0 B22R3.98287844 Cc1cc(C)cc2OC(=CC(=O)c12)c3ccc(N)cc3 Amb18034355 [0,0,0,0,0,0|3,0,0]=3 1 B22R3.98287844 Cc1cc(O)c2C(=O)CC(Oc2c1)c3ccc(O)cc3 Amb17722050 [0,0,0,0,0,0|1,0,2]=3 2 B22R3.98287844 Oc1cc(O)cc2CC(OC(=O)c12)c3ccc(O)cc3 Amb22172756 [0,0,0,0,0,0|2,0,1]=3 3 B22R3.98287844 Oc1cc(O)cc2OC(=CC(=O)c12)c3ccc(Cl)cc3 Amb20241798 [0,0,0,0,0,0|1,0,0]=1 4 B22R3.98287844 Oc1cc(O)cc2OC(=CC(=O)c12)c3ccc(O)cc3 Amb18511397 [0,0,0,0,0,0|0,0,0]=0 5 B22R3.98287844 Oc1cc(O)cc2OC(=CC(O)c12)c3ccc(O)cc3 Amb22584583 [0,0,0,0,0,0|0,0,2]=2 6 B22R3.98287844 Oc1ccc(cc1)C2CC(=O)c3c(O2)cc(cc3O)O Amb17618270 [0,0,0,0,0,0|0,0,2]=2 7 B21R3.649532 Cc1cc2OC(=CC(=O)c2cc1)c3ccc(Cl)cc3 Amb19520565 [1,0,0,0,0,0|2,0,0]=3 8 B21R3.649532 Cc1cc2OC(=CC(=O)c2cc1)c3ccc(F)cc3 Amb19520508 [1,0,0,0,0,0|2,0,0]=3 9 B21R3.649532 Cc1ccc(cc1)C2=CC(=O)c3ccc(C)cc3O2 Amb19520552 [1,0,0,0,0,0|2,0,0]=3 10 B21R3.649532 Clc1ccc(cc1)c2cc(=O)c3c(o2)cc(cc3)C Amb1265883 [1,0,0,0,0,0|2,0,0]=3 11 B21R3.649532 Clc1ccc(cc1)c2cc(=O)c3c(o2)cc(cc3)O Amb2570001 [1,0,0,0,0,0|1,0,0]=2 12 B21R3.649532 Nc1ccc(cc1)C2=CC(=O)c3ccc(Cl)cc3O2 Amb18537227 [1,0,0,0,0,0|2,0,0]=3 13 B21R3.649532 Nc1ccc(cc1)C2=CC(=O)c3ccc(N)cc3O2 Amb24079276 [1,0,0,0,0,0|2,0,0]=3 14 B21R3.649532 Nc1ccc(cc1)C2=CC(=O)c3ccc(O)cc3O2 Amb24079221 [1,0,0,0,0,0|1,0,0]=2 15 B21R3.649532 Oc1cc2OC(=CC(=O)c2cc1)c3ccc(Cl)cc3 Amb19952368 [1,0,0,0,0,0|1,0,0]=2 16 B21R3.649532 Oc1ccc(cc1)C2=CC(=O)c3ccc(O)cc3O2 Amb18511661 [1,0,0,0,0,0|0,0,0]=1 17 B21R3.3760005 Oc1cc(O)cc2[o+]c(ccc12)-c3ccc(O)cc3 Amb22729299 [1,0,0,0,0,0|0,0,1]=2 18 B21R3.41307345 Cc1cc(O)cc2OC(=CC(=O)c21)c3ccccc3 Amb18511629 [1,0,0,0,0,0|1,0,0]=2 19 B21R3.41307345 Nc1cc(O)c2C(=O)C=C(Oc2c1)c3ccccc3 Amb24079278 [1,0,0,0,0,0|1,0,0]=2 20 B21R3.41307345 O=C1C=C(Oc2cc(Cl)cc(Cl)c21)c3ccccc3 Amb19667390 [1,0,0,0,0,0|2,0,0]=3 21 B21R3.41307345 OC1=CC=2OC(=NC(=O)C2C(=O)O1)c3ccccc3 Amb20662209 [1,0,0,0,0,0|2,0,1]=4 22 B21R3.41307345 Oc1cc(O)cc2OC(=CC(=O)c12)c3ccccc3 Amb18511580 [1,0,0,0,0,0|0,0,0]=1 