,0,0]=4 826 B14R2.11684 Cc1ccc2cccc(c2n1)N[13CH3] 34a_100000019871_200025704644 [1,1,0,0,0,0|2,0,0]=4 827 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 34a_100000184714_200025704644 [1,1,0,0,0,0|1,0,0]=3 828 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 7a_100000184714_200025704644 [1,1,0,0,0,0|1,0,0]=3 829 B14R2.11684 Cc1ccc2cccc(c2n1)S[13CH3] 62a_200025704644_100011934484 [1,1,0,0,0,0|1,1,0]=4 830 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 34a_100010153751_200025704644 [1,1,0,0,0,0|2,0,0]=4 831 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 7a_100010153751_200025704644 [1,1,0,0,0,0|2,0,0]=4 832 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 34a_100000013812_200025704644 [1,1,0,0,0,0|2,0,0]=4 833 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 7a_100000013812_200025704644 [1,1,0,0,0,0|2,0,0]=4 834 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 34a_100000032106_200025704644 [1,1,0,0,0,0|2,0,0]=4 835 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 7a_100000032106_200025704644 [1,1,0,0,0,0|2,0,0]=4 836 B14R2.11684 [13CH3]Oc1cccc2c1nc(nc2)Cl 34a_100010674811_200025704644 [1,1,0,0,0,0|1,0,1]=4 837 B14R2.11684 [13CH3]Oc1cccc2c1nc(nc2)Cl 7a_100010674811_200025704644 [1,1,0,0,0,0|1,0,1]=4 838 B14R2.28472 Oc1nc2c(cccc2cc1F)O 271570a_203496583355_100010140959 [1,1,0,0,0,0|2,0,0]=4 839 B14R2.1019 CNc1cc(=O)n2ccccc2n1 27a_100102657272_100000707704 [1,1,0,0,0,0|2,0,0]=4 840 B14R2.1019 CNc1cc(c2ccccc2n1)C 27a_100102657272_100000184993 [1,1,0,0,0,0|2,0,0]=4 841 B14R2.1019 CNc1nc(c2ccccc2n1)C 27a_100102657272_100000046098 [1,1,0,0,0,0|1,0,1]=4 842 B14R2.1019 CNc1nc(c2ccccc2n1)N 27a_100102657272_100000690328 [1,1,0,0,0,0|1,0,1]=4 843 B14R2.1019 CNc1nc(c2ccccc2n1)O 271570a_203496583355_200020830163 [1,1,0,0,0,0|0,0,2]=4 844 B14R2.1019 CNc1nc(c2ccccc2n1)O 27a_100102657272_100000187174 [1,1,0,0,0,0|0,0,2]=4 845 B14R2.1019 COc1cc(=O)n2ccccc2n1 34a_100000751361_200000210301 [1,1,0,0,0,0|2,0,0]=4 846 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [1,1,0,0,0,0|1,0,1]=4 847 B14R2.1019 CSc1cc(=O)c2ccccc2[nH]1 62a_200000210301_100000090176 [1,1,0,0,0,0|1,0,1]=4 848 B14R2.1019 CSc1cc(=O)n2ccccc2n1 62a_200000210301_100000707704 [1,1,0,0,0,0|2,0,0]=4 849 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_100012354972_200000210301 [1,1,0,0,0,0|2,0,0]=4 850 B14R2.1019 CSc1cc(c2ccccc2n1)C 62a_200000210301_100000184993 [1,1,0,0,0,0|2,0,0]=4 851 B14R2.1019 CSc1cc(c2ccccc2n1)N 62a_100010197925_200000210301 [1,1,0,0,0,0|2,0,0]=4 852 B14R2.1019 CSc1cc2ccccc2c(=O)[nH]1 62a_200000210301_200015811170 [1,1,0,0,0,0|1,0,0]=3 853 B14R2.1019 CSc1nc(c2ccccc2n1)C 62a_100000046098_200000210301 [1,1,0,0,0,0|1,0,1]=4 854 B14R2.1019 CSc1nc(c2ccccc2n1)C 62a_200000210301_100000046098 [1,1,0,0,0,0|1,0,1]=4 855 B14R2.1019 CSc1nc(c2ccccc2n1)N 62a_100000690328_200000210301 [1,1,0,0,0,0|1,0,1]=4 856 B14R2.1019 CSc1nc(c2ccccc2n1)O 271570a_203496583355_100012352766 [1,1,0,0,0,0|0,0,2]=4 857 B14R2.1019 CSc1nc(c2ccccc2n1)O 62a_200000210301_100000187174 [1,1,0,0,0,0|0,0,2]=4 858 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_100012354972_200025704644 [1,1,0,0,0,0|2,0,0]=4 859 B14R2.1019 Cc1cc(nc2c1cccc2)S[13CH3] 62a_200025704644_100000184993 [1,1,0,0,0,0|2,0,0]=4 860 B14R2.1019 Cc1nc(nc2c1cccc2)S[13CH3] 62a_100000046098_200025704644 [1,1,0,0,0,0|1,0,1]=4 861 B14R2.1019 Cc1nc(nc2c1cccc2)S[13CH3] 