0 B23R3.184688319 Cc1cc(C)cc2OC(=CC(=O)c12)c3cc(N)c(Cl)cc3 Amb18034291 [0,0,0,0,0,0|4,0,0]=4 1 B23R3.184688319 Cc1ccc(cc1N)C2=CC(=O)c3c(cc(C)cc3C)O2 Amb18034283 [0,0,0,0,0,0|4,0,0]=4 2 B23R3.184688319 OC1=CC2OC(=CC(=O)C2C(=C1)O)c3ccc(c(c3)O)O Amb16182623 [0,0,0,0,0,0|0,0,2]=2 3 B23R3.184688319 Oc1cc2O[C@@H](CC(=O)c2c(c1)O)c3ccc(c(c3)O)O Amb16192979 [0,0,0,0,0,0|0,0,2]=2 4 B23R3.184688319 Oc1cc2O[C@H](CC(=O)c2c(c1)O)c3ccc(c(c3)O)O Amb10072177 [0,0,0,0,0,0|0,0,2]=2 5 B23R3.184688319 Oc1ccc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511398 [0,0,0,0,0,0|0,0,0]=0 6 B23R3.184688319 Oc1ccc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb21929356 [0,0,0,0,0,0|0,0,0]=0 7 B22R3.10328943 Oc1ccc(cc1O)C2=CC(=O)c3c(cccc3O)O2 Amb20665308 [1,0,0,0,0,0|0,0,0]=1 8 B22R3.11067224 Cc1cc2OC(=CC(=O)c2cc1)c3cc(N)c(F)cc3 Amb18034382 [1,0,0,0,0,0|3,0,0]=4 9 B22R3.11067224 Cc1ccc(cc1N)C2=CC(=O)c3ccc(Cl)cc3O2 Amb18537238 [1,0,0,0,0,0|3,0,0]=4 10 B22R3.11067224 Oc1cc(ccc1O)C2=CC(=O)c3ccc(O)cc3O2 Amb18511643 [1,0,0,0,0,0|0,0,0]=1 11 B22R3.98287844 Cc1cc(C)cc2OC(=CC(=O)c12)c3ccc(N)cc3 Amb18034355 [1,0,0,0,0,0|3,0,0]=4 12 B22R3.98287844 Cc1cc(O)c2C(=O)CC(Oc2c1)c3ccc(O)cc3 Amb17722050 [1,0,0,0,0,0|1,0,2]=4 13 B22R3.98287844 Oc1cc(O)cc2CC(OC(=O)c12)c3ccc(O)cc3 Amb22172756 [1,0,0,0,0,0|2,0,1]=4 14 B22R3.98287844 Oc1cc(O)cc2OC(=CC(=O)c12)c3ccc(Cl)cc3 Amb20241798 [1,0,0,0,0,0|1,0,0]=2 15 B22R3.98287844 Oc1cc(O)cc2OC(=CC(=O)c12)c3ccc(O)cc3 Amb18511397 [1,0,0,0,0,0|0,0,0]=1 16 B22R3.98287844 Oc1cc(O)cc2OC(=CC(O)c12)c3ccc(O)cc3 Amb22584583 [1,0,0,0,0,0|0,0,2]=3 17 B22R3.98287844 Oc1ccc(cc1)C2CC(=O)c3c(O2)cc(cc3O)O Amb17618270 [1,0,0,0,0,0|0,0,2]=3 18 B24R3.311572219 Oc1cc(O)c2c(c1)oc(c(c2=O)O)c3ccc(c(c3)O)O Amb1027849 [0,1,0,0,0,0|0,0,0]=1 19 B24R3.311572219 Oc1cc(O)c2c(c1)oc(c(c2=O)O)c3ccc(c(c3)O)O Amb1279804 [0,1,0,0,0,0|0,0,0]=1 20 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb18371663 [0,1,0,0,0,0|0,0,0]=1 21 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb18511406 [0,1,0,0,0,0|0,0,0]=1 22 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb19668884 [0,1,0,0,0,0|0,0,0]=1 23 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb21928528 [0,1,0,0,0,0|0,0,0]=1 24 B24R3.311572219 