23 B21R3.50471385 Cc1cccc2OC(=CC(=O)c21)c3ccc(Cl)cc3 Amb19667929 [1,0,0,0,0,0|2,0,0]=3 24 B21R3.50471385 Nc1cccc2OC(=CC(=O)c12)c3ccc(N)cc3 Amb24079263 [1,0,0,0,0,0|2,0,0]=3 25 B21R3.50471385 Nc1cccc2OC(=CC(=O)c21)c3ccc(O)cc3 Amb24079264 [1,0,0,0,0,0|1,0,0]=2 26 B21R3.50471385 Oc1ccc(cc1)[C@@H]2Cc3cccc(O)c3C(=O)O2 Amb24325821 [1,0,0,0,0,0|2,0,1]=4 27 B21R3.50471385 Oc1cccc2C=C(OC(=O)c21)c3ccc(Cl)cc3 Amb22439138 [1,0,0,0,0,0|3,0,0]=4 28 B21R3.50471385 Oc1cccc2OC(=CC(=O)c12)c3ccc(O)cc3 Amb20665355 [1,0,0,0,0,0|0,0,0]=1 29 B23R3.9068341 COc1ccc(cc1)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511409 [0,1,0,0,0,0|0,0,0]=1 30 B23R3.9068341 COc1ccc(cc1)C2=NC(=O)C3=C(C=C(O)OC3=O)O2 Amb22478611 [0,1,0,0,0,0|2,0,1]=4 31 B23R3.29715607 COc1cc(O)cc2OC(=CC(=O)c12)c3ccc(O)cc3 Amb22172907 [0,1,0,0,0,0|0,0,0]=1 32 B23R3.29715607 COc1cc(O)cc2O[C@@H](CC(=O)c12)c3ccc(O)cc3 Amb22748585 [0,1,0,0,0,0|0,0,2]=3 33 B23R3.71745916 CC=1C(=O)c2c(cc(O)cc2O)OC1c3ccc(F)cc3 Amb24070308 [0,1,0,0,0,0|1,0,0]=2 34 B23R3.71745916 Oc1cc(O)cc2OC(c3ccc(O)cc3)=C(O)C(=O)c12 Amb18511400 [0,1,0,0,0,0|0,0,0]=1 35 B23R3.71745916 Oc1cc(O)cc2OC(c3ccc(O)cc3)=C(O)C(O)c12 Amb22731800 [0,1,0,0,0,0|0,0,2]=3 36 B23R3.71745916 Oc1ccc(cc1)[C@H]2Oc3cc(O)cc(c3C(=O)[C@@H]2O)O Amb16192992 [0,1,0,0,0,0|0,0,2]=3 37 B23R3.71772102 Oc1c(O)c2C(=O)C=C(Oc2cc1O)c3ccc(O)cc3 Amb18511696 [0,1,0,0,0,0|0,0,0]=1 38 B23R3.71772102 Oc1ccc(cc1)C2CC(=O)c3c(O2)cc(c(c3O)O)O Amb16182734 [0,1,0,0,0,0|0,0,2]=3 39 B23R3.184688319 Cc1cc(C)cc2OC(=CC(=O)c12)c3cc(N)c(Cl)cc3 Amb18034291 [0,1,0,0,0,0|3,0,0]=4 40 B23R3.184688319 Cc1ccc(cc1N)C2=CC(=O)c3c(cc(C)cc3C)O2 Amb18034283 [0,1,0,0,0,0|3,0,0]=4 41 B23R3.184688319 OC1=CC2OC(=CC(=O)C2C(=C1)O)c3ccc(c(c3)O)O Amb16182623 [0,1,0,0,0,0|0,0,2]=3 42 B23R3.184688319 Oc1cc2O[C@@H](CC(=O)c2c(c1)O)c3ccc(c(c3)O)O Amb16192979 [0,1,0,0,0,0|0,0,2]=3 43 B23R3.184688319 Oc1cc2O[C@H](CC(=O)c2c(c1)O)c3ccc(c(c3)O)O Amb10072177 [0,1,0,0,0,0|0,0,2]=3 44 B23R3.184688319 