62a_200025704644_100000046098 [1,1,0,0,0,0|1,0,1]=4 862 B14R2.1019 [13CH3]Oc1cc(=O)n2ccccc2n1 34a_100000751361_200025704644 [1,1,0,0,0,0|2,0,0]=4 863 B14R2.1019 [13CH3]Sc1cc(=O)c2ccccc2[nH]1 62a_200025704644_100000090176 [1,1,0,0,0,0|1,0,1]=4 864 B14R2.1019 [13CH3]Sc1cc(=O)n2ccccc2n1 62a_200025704644_100000707704 [1,1,0,0,0,0|2,0,0]=4 865 B14R2.1019 [13CH3]Sc1cc(c2ccccc2n1)N 62a_100010197925_200025704644 [1,1,0,0,0,0|2,0,0]=4 866 B14R2.1019 [13CH3]Sc1cc2ccccc2c(=O)[nH]1 62a_200025704644_200015811170 [1,1,0,0,0,0|1,0,0]=3 867 B14R2.1019 [13CH3]Sc1nc(c2ccccc2n1)N 62a_100000690328_200025704644 [1,1,0,0,0,0|1,0,1]=4 868 B14R2.1019 [13CH3]Sc1nc(c2ccccc2n1)O 62a_200025704644_100000187174 [1,1,0,0,0,0|0,0,2]=4 869 B14R2.1146 C=Cc1cc(nc2c1cccc2)C 271570a_100011290941_100000764982 [1,1,0,0,0,0|2,0,0]=4 870 B14R2.1146 C=Cc1nc(nc2c1cccc2)C 271570a_100011290941_100000230251 [1,1,0,0,0,0|1,0,1]=4 871 B14R2.1146 CNc1cc(nc2c1cccc2)C 27a_100102657272_100000735862 [1,1,0,0,0,0|2,0,0]=4 872 B14R2.1146 CNc1nc(nc2c1cccc2)C 27a_100102657272_100000230251 [1,1,0,0,0,0|1,0,1]=4 873 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [1,1,0,0,0,0|1,0,1]=4 874 B14R2.1146 CSc1cc(nc2c1cccc2)C 62a_100000764982_200000210301 [1,1,0,0,0,0|1,1,0]=4 875 B14R2.1146 CSc1cc(nc2c1cccc2)C 62a_200000210301_100000735862 [1,1,0,0,0,0|1,1,0]=4 876 B14R2.1146 CSc1nc(nc2c1cccc2)C 62a_100000230251_200000210301 [1,1,0,0,0,0|0,1,1]=4 877 B14R2.1146 CSc1nc(nc2c1cccc2)C 62a_200000210301_100000230251 [1,1,0,0,0,0|0,1,1]=4 878 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [1,1,0,0,0,0|1,0,1]=4 879 B14R2.1146 Cc1cc(c2ccccc2n1)S[13CH3] 62a_100000764982_200025704644 [1,1,0,0,0,0|1,1,0]=4 880 B14R2.1146 Cc1cc(c2ccccc2n1)S[13CH3] 62a_200025704644_100000735862 [1,1,0,0,0,0|1,1,0]=4 881 B14R2.1146 Cc1nc(c2ccccc2n1)S[13CH3] 62a_100000230251_200025704644 [1,1,0,0,0,0|0,1,1]=4 882 B14R2.1146 Cc1nc(c2ccccc2n1)S[13CH3] 62a_200025704644_100000230251 [1,1,0,0,0,0|0,1,1]=4 883 B14R2.8188 Cn1c(nc2ccccc2c1=O)O 271570a_203496583355_200000215938 [1,1,0,0,0,0|1,0,0]=3 884 B14R2.28480 Cc1nc(c2c(cccc2n1)C)O 271570a_203496583355_200012002097 [1,1,0,0,0,0|0,0,2]=4 885 B14R2.28480 Cc1nc(c2c(cccc2n1)O)O 271570a_203496583355_200010988834 [1,1,0,0,0,0|0,0,2]=4 886 B14R2.28480 Cc1nc2cccc(c2c(=O)o1)O 271570a_203496583355_200010128068 [1,1,0,0,0,0|1,0,0]=3 887 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)O 271570a_203496583355_100011290880 [1,1,0,0,0,0|1,0,1]=4 888 B14R2.29365 Cc1cc2cc(ccc2c(=O)[nH]1)O 271570a_203496583355_100010883700 [1,1,0,0,0,0|1,0,0]=3 889 B14R2.29365 Cc1ccc2c(nc(nc2c1)C)O 271570a_203496583355_200010384746 [1,1,0,0,0,0|0,0,2]=4 890 B14R2.29365 Cc1nc(c2ccc(cc2n1)F)O 271570a_203496583355_100012003523 [1,1,0,0,0,0|0,0,2]=4 891 B14R2.29365 Cc1nc2cc(ccc2c(=O)[nH]1)O 271570a_203496583355_100012357626 [1,1,0,0,0,0|0,0,0]=2 892 B14R2.29365 O=c1[nH]c(=O)c2ccc(cc2[nH]1)O 271570a_203496583355_100012351534 [1,1,0,0,0,0|1,0,1]=4 893 B14R2.1078 C=Cc1cccc2c1cc[nH]c2=O 271570a_100011290941_100000703947 [1,1,0,0,0,0|2,0,0]=4 894 B14R2.1078 C=Cc1ccnc2c1cccc2O 271570a_100011290941_100000703299 [1,1,0,0,0,0|2,0,0]=4 895 B14R2.1078 C=Cc1cncc2c1nc[nH]c2=O 271570a_100011290941_200010117198 [1,1,0,0,0,0|2,0,0]=4 896 B14R2.1078 CNc1cccc2c1nc[nH]c2=O 27a_100102657272_100000741247 [1,1,0,0,0,0|1,0,0]=3 897 B14R2.1078 CNc1ccnc2c1cccc2O 27a_100102657272_100000703299 [1,1,0,0,0,0|2,0,0]=4 