Oc1cc2OC(c3ccc(c(c3)O)O)C(C(=O)c2c(c1)O)O Amb1056090 [0,1,0,0,0,0|0,0,2]=3 25 B24R3.311572219 Oc1cc2OC(c3ccc(c(c3)O)O)[C@H](C(=O)c2c(c1)O)O Amb16200032 [0,1,0,0,0,0|0,0,2]=3 26 B24R3.337791963 COc1cc(O)c2c(c1)OC(=CC2=O)c3ccc(O)c(O)c3 Amb19959169 [0,1,0,0,0,0|0,0,0]=1 27 B24R3.557722971 Oc1c(O)cc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511697 [0,1,0,0,0,0|0,0,0]=1 28 B24R3.558304036 Oc1ccc(C2=CC(=O)c3c(cc(O)cc3O)O2)c(O)c1O Amb19928577 [0,1,0,0,0,0|0,0,0]=1 29 B24R3.1245441990 COc1ccc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511414 [0,1,0,0,0,0|0,0,0]=1 30 B24R3.1289013967 COc1cc(ccc1O)C2=CC(=O)c3c(cc(C)cc3C)O2 Amb17992006 [0,1,0,0,0,0|2,0,0]=3 31 B24R3.1289013967 COc1cc(ccc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511613 [0,1,0,0,0,0|0,0,0]=1 32 B24R3.1289013967 COc1cc(ccc1O)[C@@H]2CC(=O)c3c(cc(O)cc3O)O2 Amb18511668 [0,1,0,0,0,0|0,0,2]=3 33 B21R3.654077 Nc1cc(ccc1Cl)C2=CC(=O)c3ccccc3O2 Amb18537242 [2,0,0,0,0,0|2,0,0]=4 34 B21R3.654077 Nc1cc(ccc1F)C2=CC(=O)c3ccccc3O2 Amb18537245 [2,0,0,0,0,0|2,0,0]=4 35 B21R3.654077 Nc1ccc(cc1N)C2=CC(=O)c3ccccc3O2 Amb24079208 [2,0,0,0,0,0|2,0,0]=4 36 B21R3.654077 O=C1C=C(Oc2ccccc21)c3cc(Cl)c(Cl)cc3 Amb19665407 [2,0,0,0,0,0|2,0,0]=4 37 B21R3.654077 Oc1cc(ccc1O)C2CC(=O)c3ccccc3O2 Amb24086003 [2,0,0,0,0,0|0,0,2]=4 38 B21R3.654077 Oc1cc(ccc1O)C=2NC(=O)c3ccccc3N2 Amb19351762 [2,0,0,0,0,0|2,0,0]=4 39 B21R3.654077 Oc1ccc(cc1F)-c2cc(=O)c3ccc[n]c3o2 Amb24089806 [2,0,0,0,0,0|2,0,0]=4 40 B21R3.654077 Oc1ccc(cc1O)C2=CC(=O)c3ccccc3O2 Amb18511642 [2,0,0,0,0,0|0,0,0]=2 41 B21R3.23131681 Nc1cccc2OC(=CC(=O)c12)c3cc(N)ccc3 Amb24079259 [2,0,0,0,0,0|2,0,0]=4 42 B21R3.23131681 Nc1cccc2OC(=CC(=O)c21)c3cc(O)ccc3 Amb24079260 [2,0,0,0,0,0|1,0,0]=3 43 B21R3.23131681 Oc1cccc2OC(=CC(=O)c12)c3cc(O)ccc3 Amb21928433 [2,0,0,0,0,0|0,0,0]=2 44 B21R3.50471385 Cc1cccc2OC(=CC(=O)c21)c3ccc(Cl)cc3 Amb19667929 [2,0,0,0,0,0|2,0,0]=4 45 B21R3.50471385 Nc1cccc2OC(=CC(=O)c12)c3ccc(N)cc3 Amb24079263 [2,0,0,0,0,0|2,0,0]=4 46 B21R3.50471385 Nc1cccc2OC(=CC(=O)c21)c3ccc(O)cc3 Amb24079264 [2,0,0,0,0,0|1,0,0]=3 47 B21R3.50471385 Oc1cccc2OC(=CC(=O)c12)c3ccc(O)cc3 Amb20665355 [2,0,0,0,0,0|0,0,0]=2 48 B21R3.649532 Cc1cc2OC(=CC(=O)c2cc1)c3ccc(Cl)cc3 Amb19520565 [2,0,0,0,0,0|2,0,0]=4 49 B21R3.649532 Cc1cc2OC(=CC(=O)c2cc1)c3ccc(F)cc3 Amb19520508 [2,0,0,0,0,0|2,0,0]=4 50 B21R3.649532 Cc1ccc(cc1)C2=CC(=O)c3ccc(C)cc3O2 Amb19520552 [2,0,0,0,0,0|2,0,0]=4 51 B21R3.649532 Clc1ccc(cc1)c2cc(=O)c3c(o2)cc(cc3)C Amb1265883 [2,0,0,0,0,0|2,0,0]=4 52 B21R3.649532 Clc1ccc(cc1)c2cc(=O)c3c(o2)cc(cc3)O Amb2570001 [2,0,0,0,0,0|1,0,0]=3 53 B21R3.649532 Nc1ccc(cc1)C2=CC(=O)c3ccc(Cl)cc3O2 Amb18537227 [2,0,0,0,0,0|2,0,0]=4 54 B21R3.649532 Nc1ccc(cc1)C2=CC(=O)c3ccc(N)cc3O2 Amb24079276 [2,0,0,0,0,0|2,0,0]=4 55 B21R3.649532 Nc1ccc(cc1)C2=CC(=O)c3ccc(O)cc3O2 Amb24079221 [2,0,0,0,0,0|1,0,0]=3 56 B21R3.649532 Oc1cc2OC(=CC(=O)c2cc1)c3ccc(Cl)cc3 Amb19952368 [2,0,0,0,0,0|1,0,0]=3 57 B21R3.649532 Oc1ccc(cc1)C2=CC(=O)c3ccc(O)cc3O2 Amb18511661 [2,0,0,0,0,0|0,0,0]=2 58 B21R3.3823543 Cc1cc2OC(=CC(=O)c2cc1)c3cc(Br)ccc3 Amb19524698 [2,0,0,0,0,0|2,0,0]=4 59 B21R3.3823543 Cc1cc2OC(=CC(=O)c2cc1)c3cc(F)ccc3 Amb20032033 [2,0,0,0,0,0|2,0,0]=4 60 B21R3.3823543 Oc1cc2OC(=CC(=O)c2cc1)c3cc(F)ccc3 Amb22552100 [2,0,0,0,0,0|1,0,0]=3 61 B21R3.3823543 Oc1cc2OC(=CC(=O)c2cc1)c3cc(O)ccc3 Amb21928436 [2,0,0,0,0,0|0,0,0]=2 62 B21R3.3760005 Oc1cc(O)cc2[o+]c(ccc12)-c3ccc(O)cc3 Amb22729299 [2,0,0,0,0,0|0,0,1]=3 63 B21R3.41307345 Cc1cc(O)cc2OC(=CC(=O)c21)c3ccccc3 Amb18511629 [2,0,0,0,0,0|1,0,0]=3 64 B21R3.41307345 Nc1cc(O)c2C(=O)C=C(Oc2c1)c3ccccc3 Amb24079278 [2,0,0,0,0,0|1,0,0]=3 65 B21R3.41307345 O=C1C=C(Oc2cc(Cl)cc(Cl)c21)c3ccccc3 Amb19667390 [2,0,0,0,0,0|2,0,0]=4 66 B21R3.41307345 Oc1cc(O)cc2OC(=CC(=O)c12)c3ccccc3 Amb18511580 [2,0,0,0,0,0|0,0,0]=2 67 B23R2.22678440 COc1ccc(cc1O)CCC(=O)c2c(O)cc(cc2O)O Amb16192911 [0,1,1,0,0,0|0,0,2]=4 68 B23R3.4391794 Cc1cc2OC(=CC(=O)c2cc1)c3cc(OC)c(O)cc3 Amb17992010 [1,1,0,0,0,0|1,0,0]=3 69 B23R3.17086460 O[C@@H]1[C@@H](Oc2cc(O)ccc2C1=O)c3cc(O)c(O)cc3 Amb22800141 [1,1,0,0,0,0|0,0,2]=4 70 B23R3.17086460 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2cc1 Amb18511407 [1,1,0,0,0,0|0,0,0]=2 71 B23R3.17086460 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2cc1 Amb20663584 [1,1,0,0,0,0|0,0,0]=2 72 B23R3.24435957 Oc1ccc(cc1O)C2=CC(=O)c3ccc(O)c(O)c3O2 Amb18511678 [1,1,0,0,0,0|0,0,0]=2 73 B23R3.29314985 Cc1ccc(cc1N)C2=CC(=O)c3ccc(cc3O2)OC Amb18034369 [1,1,0,0,0,0|2,0,0]=4 