Oc1ccc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511398 [0,1,0,0,0,0|0,0,0]=1 45 B23R3.184688319 Oc1ccc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb21929356 [0,1,0,0,0,0|0,0,0]=1 46 B23R3.199765921 COc1cc(O)c2c(c1)OC(=CC2=O)c3ccc(O)cc3 Amb18511628 [0,1,0,0,0,0|0,0,0]=1 47 B23R3.422001140 Oc1cc(O)cc2OC(O)(CC(=O)c12)c3ccc(O)cc3 Amb22172861 [0,1,0,0,0,0|0,0,2]=3 48 B23R3.438268709 Oc1cc(O)c(cc1)[C@@H]2CC(=O)c3c(cc(O)cc3O)O2 Amb24107099 [0,1,0,0,0,0|0,0,2]=3 49 B21R2.362231 CC1=CC(O)=C(C(=O)O1)C(=O)\C=C\c2ccc(O)cc2 Amb18548656 [0,0,1,0,0,0|2,0,1]=4 50 B21R2.362231 Oc1cc(O)c(c(c1)O)C(=O)COc2ccc(cc2)F Amb1418992 [0,0,1,0,0,0|2,0,1]=4 51 B23R3.71761172 Oc1ccc(cc1)OC2=CC(=O)c3c(cc(O)cc3O)O2 Amb22172819 [0,0,0,0,0,1|0,0,0]=1 52 B20R2.294 Cc1ccc(cc1)\C(=C\C(=O)c2ccc(cc2)C)\O Amb10572788 [1,0,1,0,0,0|2,0,0]=4 53 B20R2.294 O=C(c1ccc(cc1)O)CC(=O)c2ccc(cc2)O Amb10563775 [1,0,1,0,0,0|0,0,2]=4 54 B20R2.23087 Oc1cc(O)c(C(=O)\C=C\c2ccccc2)c(O)c1 Amb22741237 [1,0,1,0,0,0|0,0,0]=2 55 B20R3.19283 Cc1ccc(cc1)C2=CC(=O)c3ccccc3N2 Amb20247406 [2,0,0,0,0,0|2,0,0]=4 56 B20R3.19283 Cc1ccc(cc1)C2=CC(=O)c3ccccc3O2 Amb18473698 [2,0,0,0,0,0|1,0,0]=3 57 B20R3.19283 Cc1ccc(cc1)C2=NC(=O)c3ccccc3O2 Amb19666253 [2,0,0,0,0,0|2,0,0]=4 58 B20R3.19283 Fc1ccc(cc1)c2cc(=O)c3c(o2)cccc3 Amb1398032 [2,0,0,0,0,0|1,0,0]=3 59 B20R3.19283 O=C1C=C(Nc2ccccc21)c3ccc(Br)cc3 Amb20247407 [2,0,0,0,0,0|2,0,0]=4 60 B20R3.19283 O=C1C=C(Nc2ccccc21)c3ccc(Cl)cc3 Amb20247408 [2,0,0,0,0,0|2,0,0]=4 61 B20R3.19283 O=C1C=C(Nc2ccccc21)c3ccc(F)cc3 Amb20247409 [2,0,0,0,0,0|2,0,0]=4 62 B20R3.19283 O=C1C=C(Oc2ccccc21)c3ccc(Br)cc3 Amb18473700 [2,0,0,0,0,0|1,0,0]=3 63 B20R3.19283 O=C1C=C(Oc2ccccc21)c3ccc(Cl)cc3 Amb19667388 [2,0,0,0,0,0|1,0,0]=3 64 B20R3.19283 O=C1C=C(Oc2ccccc21)c3ccc(F)cc3 Amb18376690 [2,0,0,0,0,0|1,0,0]=3 65 B20R3.19283 O=C1N=C(Oc2ccccc21)c3ccc(Cl)cc3 Amb19519367 [2,0,0,0,0,0|2,0,0]=4 66 B20R3.19283 O=c1cc(oc2[n]cccc21)-c3ccc(F)cc3 Amb24090000 [2,0,0,0,0,0|2,0,0]=4 67 B20R3.19283 O=c1cc(oc2ccc[n]c21)-c3ccc(F)cc3 