898 B14R2.1078 CNc1cncc2c1nc[nH]c2=O 27a_100102657272_200010117198 [1,1,0,0,0,0|2,0,0]=4 899 B14R2.1078 COc1cccc2c1CCNC2=O 34a_100000079299_200000210301 [1,1,0,0,0,0|1,0,1]=4 900 B14R2.1078 COc1cccc2c1CCNC2=O 7a_100000079299_200000210301 [1,1,0,0,0,0|1,0,1]=4 901 B14R2.1078 COc1cccc2c1nccc2Br 34a_100000703299_200000210301 [1,1,0,0,0,0|2,0,0]=4 902 B14R2.1078 COc1cccc2c1nccc2Br 7a_100000703299_200000210301 [1,1,0,0,0,0|2,0,0]=4 903 B14R2.1078 COc1cccc2c1nccc2C 7a_100000702989_200000210301 [1,1,0,0,0,0|2,0,0]=4 904 B14R2.1078 COc1cccc2c1nccc2O 271570a_203496583355_100000709070 [1,1,0,0,0,0|1,0,1]=4 905 B14R2.1078 COc1cccc2c1ncnc2O 271570a_203496583355_100012001261 [1,1,0,0,0,0|0,0,2]=4 906 B14R2.1078 CSc1cccc2c1cc[nH]c2=O 62a_200000210301_100000703947 [1,1,0,0,0,0|1,1,0]=4 907 B14R2.1078 CSc1ccnc2c1cccc2O 62a_200000210301_100000703299 [1,1,0,0,0,0|1,1,0]=4 908 B14R2.1078 CSc1cncc2c1nc[nH]c2=O 62a_200000210301_200010117198 [1,1,0,0,0,0|1,1,0]=4 909 B14R2.1078 Cc1ccnc2c1cccc2O[13CH3] 7a_100000702989_200025704644 [1,1,0,0,0,0|2,0,0]=4 910 B14R2.1078 [13CH3]Oc1cccc2c1CCNC2=O 34a_100000079299_200025704644 [1,1,0,0,0,0|1,0,1]=4 911 B14R2.1078 [13CH3]Oc1cccc2c1CCNC2=O 7a_100000079299_200025704644 [1,1,0,0,0,0|1,0,1]=4 912 B14R2.1078 [13CH3]Oc1cccc2c1nccc2Br 34a_100000703299_200025704644 [1,1,0,0,0,0|2,0,0]=4 913 B14R2.1078 [13CH3]Oc1cccc2c1nccc2Br 7a_100000703299_200025704644 [1,1,0,0,0,0|2,0,0]=4 914 B14R2.1078 [13CH3]Sc1cccc2c1cc[nH]c2=O 62a_200025704644_100000703947 [1,1,0,0,0,0|1,1,0]=4 915 B14R2.1078 [13CH3]Sc1ccnc2c1cccc2O 62a_200025704644_100000703299 [1,1,0,0,0,0|1,1,0]=4 916 B14R2.1078 [13CH3]Sc1cncc2c1nc[nH]c2=O 62a_200025704644_200010117198 [1,1,0,0,0,0|1,1,0]=4 917 B14R2.8038 CN1CCc2c(cccc2C1=O)O 271570a_203496583355_100010269134 [1,1,0,0,0,0|1,0,1]=4 918 B14R2.8051 Cc1ccnc2c1c(ccc2O)C 271570a_203496583355_200010761301 [1,1,0,0,0,0|2,0,0]=4 919 B14R2.8051 O=c1cc[nH]c2c1c(ccc2O)F 271570a_203496583355_100012347610 [1,1,0,0,0,0|1,0,1]=4 920 B14R2.4220 Cn1nc2c(cccc2c1C=O)O 271570a_203496583355_100010240406 [0,1,0,0,1,0|1,0,0]=3 921 B14R2.8620 O=C1Nc2c(ccc(c2C1=O)F)O 271570a_203496583355_100000716705 [0,1,0,0,1,0|1,0,1]=4 922 B14R2.11691 C=Cc1cccc2c1C(=O)NC2=O 271570a_100011290941_100010194295 [0,1,0,0,1,0|2,0,0]=4 923 B14R2.11691 COc1cccc2c1C(=O)OC2=O 7a_100000042631_200000210301 [0,1,0,0,1,0|2,0,0]=4 924 B14R2.11691 CSc1cccc2c1C(=O)NC2=O 62a_100010194295_200000210301 [0,1,0,0,1,0|1,1,0]=4 925 B14R2.11691 [13CH3]Oc1cccc2c1C(=O)OC2=O 7a_100000042631_200025704644 [0,1,0,0,1,0|2,0,0]=4 926 B14R2.11691 [13CH3]Sc1cccc2c1C(=O)NC2=O 62a_100010194295_200025704644 [0,1,0,0,1,0|1,1,0]=4 927 B16R2.21720 CNCc1cc(=O)n2cccc(c2n1)O 7a_106832991635_200010191273 [0,2,0,0,0,0|2,0,0]=4 928 B16R2.21720 CNCc1nc2c(cccc2c(=O)[nH]1)C 2230a_106832991635_100000204627 [0,2,0,0,0,0|1,0,0]=3 929 B16R2.21720 CNCc1nc2c(cccc2c(=O)[nH]1)C 7a_106832991635_100000204627 [0,2,0,0,0,0|1,0,0]=3 930 B16R2.36835 C=Cc1cc2c(cccc2c(=O)[nH]1)OC 271570a_100011290941_200010523595 [0,2,0,0,0,0|1,0,1]=4 931 B16R2.36835 COc1cccn2c1nc(cc2=O)CCl 7a_200010191273_200000210301 [0,2,0,0,0,0|2,0,0]=4 932 B16R2.36835 [13CH3]Oc1cccn2c1nc(cc2=O)CCl 7a_200010191273_200025704644 [0,2,0,0,0,0|2,0,0]=4 933 B16R2.22293 Cc1cc(c2[nH]c(=O)n(c(=O)c2c1)C)O 271570a_203496583355_206835377772 [0,2,0,0,0,0|1,0,1]=4 934 B16R2.20017 C=C=Cc1cccc2c1nc([nH]c2=O)N 271570a_100015277604_100010142784 [0,2,0,0,0,0|2,0,0]=4 935 B16R2.20017 CC=Cc1cccc2c1nc([nH]c2=O)N 271570a_100016259895_100010142784 [0,2,0,0,0,0|2,0,0]=4 936 B16R2.20017 CCOc1cccc2c1nc(cc2C)C 34a_100000719286_100000210202 [0,2,0,0,0,0|2,0,0]=4 937 B16R2.20017 CCOc1cccc2c1nc(cc2C)C 7a_100000719286_100000210202 [0,2,0,0,0,0|2,0,0]=4 938 B16R2.20017 Cc1cc(c2cccc(c2n1)OCF)C 34a_100000719286_100015361967 [0,2,0,0,0,0|2,0,0]=4 939 B16R2.20017 Cc1cc(c2cccc(c2n1)OCF)C 7a_100000719286_100015361967 [0,2,0,0,0,0|2,0,0]=4 940 B16R2.26166 C=C(C)c1cccc2c1nc([nH]c2=O)N 271570a_100000694244_100010142784 [0,2,0,0,0,0|2,0,0]=4 941 B16R2.36833 C=Cc1cc(nc2c1cccc2OC)C 271570a_100011290941_100000689690 [0,2,0,0,0,0|2,0,0]=4 942 B16R2.36833 C=Cc1nc(nc2c1cccc2OC)C 271570a_100011290941_200010196080 [0,2,0,0,0,0|1,0,1]=4 943 B16R2.36833 CNc1cc(nc2c1cccc2OC)C 27a_100102657272_100000689690 [0,2,0,0,0,0|2,0,0]=4 944 B16R2.36833 CNc1nc(nc2c1cccc2OC)C 27a_100102657272_200010196080 [0,2,0,0,0,0|1,0,1]=4 945 B16R2.36833 COc1cc(nc2c1cccc2OC)C 34a_100000689699_200000210301 [0,2,0,0,0,0|1,0,1]=4 946 B16R2.36833 COc1cccc2c1nc(cc2O[13CH3])C 34a_100000689699_200025704644 [0,2,0,0,0,0|1,0,1]=4 947 B16R2.36833 COc1cccc2c1nc(nc2SC)C 62a_200000210301_200010196080 [0,2,0,0,0,0|0,1,1]=4 948 B16R2.36833 COc1cccc2c1nc(nc2S[13CH3])C 62a_200025704644_200010196080 [0,2,0,0,0,0|0,1,1]=4 949 B16R2.40108 C=Cc1cc(cc2c1nc([nH]c2=O)C)F 271570a_100011290941_100011015873 [0,2,0,0,0,0|1,0,0]=3 950 B16R2.40108 CNc1cc(cc2c1nc([nH]c2=O)C)F 27a_100102657272_100011015873 [0,2,0,0,0,0|1,0,0]=3 951 B16R2.40108 CSc1cc(cc2c1nc([nH]c2=O)C)F 62a_200000210301_100011015873 [0,2,0,0,0,0|0,1,0]=3 952 B16R2.40108 Cc1nc2c(cc(cc2c(=O)[nH]1)F)S[13CH3] 62a_200025704644_100011015873 [0,2,0,0,0,0|0,1,0]=3 953 B14R2.22 Cc1cc(sn1)c2cccc(c2)O 271570a_100000693801_100009815735 [0,0,1,1,0,0|1,1,0]=4 954 B14R2.22 Cc1ncc(s1)c2cccc(c2)O 271570a_100000693801_100000764884 [0,0,1,1,0,0|2,0,0]=4 955 B14R2.22 Cc1ncc(s1)c2cccc(c2)O 271570a_100000696845_100000211634 [0,0,1,1,0,0|2,0,0]=4 956 B14R2.22 Cc1nnc(o1)c2cccc(c2)O 271570a_100000693801_100000708914 [0,0,1,1,0,0|2,0,0]=4 957 B14R2.22 Cc1nnc(o1)c2cccc(c2)O 271570a_203496583355_100000756742 [0,0,1,1,0,0|2,0,0]=4 958 B14R2.22 Cc1nnc(s1)c2cccc(c2)O 271570a_100000693801_100000686958 [0,0,1,1,0,0|2,0,0]=4 959 B14R2.22 Cc1noc(n1)c2cccc(c2)O 270196a_100000212224_100000183914 [0,0,1,1,0,0|0,0,2]=4 960 B14R2.22 Cc1noc(n1)c2cccc(c2)O 271570a_203496583355_100000756750 [0,0,1,1,0,0|0,0,2]=4 961 B14R2.22 Cc1nsc(n1)c2cccc(c2)O 271570a_100000693801_100000709739 [0,0,1,1,0,0|0,1,1]=4 962 B14R2.9036 O=C(NC1CC1)c2cccc(c2)O 240690a_100000212008_100000183914 [0,0,1,1,0,0|1,0,1]=4 963 B14R2.9036 O=C(NC1CC1)c2cccc(c2)O 271570a_203496583355_200000155674 [0,0,1,1,0,0|1,0,1]=4 964 B14R2.9036 O=C(NC1CC1)c2cccc(c2)O 527a_100000212008_100000183914 [0,0,1,1,0,0|1,0,1]=4 965 B14R2.739 Cc1cc(c(cn1)c2ccco2)C 271570a_100000750936_100009819613 [0,0,1,1,0,0|2,0,0]=4 966 B14R2.739 Cc1cc(c(cn1)c2ccco2)N 271570a_100000750936_100009817891 [0,0,1,1,0,0|2,0,0]=4 967 B14R2.739 Cc1cc(c(cn1)c2ccco2)O 271570a_100000750936_100011016184 [0,0,1,1,0,0|1,0,1]=4 968 B14R2.739 Cc1ncc(c(=O)[nH]1)c2cc[nH]c2 271570a_100000102155_100011999157 [0,0,1,1,0,0|2,0,0]=4 969 B14R2.739 Cc1ncc(c(=O)[nH]1)c2cc[nH]n2 271570a_100000062414_100011999157 [0,0,1,1,0,0|2,0,0]=4 970 B14R2.739 Cc1ncc(c(=O)[nH]1)c2ccco2 271570a_100000750936_100011999157 [0,0,1,1,0,0|0,0,0]=2 971 B14R2.739 Cc1ncc(c(=O)[nH]1)c2cccs2 271570a_100000742291_100011999157 [0,0,1,1,0,0|0,1,0]=3 972 B14R2.739 Cc1ncc(c(=O)[nH]1)c2ccoc2 271570a_100011218838_100011999157 [0,0,1,1,0,0|2,0,0]=4 973 B14R2.739 Cc1ncc(c(=O)[nH]1)c2ccsc2 271570a_100011934443_100011999157 [0,0,1,1,0,0|2,0,0]=4 974 B14R2.739 Cc1ncc(c(=O)[nH]1)c2cncs2 271570a_100010231675_100011999157 [0,0,1,1,0,0|1,1,0]=4 975 B14R2.739 Cc1ncc(c(=O)[nH]1)c2ncc[nH]2 271570a_100016988920_100011999157 [0,0,1,1,0,0|2,0,0]=4 976 B14R2.739 Cc1ncc(c(n1)N)c2ccco2 271570a_100000750936_100000684960 [0,0,1,1,0,0|1,0,1]=4 977 B14R2.739 Nc1ncc(c(=O)[nH]1)c2ccco2 271570a_100000750936_100012456729 [0,0,1,1,0,0|1,0,0]=3 978 B14R2.739 Nc1ncc(c(=O)[nH]1)c2cccs2 271570a_100000742291_100012456729 [0,0,1,1,0,0|1,1,0]=4 979 B14R2.739 O=c1[nH]c(ncc1c2ccco2)O 271570a_100000750936_100011215686 [0,0,1,1,0,0|1,0,0]=3 980 B14R2.739 O=c1[nH]c(ncc1c2cccs2)O 271570a_100000742291_100011215686 [0,0,1,1,0,0|1,1,0]=4 981 B14R2.249 Cc1cc(cc(=O)[nH]1)c2ccco2 271570a_100000750936_100009861981 [0,0,1,1,0,0|1,0,0]=3 982 B14R2.249 Cc1cc(cc(=O)[nH]1)c2cccs2 271570a_100000742291_100009861981 [0,0,1,1,0,0|1,1,0]=4 983 B14R2.249 Cc1cc(nc(c1)c2ccco2)C 271570a_100000750936_100000069240 [0,0,1,1,0,0|2,0,0]=4 984 B14R2.249 Cc1cc(nc(n1)C)c2ccco2 271570a_100000750936_100000736142 [0,0,1,1,0,0|1,0,1]=4 985 B14R2.249 Cc1nc(cc(n1)c2ccco2)N 271570a_100000750936_100012178882 [0,0,1,1,0,0|1,0,1]=4 986 B14R2.249 Cc1nc(cc(n1)c2ccco2)O 271570a_100000750936_106741647437 [0,0,1,1,0,0|0,0,2]=4 987 B14R2.249 O=c1cc([nH]c(=O)[nH]1)c2ccco2 271570a_100000750936_100000015670 [0,0,1,1,0,0|1,0,1]=4 988 B14R2.296 Cc1[nH]cnc1c2ccccc2O 271570a_100000035170_100009816806 [0,0,1,1,0,0|2,0,0]=4 989 B14R2.712 C=C(C)c1cccc2c1nc(o2)C 271570a_100000694244_100010883239 [0,0,1,1,0,0|2,0,0]=4 990 B12R1.225 CC(=C(C)c1cccc(c1)O)C 271570a_200000049429_100000211634 [0,0,1,0,1,0|2,0,0]=4 991 B12R1.225 CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000210206 [0,0,1,0,1,0|1,0,1]=4 992 B12R1.225 CC(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011350656 [0,0,1,0,1,0|1,0,1]=4 993 B12R1.225 CN(C)C(=O)c1cccc(c1)O 240690a_100102631434_100000183914 [0,0,1,0,1,0|2,0,0]=4 994 B12R1.225 CN(C)C(=O)c1cccc(c1)O 271570a_203496583355_100000159571 [0,0,1,0,1,0|2,0,0]=4 995 B12R1.225 CN(C)C(=O)c1cccc(c1)O 527a_100102631434_100000183914 [0,0,1,0,1,0|2,0,0]=4 996 B12R1.437 C=C(C)c1c(cccc1C=O)F 271570a_100000694244_100011998484 [0,0,1,0,1,0|2,0,0]=4 997 B12R1.437 C=C(C)c1c(cccc1C=O)O 271570a_100000694244_100009816417 [0,0,1,0,1,0|1,0,0]=3 998 B12R1.437 C=Cc1cccc(c1C(=O)C)O 271570a_100011290941_100010174959 [0,0,1,0,1,0|2,0,0]=4 999 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [1,0,0,0,1,0|1,0,0]=3 1000 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [1,0,0,0,1,0|1,0,0]=3 1001 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [1,0,0,0,1,0|2,0,0]=4 1002 B12R2.202 Cc1cn2ccnc(c2n1)O 271570a_203496583355_100000098434 [1,0,0,0,1,0|2,0,0]=4 1003 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [1,0,0,0,1,0|0,0,0]=2 1004 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [1,0,0,0,1,0|1,0,0]=3 1005 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [1,0,0,0,1,0|1,0,0]=3 1006 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [1,0,0,0,1,0|1,0,1]=4 1007 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [1,0,0,0,1,0|1,0,1]=4 