74 B23R3.39735021 COc1ccc(cc1N)C2=CC(=O)c3ccc(Cl)cc3O2 Amb18034302 [1,1,0,0,0,0|2,0,0]=4 75 B23R3.39735021 Cc1cc2OC(=CC(=O)c2cc1)c3cc(N)c(cc3)OC Amb18537255 [1,1,0,0,0,0|2,0,0]=4 76 B23R3.137614192 Oc1c(O)cc(cc1O)C2=CC(=O)c3ccc(O)cc3O2 Amb21928533 [1,1,0,0,0,0|0,0,0]=2 77 B23R3.184684647 Oc1ccc(cc1O)C2=CC(=O)c3cc(O)c(O)cc3O2 Amb21928532 [1,1,0,0,0,0|0,0,0]=2 78 B23R3.17998529 Oc1cc2[o+]c(ccc2c(O)c1)-c3cc(O)c(O)c(O)c3 Amb18511557 [1,1,0,0,0,0|0,0,1]=3 79 B23R3.71361071 Oc1cc(O)cc2O[C@@H](CC(=O)c12)c3cc(O)cc(O)c3 Amb22748379 [1,1,0,0,0,0|0,0,2]=4 80 B23R3.9068341 COc1ccc(cc1)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511409 [1,1,0,0,0,0|0,0,0]=2 81 B23R3.29715607 COc1cc(O)cc2OC(=CC(=O)c12)c3ccc(O)cc3 Amb22172907 [1,1,0,0,0,0|0,0,0]=2 82 B23R3.29715607 COc1cc(O)cc2O[C@@H](CC(=O)c12)c3ccc(O)cc3 Amb22748585 [1,1,0,0,0,0|0,0,2]=4 83 B23R3.71745916 CC=1C(=O)c2c(cc(O)cc2O)OC1c3ccc(F)cc3 Amb24070308 [1,1,0,0,0,0|1,0,0]=3 84 B23R3.71745916 Oc1cc(O)cc2OC(c3ccc(O)cc3)=C(O)C(=O)c12 Amb18511400 [1,1,0,0,0,0|0,0,0]=2 85 B23R3.71745916 Oc1cc(O)cc2OC(c3ccc(O)cc3)=C(O)C(O)c12 Amb22731800 [1,1,0,0,0,0|0,0,2]=4 86 B23R3.71745916 Oc1ccc(cc1)[C@H]2Oc3cc(O)cc(c3C(=O)[C@@H]2O)O Amb16192992 [1,1,0,0,0,0|0,0,2]=4 87 B23R3.71772102 Oc1c(O)c2C(=O)C=C(Oc2cc1O)c3ccc(O)cc3 Amb18511696 [1,1,0,0,0,0|0,0,0]=2 88 B23R3.71772102 Oc1ccc(cc1)C2CC(=O)c3c(O2)cc(c(c3O)O)O Amb16182734 [1,1,0,0,0,0|0,0,2]=4 89 B23R3.199765921 COc1cc(O)c2c(c1)OC(=CC2=O)c3ccc(O)cc3 Amb18511628 [1,1,0,0,0,0|0,0,0]=2 90 B23R3.422001140 Oc1cc(O)cc2OC(O)(CC(=O)c12)c3ccc(O)cc3 Amb22172861 [1,1,0,0,0,0|0,0,2]=4 91 B23R3.438268709 Oc1cc(O)c(cc1)[C@@H]2CC(=O)c3c(cc(O)cc3O)O2 Amb24107099 [1,1,0,0,0,0|0,0,2]=4 92 B25R3.351843520 COc1cc(O)cc2OC(=C(O)C(=O)c12)c3ccc(O)c(O)c3 Amb22054320 [0,2,0,0,0,0|0,0,0]=2 93 B25R3.351843520 COc1cc(O)cc2OC(C3CC=C(O)C(O)=C3)=C(O)C(=O)c12 Amb22002037 [0,2,0,0,0,0|0,0,2]=4 94 B25R3.11816672 COC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)c(O)c3 Amb18511702 [0,2,0,0,0,0|0,0,0]=2 95 B25R3.11816672 COC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)c(O)c3 Amb20665135 [0,2,0,0,0,0|0,0,0]=2 96 B25R3.42836562 Cc1c(O)c2C(=O)C(O)=C(Oc2cc1O)c3cc(O)c(O)cc3 Amb19928571 [0,2,0,0,0,0|0,0,0]=2 