Amb24089985 [2,0,0,0,0,0|2,0,0]=4 68 B20R3.19283 Oc1c[n]c(cc1)-c2cc(=O)c3ccccc3o2 Amb24065038 [2,0,0,0,0,0|1,0,0]=3 69 B20R3.19283 Oc1ccc(cc1)-c2cc(=O)c3[n]cccc3o2 Amb24090012 [2,0,0,0,0,0|1,0,0]=3 70 B20R3.19283 Oc1ccc(cc1)-c2cc(=O)c3ccccc3[nH]2 Amb24089993 [2,0,0,0,0,0|1,0,0]=3 71 B20R3.19283 Oc1ccc(cc1)C2=CC(=O)c3ccc[n]c3O2 Amb20241449 [2,0,0,0,0,0|1,0,0]=3 72 B20R3.19283 Oc1ccc(cc1)C2=CC(=O)c3ccccc3O2 Amb18663175 [2,0,0,0,0,0|0,0,0]=2 73 B20R3.19283 Oc1ccc(cc1)C=2NC(=O)c3ccccc3N2 Amb18663205 [2,0,0,0,0,0|2,0,0]=4 74 B20R3.19283 Oc1ccc(cc1)C=2Nc3ccccc3C(=O)N2 Amb19665890 [2,0,0,0,0,0|2,0,0]=4 75 B20R3.87738 Oc1ccc(cc1)-c2ccc3ccc(=O)cc3o2 Amb24090011 [2,0,0,0,0,0|0,0,1]=3 76 B20R3.277426 Cc1cc2OC(=CC(=O)c2cc1)c3ccccc3 Amb24079262 [2,0,0,0,0,0|1,0,0]=3 77 B20R3.277426 Nc1cc2OC(=CC(=O)c2cc1)c3ccccc3 Amb22360616 [2,0,0,0,0,0|1,0,0]=3 78 B20R3.277426 O=C1C=C(Oc2cc(Cl)ccc21)c3ccccc3 Amb22645360 [2,0,0,0,0,0|1,0,0]=3 79 B20R3.277426 O=C1C=C(Oc2cc(I)ccc21)c3ccccc3 Amb24070335 [2,0,0,0,0,0|1,0,0]=3 80 B20R3.277426 O=c1cc(oc2cc(Br)ccc21)-c3ccccc3 Amb24092026 [2,0,0,0,0,0|1,0,0]=3 81 B20R3.277426 Oc1cc2N=C(OC(=O)c2cc1)c3ccccc3 Amb18663381 [2,0,0,0,0,0|2,0,0]=4 82 B20R3.277426 Oc1cc2OC(=CC(=O)c2cc1)c3ccccc3 Amb18511602 [2,0,0,0,0,0|0,0,0]=2 83 B20R3.277426 Oc1cc2O[C@@H](CC(=O)c2cc1)c3ccccc3 Amb24107257 [2,0,0,0,0,0|0,0,2]=4 84 B20R3.247868 Cc1cccc2OC(=CC(=O)c21)c3ccccc3 Amb24079265 [2,0,0,0,0,0|1,0,0]=3 85 B20R3.247868 Oc1cccc2OC(=CC(=O)c21)c3ccccc3 Amb18511587 [2,0,0,0,0,0|0,0,0]=2 86 B22R3.294781 COc1ccc(cc1)C2=CC(=O)c3ccc(N)cc3O2 Amb19831734 [1,1,0,0,0,0|1,0,0]=3 87 B22R3.294781 COc1ccc(cc1)C2=CC(=O)c3ccc(O)cc3O2 Amb18511622 [1,1,0,0,0,0|0,0,0]=2 88 B22R3.294781 COc1ccc(cc1)c2cc(=O)c3c(o2)cc(cc3)N Amb10789123 [1,1,0,0,0,0|1,0,0]=3 89 B22R3.294781 Cc1cc(oc2cc(=O)ccc12)-c3ccc(cc3)OC Amb24064945 [1,1,0,0,0,0|1,0,1]=4 90 B22R3.294781 Cc1cc2OC(=CC(=O)c2cc1)c3ccc(cc3)OC Amb19520515 [1,1,0,0,0,0|1,0,0]=3 91 B22R3.1011217 Nc1c(O)ccc2C(=O)C=C(Oc12)c3ccc(N)cc3 