1008 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [1,0,0,0,1,0|1,0,0]=3 1009 B12R2.202 Cn1cc2ccnc(c2n1)O 271570a_203496583355_100010890759 [1,0,0,0,1,0|2,0,0]=4 1010 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [1,0,0,0,1,0|2,0,0]=4 1011 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [1,0,0,0,1,0|1,0,0]=3 1012 B12R2.202 Nc1nc2c(cccc2s1)O 271570a_203496583355_100000724365 [1,0,0,0,1,0|2,0,0]=4 1013 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [1,0,0,0,1,0|2,0,0]=4 1014 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [1,0,0,0,1,0|2,0,0]=4 1015 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [1,0,0,0,1,0|1,0,0]=3 1016 B12R2.202 Oc1nc2c(cncc2[nH]1)O 271570a_203496583355_100012340553 [1,0,0,0,1,0|2,0,0]=4 1017 B12R2.203 Cc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100010194227 [1,0,0,0,1,0|2,0,0]=4 1018 B12R2.203 Cc1n[nH]c2c1c(ccc2)O 271570a_203496583355_100010205804 [1,0,0,0,1,0|1,0,1]=4 1019 B12R2.203 Cn1ccc2c1c(ccc2)O 271570a_203496583355_100009817156 [1,0,0,0,1,0|2,0,0]=4 1020 B12R2.203 Cn1ncc2c1c(ccc2)O 271570a_203496583355_100009817178 [1,0,0,0,1,0|1,0,1]=4 1021 B12R2.203 O=C1NCc2c1c(ccc2)O 271570a_203496583355_100000724024 [1,0,0,0,1,0|1,0,1]=4 1022 B12R2.203 O=c1[nH][nH]c2c1c(ccc2)O 271570a_203496583355_100010170957 [1,0,0,0,1,0|2,0,0]=4 1023 B12R2.18 Cc1nc2ccccn2c1O 271570a_203496583355_100009816614 [1,0,0,0,1,0|1,0,1]=4 1024 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [1,0,0,0,1,0|1,0,1]=4 1025 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [1,0,0,0,1,0|1,0,1]=4 1026 B12R2.18 Cn1nc2ccccc2c1O 271570a_203496583355_100010163699 [1,0,0,0,1,0|1,0,1]=4 1027 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [1,0,0,0,1,0|1,0,1]=4 1028 B12R2.196 Cn1cnc2c1cccc2O 271570a_203496583355_100000696766 [1,0,0,0,1,0|2,0,0]=4 1029 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [1,0,0,0,1,0|1,0,1]=4 1030 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [1,0,0,0,1,0|1,0,1]=4 1031 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [1,0,0,0,1,0|0,0,1]=3 1032 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [1,0,0,0,1,0|1,0,1]=4 1033 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [1,0,0,0,1,0|0,0,1]=3 1034 B12R2.196 O=c1[nH]cnn2c1ccc2O 271570a_203496583355_100000724678 [1,0,0,0,1,0|1,0,0]=3 1035 B12R2.196 Oc1cccn2c1ncc2O 271570a_203496583355_200020799507 [1,0,0,0,1,0|1,0,1]=4 1036 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_100000730704 [0,0,1,0,0,1|2,0,0]=4 1037 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 11a_100000765925_100000210664 [0,0,1,0,0,1|2,0,0]=4 1038 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 1626a_100000765925_100000210664 [0,0,1,0,0,1|2,0,0]=4 1039 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 240690a_100000765925_100000210664 [0,0,1,0,0,1|2,0,0]=4 1040 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 527a_100000765925_100000210664 [0,0,1,0,0,1|2,0,0]=4 1041 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 11a_100000765925_100000189346 [0,0,1,0,0,1|2,0,0]=4 1042 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 1626a_100000765925_100000189346 [0,0,1,0,0,1|2,0,0]=4 1043 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 240690a_100000765925_100000189346 [0,0,1,0,0,1|2,0,0]=4 1044 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 527a_100000765925_100000189346 [0,0,1,0,0,1|2,0,0]=4 1045 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 11a_100000765925_100000210390 [0,0,1,0,0,1|2,0,0]=4 1046 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 1626a_100000765925_100000210390 [0,0,1,0,0,1|2,0,0]=4 1047 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 240690a_100000765925_100000210390 [0,0,1,0,0,1|2,0,0]=4 1048 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 527a_100000765925_100000210390 [0,0,1,0,0,1|2,0,0]=4 1049 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 11a_100000765925_100000210950 [0,0,1,0,0,1|2,0,0]=4 1050 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 1626a_100000765925_100000210950 [0,0,1,0,0,1|2,0,0]=4 1051 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 240690a_100000765925_100000210950 [0,0,1,0,0,1|2,0,0]=4 1052 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 527a_100000765925_100000210950 [0,0,1,0,0,1|2,0,0]=4 1053 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 11a_100000765925_100000184098 [0,0,1,0,0,1|2,0,0]=4 1054 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 1626a_100000765925_100000184098 [0,0,1,0,0,1|2,0,0]=4 1055 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 240690a_100000765925_100000184098 [0,0,1,0,0,1|2,0,0]=4 1056 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 527a_100000765925_100000184098 [0,0,1,0,0,1|2,0,0]=4 1057 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)O 240690a_100000765925_100000183914 [0,0,1,0,0,1|1,0,0]=3 1058 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)O 527a_100000765925_100000183914 [0,0,1,0,0,1|1,0,0]=3 1059 B14R1.149 CC(=CCC(=O)c1cccc(c1)O)C 1458a_100000183914_100000761012 [0,0,1,0,0,1|2,0,0]=4 1060 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)Br 1458a_100000179737_200000210301 [0,0,1,0,0,1|2,0,0]=4 1061 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)C 1458a_100000182573_200000210301 [0,0,1,0,0,1|2,0,0]=4 1062 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)Cl 1458a_100000182572_200000210301 [0,0,1,0,0,1|2,0,0]=4 1063 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)F 1458a_100000183068_200000210301 [0,0,1,0,0,1|2,0,0]=4 1064 B14R1.149 CC(=O)NN=C(C)c1cccc(c1)O 4a_100000189765_100000211620 [0,0,1,0,0,1|2,0,0]=4 1065 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)Br 22a_100000189765_100000210664 [0,0,1,0,0,1|2,0,0]=4 1066 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)Br 22a_100000189783_100000070787 [0,0,1,0,0,1|2,0,0]=4 1067 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)C 22a_100000189765_100000189346 [0,0,1,0,0,1|2,0,0]=4 1068 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)C 22a_100000189845_100000070787 [0,0,1,0,0,1|2,0,0]=4 1069 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)Cl 22a_100000183659_100000070787 [0,0,1,0,0,1|2,0,0]=4 1070 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)Cl 22a_100000189765_100000210390 [0,0,1,0,0,1|2,0,0]=4 1071 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)F 22a_100000189765_100000210950 [0,0,1,0,0,1|2,0,0]=4 1072 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)F 22a_100000189798_100000070787 [0,0,1,0,0,1|2,0,0]=4 1073 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)I 22a_100000186306_100000070787 [0,0,1,0,0,1|2,0,0]=4 1074 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)I 22a_100000189765_100000184098 [0,0,1,0,0,1|2,0,0]=4 1075 B14R1.149 CC(=O)NNC(=O)c1cccc(c1)O 22a_100000189765_100000183914 [0,0,1,0,0,1|1,0,0]=3 1076 B14R1.149 CC(C)CNC(=O)c1cccc(c1)O 240690a_100000210953_100000183914 [0,0,1,0,0,1|1,0,1]=4 1077 B14R1.149 CC(C)CNC(=O)c1cccc(c1)O 527a_100000210953_100000183914 [0,0,1,0,0,1|1,0,1]=4 1078 B14R1.149 CC(C)NCC(=O)c1cccc(c1)O 34a_100138425928_100009813753 [0,0,1,0,0,1|1,0,1]=4 1079 B14R1.149 CC(C)NNC(=O)c1cccc(c1)O 22a_100000741168_100000183914 [0,0,1,0,0,1|1,0,1]=4 1080 B14R1.149 CC(O)CNC(=O)c1cccc(c1)O 240690a_100000210904_100000183914 [0,0,1,0,0,1|1,0,1]=4 1081 B14R1.149 CC(O)CNC(=O)c1cccc(c1)O 527a_100000210904_100000183914 [0,0,1,0,0,1|1,0,1]=4 1082 B14R1.149 Cc1cccc(c1)C(=O)NCC(=O)[13CH3] 1458a_100000182573_200025704644 [0,0,1,0,0,1|2,0,0]=4 1083 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)O 240690a_100000711301_100000183914 [0,0,1,0,0,1|1,0,1]=4 1084 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)O 527a_100000711301_100000183914 [0,0,1,0,0,1|1,0,1]=4 1085 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)Br 1458a_100000179737_200025704644 [0,0,1,0,0,1|2,0,0]=4 1086 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)Cl 1458a_100000182572_200025704644 [0,0,1,0,0,1|2,0,0]=4 1087 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)F 1458a_100000183068_200025704644 [0,0,1,0,0,1|2,0,0]=4 1088 B14R1.5978 C=C(C)CC(=O)Cc1cccc(c1)O 1458a_100000745134_100000748629 [0,0,1,0,0,1|2,0,0]=4 1089 B14R1.5978 CC(=CC(=O)Cc1cccc(c1)O)C 1458a_100000211388_100011660834 [0,0,1,0,0,1|2,0,0]=4 1090 B14R1.5978 CC(=CC(=O)Cc1cccc(c1)O)Cl 1458a_200042562850_100011660834 [0,0,1,0,0,1|2,0,0]=4 1091 B14R1.5978 CC(=CC(=O)Cc1cccc(c1)O)I 1458a_100025716642_100011660834 [0,0,1,0,0,1|2,0,0]=4 1092 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)C 1626a_100000210217_100000211388 [0,0,1,0,0,1|2,0,0]=4 1093 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)C 22a_100000210217_100000211388 [0,0,1,0,0,1|2,0,0]=4 1094 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)Cl 1626a_100000210217_200042562850 [0,0,1,0,0,1|2,0,0]=4 1095 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)Cl 22a_100000210217_200042562850 [0,0,1,0,0,1|2,0,0]=4 1096 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)I 1626a_100000210217_100025716642 [0,0,1,0,0,1|2,0,0]=4 1097 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)O 1458a_100000070787_100011236192 [0,0,1,0,0,1|2,0,0]=4 1098 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000187718 [0,0,1,0,0,1|2,0,0]=4 1099 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)O 240690a_100138425928_100000745134 [0,0,1,0,0,1|1,0,1]=4 1100 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)O 527a_100138425928_100000745134 [0,0,1,0,0,1|1,0,1]=4 1101 B14R1.5978 CC(C)NC(=O)Nc1cccc(c1)O 2430a_100000210217_100138425928 [0,0,1,0,0,1|1,0,1]=4 1102 B14R1.5978 CC(C)NC(=O)Nc1cccc(c1)O 512a_100000210217_100138425928 [0,0,1,0,0,1|1,0,1]=4 1103 B14R1.2172 C=C(C)CSc1c(cccc1C=O)O 62a_100000748629_100009816417 [0,0,1,0,0,1|2,0,0]=4 1104 B14R1.2172 C=C(C)CSc1c(cccc1C=O)O 62a_100009816417_100000211660 [0,0,1,0,0,1|2,0,0]=4 1105 B14R1.2172 NC(=O)CSc1c(cccc1C=O)O 62a_100000747473_100009816417 [0,0,1,0,0,1|2,0,0]=4 1106 B14R1.2172 NC(=O)CSc1c(cccc1C=O)O 62a_100009816417_100000747473 [0,0,1,0,0,1|2,0,0]=4 1107 B14R1.5090 CC=Cc1c(cccc1CC(=O)N)C 271570a_100016259895_100011096275 [0,0,1,0,0,1|2,0,0]=4