97 B25R3.42836562 Oc1c2C(=O)C(O)=C(Oc2cc(O)c1O)c3cc(O)c(O)cc3 Amb18511593 [0,2,0,0,0,0|0,0,0]=2 98 B25R3.157573357 Oc1cc2OC(c3cc(O)c(O)c(O)c3)=C(O)C(=O)c2c(O)c1 Amb18511401 [0,2,0,0,0,0|0,0,0]=2 99 B25R3.157573357 Oc1cc2OC(c3cc(O)c(c(c3)O)O)C(C(=O)c2c(c1)O)O Amb10549908 [0,2,0,0,0,0|0,0,2]=4 100 B25R3.296046236 Cc1c2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)cc1O Amb20591891 [0,2,0,0,0,0|0,0,0]=2 101 B25R3.296046236 Oc1cc(O)c2C(=O)C(O)=C(Oc2c1O)c3cc(O)c(O)cc3 Amb18511635 [0,2,0,0,0,0|0,0,0]=2 102 B25R3.696862022 Oc1cc2OC(c3ccc(O)c(O)c3O)=C(O)C(=O)c2c(O)c1 Amb19133361 [0,2,0,0,0,0|0,0,0]=2 103 B25R3.970028913 COc1cc(O)c2c(c1)OC(=C(O)C2=O)c3ccc(O)c(O)c3 Amb18511623 [0,2,0,0,0,0|0,0,0]=2 104 B25R3.1196228775 COc1ccc(cc1O)C=2Oc3cc(O)cc(O)c3C(=O)C2O Amb18511624 [0,2,0,0,0,0|0,0,0]=2 105 B25R3.1229852970 COc1cc(ccc1O)C=2Oc3cc(O)cc(O)c3C(=O)C2O Amb18511405 [0,2,0,0,0,0|0,0,0]=2 106 B25R3.1229852970 COc1cc(ccc1O)c2oc3cc(O)cc(c3c(=O)c2C)O Amb10842391 [0,2,0,0,0,0|0,0,0]=2 107 B25R3.10796687 COc1c(O)c2c(cc1O)OC(=CC2=O)c3ccc(O)c(O)c3 Amb18511608 [0,2,0,0,0,0|0,0,0]=2 108 B25R3.113334912 COc1cc2OC(=CC(=O)c2c(O)c1O)c3ccc(O)c(O)c3 Amb22172884 [0,2,0,0,0,0|0,0,0]=2 109 B25R3.890477379 Oc1ccc(cc1O)C2=CC(=O)c3c(cc(O)c(O)c3O)C2=O Amb22733131 [0,2,0,0,0,0|1,0,0]=3 110 B25R3.1229894726 COc1cc(ccc1O)C2=CC(=O)c3c(cc(C)c(Cl)c3C)O2 Amb17992965 [0,2,0,0,0,0|2,0,0]=4 111 B25R3.970044825 COc1cc(ccc1O)C2=CC(=O)c3c(cc(cc3O)OC)O2 Amb22172716 [0,2,0,0,0,0|0,0,0]=2 112 B25R3.1196288656 COc1ccc(cc1O)C2=CC(=O)c3c(cc(cc3O)OC)O2 Amb22741213 [0,2,0,0,0,0|0,0,0]=2 113 B25R3.1196100423 Cc1cc(O)cc2oc(cc(=O)c12)-c3cc(OC)c(cc3)OC Amb24089732 [0,2,0,0,0,0|1,0,0]=3 114 B25R3.1196100423 Cc1cc2oc(cc(=O)c2c(O)c1)-c3cc(OC)c(cc3)OC Amb24089736 [0,2,0,0,0,0|1,0,0]=3 115 B23R3.24513547 Oc1ccc(\C=C\2/Oc3cc(O)cc(O)c3C2=O)cc1O Amb19130587 [0,0,1,1,0,0|0,0,0]=2 116 B23R3.71761172 Oc1ccc(cc1)OC2=CC(=O)c3c(cc(O)cc3O)O2 Amb22172819 [1,0,0,0,0,1|0,0,0]=2 117 B23R3.24536673 Oc1cc2OCC(C(=O)c2c(O)c1)c3cc(O)c(O)cc3 Amb22173675 [0,0,0,0,1,1|0,0,1]=3 118 B23R3.24536673 Oc1ccc(cc1O)C2=COc3cc(O)cc(O)c3C2=O Amb22172748 [0,0,0,0,1,1|0,0,0]=2 119 B23R3.184434497 Cc1cc(C)cc2C(=O)C=C(Oc12)c3cc(O)c(O)cc3 Amb17992005 [0,0,0,0,1,1|2,0,0]=4