Amb24079279 [1,1,0,0,0,0|1,0,0]=3 92 B22R3.1011217 Oc1c2OC(=CC(=O)c2ccc1O)c3ccc(F)cc3 Amb22549275 [1,1,0,0,0,0|1,0,0]=3 93 B22R3.1011217 Oc1c2OC(=CC(=O)c2ccc1O)c3ccc(O)cc3 Amb20665324 [1,1,0,0,0,0|0,0,0]=2 94 B22R3.5321610 Cc1cc2OC(=C(O)C(=O)c2cc1)c3ccc(F)cc3 Amb20665446 [1,1,0,0,0,0|2,0,0]=4 95 B22R3.5321610 Cc1ccc(cc1)C=2Oc3cc(Cl)ccc3C(=O)C2O Amb19541418 [1,1,0,0,0,0|2,0,0]=4 96 B22R3.5321610 OC=1C(=O)c2ccc(Cl)cc2OC1c3ccc(F)cc3 Amb19541758 [1,1,0,0,0,0|2,0,0]=4 97 B22R3.5321610 OC=1C(=O)c2ccc(O)cc2OC1c3ccc(O)cc3 Amb18511659 [1,1,0,0,0,0|0,0,0]=2 98 B22R3.5321610 O[C@@H]1[C@H](Oc2cc(O)ccc2C1=O)c3ccc(O)cc3 Amb23604180 [1,1,0,0,0,0|0,0,2]=4 99 B22R3.11067224 Cc1cc2OC(=CC(=O)c2cc1)c3cc(N)c(F)cc3 Amb18034382 [1,1,0,0,0,0|2,0,0]=4 100 B22R3.11067224 Cc1ccc(cc1N)C2=CC(=O)c3ccc(Cl)cc3O2 Amb18537238 [1,1,0,0,0,0|2,0,0]=4 101 B22R3.11067224 Oc1cc(ccc1O)C2=CC(=O)c3ccc(O)cc3O2 Amb18511643 [1,1,0,0,0,0|0,0,0]=2 102 B22R3.15233977 Cc1cc2OC(=CC(=O)c2cc1Cl)c3ccc(Br)cc3 Amb20665775 [1,1,0,0,0,0|2,0,0]=4 103 B22R3.15233977 Cc1cc2OC(=CC(=O)c2cc1Cl)c3ccc(C)cc3 Amb20665781 [1,1,0,0,0,0|2,0,0]=4 104 B22R3.15233977 Cc1cc2OC(=CC(=O)c2cc1Cl)c3ccc(Cl)cc3 Amb21928402 [1,1,0,0,0,0|2,0,0]=4 105 B22R3.15233977 Cc1cc2OC(=CC(=O)c2cc1Cl)c3ccc(N)cc3 Amb18034293 [1,1,0,0,0,0|2,0,0]=4 106 B22R3.15233977 Nc1cc2C(=O)C=C(Oc2cc1O)c3ccc(N)cc3 Amb24079271 [1,1,0,0,0,0|1,0,0]=3 107 B22R3.18107773 COc1ccc2c(c1)OC(=CC2=O)c3ccc(O)cc3 Amb21928221 [1,1,0,0,0,0|0,0,0]=2 108 B22R3.18107773 Cc1ccc(cc1)C2=CC(=O)c3ccc(cc3O2)OC Amb19806252 [1,1,0,0,0,0|1,0,0]=3 109 B22R3.303788 COc1ccc(cc1)C2C=Cc3c(cc(O)cc3O)O2 Amb24064935 [1,1,0,0,0,0|0,0,1]=3 110 B22R3.41030782 Oc1ccc(cc1)c2[o+]c3cc(O)cc(c3cc2O)O Amb16192917 [1,1,0,0,0,0|0,0,1]=3 111 B22R3.2846088 Nc1c(O)c2C(=O)C=C(Oc2cc1O)c3ccccc3 Amb24079272 [1,1,0,0,0,0|0,0,0]=2 112 B22R3.2846088 Oc1c(C)cc2c(c1O)c(=O)cc(o2)c3ccccc3 Amb10842380 [1,1,0,0,0,0|1,0,0]=3 113 B22R3.2846088 Oc1c(O)c2C(=O)C=C(Oc2cc1O)c3ccccc3 Amb18511633 [1,1,0,0,0,0|0,0,0]=2 114 B22R3.2846088 Oc1c(O)c2C(=O)C=C(Oc2cc1O)c3ccccc3 Amb19130638 [1,1,0,0,0,0|0,0,0]=2 115 B22R3.2846088 Oc1cc2O[C@@H](CC(=O)c2c(O)c1O)c3ccccc3 Amb24107184 [1,1,0,0,0,0|0,0,2]=4 116 B22R3.18332665 COc1cc(O)cc2OC(=CC(=O)c12)c3ccccc3 Amb19935636 [1,1,0,0,0,0|0,0,0]=2 117 B22R3.43403522 Cc1cc(C)cc2OC(=CC(=O)c12)c3ccccc3Cl Amb19667799 [1,1,0,0,0,0|2,0,0]=4 118 B22R3.43403522 Oc1ccccc1C2=CC(=O)c3c(cc(O)cc3O)O2 Amb21928547 [1,1,0,0,0,0|0,0,0]=2 119 B22R3.53618968 Oc1cc2CC(=C(C(=O)c2c(c1)O)O)c3ccccc3 Amb17597321 [1,1,0,0,0,0|1,0,0]=3 120 B22R3.53618968 Oc1cc2OC(c3ccccc3)=C(O)C(=O)c2c(O)c1 Amb18511617 [1,1,0,0,0,0|0,0,0]=2 121 B22R3.78129056 Nc1c2OC(=CC(=O)c2c(O)cc1O)c3ccccc3 Amb24079280 [1,1,0,0,0,0|0,0,0]=2 122 B22R3.78129056 Oc1c2OC(=CC(=O)c2c(O)cc1O)c3ccccc3 Amb18511644 [1,1,0,0,0,0|0,0,0]=2 123 B22R3.121441578 COc1cc(O)c2c(c1)OC(=CC2=O)c3ccccc3 Amb18011138 [1,1,0,0,0,0|0,0,0]=2 124 B22R3.121441578 COc1cc(O)c2c(c1)oc(cc2=O)c3ccccc3 Amb1395283 [1,1,0,0,0,0|0,0,0]=2 125 B22R3.121441578 COc1cc2O[C@@H](CC(=O)c2c(O)c1)c3ccccc3 Amb18511610 [1,1,0,0,0,0|0,0,2]=4 126 B22R3.10328943 Oc1ccc(cc1O)C2=CC(=O)c3c(cccc3O)O2 Amb20665308 [1,1,0,0,0,0|0,0,0]=2 127 B22R3.16902753 COc1cccc2OC(=CC(=O)c12)c3ccc(O)cc3 Amb20665306 [1,1,0,0,0,0|0,0,0]=2 128 B22R3.98287842 Nc1ccc2OC(=CC(=O)c2c1O)c3ccc(N)cc3 Amb24079270 [1,1,0,0,0,0|1,0,0]=3 129 B24R3.391457772 COc1cc(O)c2C(=O)C=C(Oc2c1)Oc3ccc(O)cc3 Amb22172934 [0,1,0,0,0,1|0,0,0]=2 130 B24R3.13139879 COc1ccc(cc1)C=2Oc3cc(O)cc(O)c3C(=O)C2O Amb18511404 [0,2,0,0,0,0|0,0,0]=2 131 B24R3.13272581 COc1cc2OC(CC(=O)c2c(O)c1)c3ccc(cc3)OC Amb22173965 [0,2,0,0,0,0|0,0,2]=4 132 B24R3.13272581 COc1cc2O[C@@H](CC(=O)c2c(O)c1)c3ccc(cc3)OC Amb22748479 [0,2,0,0,0,0|0,0,2]=4 133 B24R3.13272581 COc1ccc(cc1)C2=CC(=O)c3c(O)cc(cc3O2)OC Amb22002078 [0,2,0,0,0,0|0,0,0]=2 134 B24R3.13273904 COc1ccc(cc1)C2=CC(=O)c3c(cc(O)c(O)c3O)O2 Amb19742231 [0,2,0,0,0,0|0,0,0]=2 135 B24R3.132789761 COc1ccc(cc1)[C@@H]2CC(=O)c3c(cc(O)cc3OC)O2 Amb23604517 [0,2,0,0,0,0|0,0,2]=4 136 B24R3.1245441990 COc1ccc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511414 [0,2,0,0,0,0|0,0,0]=2 137 B24R3.43764526 COc1cc(OC)c2c(=O)cc(oc2c1)-c3ccc(O)cc3 Amb24100673 [0,2,0,0,0,0|0,0,0]=2 138 B24R3.43764526 COc1cc(cc2OC(=CC(=O)c21)c3ccc(N)cc3)OC Amb18537209 [0,2,0,0,0,0|1,0,0]=3 139 B24R3.45757781 COc1cc(O)cc2OC(=C(O)C(=O)c12)c3ccc(O)cc3 Amb22173870 [0,2,0,0,0,0|0,0,0]=2 140 B24R3.1012910 Oc1ccc(cc1)C=2Oc3cc(O)c(O)c(O)c3C(=O)C2O Amb22173747 [0,2,0,0,0,0|0,0,0]=2 141 B24R3.2307788 COC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)cc3 Amb19742207 [0,2,0,0,0,0|0,0,0]=2 142 B24R3.115469742 Oc1ccc(cc1)C=2Oc3c(C(=O)C2O)c(O)cc(O)c3O Amb18511703 [0,2,0,0,0,0|0,0,0]=2 143 B24R3.311572219 Oc1cc(O)c2c(c1)oc(c(c2=O)O)c3ccc(c(c3)O)O Amb1027849 [0,2,0,0,0,0|0,0,0]=2 144 B24R3.311572219 Oc1cc(O)c2c(c1)oc(c(c2=O)O)c3ccc(c(c3)O)O Amb1279804 [0,2,0,0,0,0|0,0,0]=2 145 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb18371663 [0,2,0,0,0,0|0,0,0]=2 146 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb18511406 [0,2,0,0,0,0|0,0,0]=2 147 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb19668884 [0,2,0,0,0,0|0,0,0]=2 148 B24R3.311572219 Oc1cc2OC(c3cc(O)c(O)cc3)=C(O)C(=O)c2c(O)c1 Amb21928528 [0,2,0,0,0,0|0,0,0]=2 149 B24R3.311572219 Oc1cc2OC(c3ccc(c(c3)O)O)C(C(=O)c2c(c1)O)O Amb1056090 [0,2,0,0,0,0|0,0,2]=4 150 B24R3.311572219 Oc1cc2OC(c3ccc(c(c3)O)O)[C@H](C(=O)c2c(c1)O)O Amb16200032 [0,2,0,0,0,0|0,0,2]=4 151 B24R3.337787570 COc1cc(O)c2c(c1)OC(=C(O)C2=O)c3ccc(O)cc3 Amb19886472 [0,2,0,0,0,0|0,0,0]=2 152 B24R3.558339597 O[C@@H]1[C@H](Oc2cc(O)cc(O)c2C1=O)c3ccc(O)cc3O Amb22748561 [0,2,0,0,0,0|0,0,2]=4 153 B24R3.558339597 Oc1cc(O)c(cc1)C=2Oc3cc(O)cc(O)c3C(=O)C2O Amb18511704 [0,2,0,0,0,0|0,0,0]=2 154 B24R3.558339597 Oc1cc(O)c(cc1)C=2Oc3cc(O)cc(O)c3C(=O)C2O Amb20246382 [0,2,0,0,0,0|0,0,0]=2 155 B24R3.558339597 Oc1cc(O)c(cc1)C=2Oc3cc(O)cc(O)c3C(=O)C2O Amb22168349 [0,2,0,0,0,0|0,0,0]=2 156 B24R3.8721024 COc1c(O)c2c(cc1O)OC(=CC2=O)c3ccc(O)cc3 Amb19742232 [0,2,0,0,0,0|0,0,0]=2 157 B24R3.8721024 COc1c(O)c2c(cc1O)OC(CC2=O)c3ccc(O)cc3 Amb22168712 [0,2,0,0,0,0|0,0,2]=4 158 B24R3.10522450 Cc1c(cc2OC(=CC(=O)c2c1O)c3ccc(O)cc3)OC Amb22172892 [0,2,0,0,0,0|0,0,0]=2 159 B24R3.10522450 Cc1c(cc2O[C@@H](CC(=O)c2c1O)c3ccc(O)cc3)OC Amb23602926 [0,2,0,0,0,0|0,0,2]=4 160 B24R3.311191956 Cc1c(O)c2C(=O)C=C(Oc2c(C)c1O)c3ccc(O)cc3 Amb22172891 [0,2,0,0,0,0|0,0,0]=2 161 B24R3.9104595 COc1c2OC(=CC(=O)c2c(O)cc1O)c3ccc(O)cc3 Amb22172660 [0,2,0,0,0,0|0,0,0]=2 162 B24R3.337791963 COc1cc(O)c2c(c1)OC(=CC2=O)c3ccc(O)c(O)c3 Amb19959169 [0,2,0,0,0,0|0,0,0]=2 163 B24R3.557722971 Oc1c(O)cc(cc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511697 [0,2,0,0,0,0|0,0,0]=2 164 B24R3.558304036 Oc1ccc(C2=CC(=O)c3c(cc(O)cc3O)O2)c(O)c1O Amb19928577 [0,2,0,0,0,0|0,0,0]=2 165 B24R3.1289013967 COc1cc(ccc1O)C2=CC(=O)c3c(cc(C)cc3C)O2 Amb17992006 [0,2,0,0,0,0|2,0,0]=4 166 B24R3.1289013967 COc1cc(ccc1O)C2=CC(=O)c3c(cc(O)cc3O)O2 Amb18511613 [0,2,0,0,0,0|0,0,0]=2 167 B24R3.1289013967 COc1cc(ccc1O)[C@@H]2CC(=O)c3c(cc(O)cc3O)O2 Amb18511668 [0,2,0,0,0,0|0,0,2]=4 168 B20R2.239988 Oc1cc(O)c(c(c1)O)C(=O)Cc2ccc(cc2)Br Amb1486547 [0,0,1,0,1,0|1,0,1]=4 169 B20R2.239988 Oc1cc(O)c(c(c1)O)C(=O)Cc2ccc(cc2)Cl Amb1345388 [0,0,1,0,1,0|1,0,1]=4 170 B20R2.239988 Oc1cc(O)c(c(c1)O)C(=O)Cc2ccc(cc2)F Amb1486549 [0,0,1,0,1,0|1,0,1]=4 171 B20R2.239988 Oc1ccc(cc1)CC(=O)c2c(O)cc(cc2O)O Amb17615706 [0,0,1,0,1,0|0,0,1]=3 172 B22R3.5327493 Oc1cc(O)cc2OC=C(C(=O)c12)c3ccc(Br)cc3 Amb18010288 [0,0,0,0,1,1|1,0,0]=3 173 B22R3.5327493 Oc1cc(O)cc2OC=C(C(=O)c12)c3ccc(Cl)cc3 Amb18010287 [0,0,0,0,1,1|1,0,0]=3 174 B22R3.5327493 Oc1cc(O)cc2OC=C(C(=O)c12)c3ccc(F)cc3 Amb18005776 [0,0,0,0,1,1|1,0,0]=3 175 B22R3.5327493 Oc1cc(O)cc2OC=C(C(=O)c12)c3ccc(O)cc3 Amb17933801 [0,0,0,0,1,1|0,0,0]=2 176 B22R3.15233915 Cc1cc(C)cc2C(=O)C=C(Oc12)c3ccc(O)cc3 Amb18524772 [0,0,0,0,1,1|2,0,0]=4 177 B22R3.15233915 Oc1ccc(cc1)C2=CC(=O)c3cc(Cl)cc(Cl)c3O2 Amb21928146 [0,0,0,0,1,1|2,0,0]=4