0 B23R3.205094787 CCC1=CC2=C(C=C1O)OC=C(C2=O)C3=CC=C(C=C3)Br MCULE-7169746103 [0,0,0,0,0,0|2,0,0]=2 1 B23R3.205094787 CCC1=CC2=C(C=C1O)OC=C(C2=O)C3=CC=C(C=C3)Cl MCULE-4385583498 [0,0,0,0,0,0|2,0,0]=2 2 B23R3.205094787 CCC1=CC2=C(C=C1O)OC=C(C2=O)C3=CC=C(C=C3)F MCULE-6416312556 [0,0,0,0,0,0|2,0,0]=2 3 B23R3.205094787 COC1=C(C=C2OC=C(C(=O)C2=C1)C3=CC=C(C=C3)O)O MCULE-4175634173 [0,0,0,0,0,0|0,0,0]=0 4 B22R3.5321326 CC1=C(C=C2C(=O)C(=COC2=C1)C3=CC=C(C=C3)N)C MCULE-5818334966 [1,0,0,0,0,0|2,0,0]=3 5 B22R3.5321326 O=C1C(=COC2=CC(=C(C=C12)O)O)C3=CC=C(C=C3)O MCULE-4263332259 [1,0,0,0,0,0|0,0,0]=1 6 B22R3.16743667 CCC1=CC2=C(C=C1O)OC=C(C2=O)C3=NC=CC=C3 MCULE-7363254801 [1,0,0,0,0,0|2,0,0]=3 7 B24R3.111470 CCC1=CC2=C(C=C1OC)OC=C(C2=O)C3=CC=C(C=C3)Br MCULE-1042504327 [0,1,0,0,0,0|2,0,0]=3 8 B24R3.111470 CCC1=CC2=C(C=C1OC)OC=C(C2=O)C3=CC=C(C=C3)Cl MCULE-7455668871 [0,1,0,0,0,0|2,0,0]=3 9 B24R3.2574212 CCC1=CC2=C(C=C1O)OC=C(C2=O)C3=CC=C(C=C3)OC MCULE-5640212438 [0,1,0,0,0,0|1,0,0]=2 10 B24R3.2574212 COC1=CC=C(C=C1)C2=COC3=CC(=C(C=C3C2=O)OC)O MCULE-7064090251 [0,1,0,0,0,0|0,0,0]=1 11 B24R3.7724733 COC1=C(C=C2OC=C(C(=O)C2=C1O)C3=CC=C(C=C3)O)O MCULE-2089260732 [0,1,0,0,0,0|0,0,0]=1 12 B24R3.345558058 CCC1=CC2=C(C=C1O)OC(=C(C2=O)C3=CC=C(C=C3)F)C MCULE-8509605786 [0,1,0,0,0,0|2,0,0]=3 13 B22R2.45327 C=C[C@H](C=CC1=CC=C(C(=C1)O)OC)C2=CC=C(C=C2)O MCULE-9208395338 [0,0,1,0,0,0|2,0,1]=4 14 B24R3.345530145 CCC1=CC2=C(C=C1O)OC=C(C2=O)OC3=CC=C(C=C3)Cl MCULE-6895022785 [0,0,0,0,0,1|2,0,0]=3 15 B24R3.345530145 CCC1=CC2=C(C=C1O)OC=C(C2=O)OC3=CC=C(C=C3)F MCULE-3303362307 [0,0,0,0,0,1|2,0,0]=3 16 B21R2.35329 COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)I)O MCULE-7441446660 [1,0,1,0,0,0|2,0,0]=4 17 B21R2.24209 COC1=C(C=C(C(=C1)C(=O)CC2=CC=C(C=C2)O)O)O MCULE-8174972036 [1,0,1,0,0,0|0,0,1]=3 18 B21R3.145347 CC1=CC2=C(C=C1)OC=C(C2=O)C3=CC=C(C=C3)Cl MCULE-3727063875 [2,0,0,0,0,0|1,0,0]=3 19 B21R3.145347 CC1=CC=C(C=C1)C2=COC3=C(C2=O)C=C(C=C3)C MCULE-5113007488 [2,0,0,0,0,0|1,0,0]=3 20 B21R3.145347 CC1=CC=C(C=C1)C2=COC3=C(C2=O)C=C(C=C3)Cl MCULE-1077458625 [2,0,0,0,0,0|2,0,0]=4 21 B21R3.145347 CC1=CC=C(C=C1)C2=COC3=C(C2=O)C=C(C=C3)F MCULE-3985104154 [2,0,0,0,0,0|2,0,0]=4 22 B21R3.19964 CC1=CC2=C(C=C1O)OC=C(C2=O)C3=NC=CC=C3 MCULE-1189068217 [2,0,0,0,0,0|1,0,0]=3 23 B21R3.19964 O=C1C(=COC2=C1C=C(C(=C2)O)O)C3=CC=CC=C3 MCULE-1263803416 [2,0,0,0,0,0|0,0,0]=2 24 B21R3.3759272 CC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)Cl MCULE-4894450365 [2,0,0,0,0,0|2,0,0]=4 25 B21R3.3759272 NC1=CC=C(C=C1)C2=COC3=CC(=CC=C3C2=O)O MCULE-3591453385 [2,0,0,0,0,0|1,0,0]=3 26 B21R3.3759272 O=C1C(=COC2=C1C=CC(=C2)O)C3=CC=C(C=C3)F MCULE-7003586571 [2,0,0,0,0,0|1,0,0]=3 27 B21R3.3759272 O=C1C(=COC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O MCULE-8239511422 [2,0,0,0,0,0|0,0,0]=2 28 B21R3.3759272 O=C1C(=COC2=CC(=CC=C12)O)C3=CC=C(C=C3)Br MCULE-2664679319 [2,0,0,0,0,0|1,0,0]=3 29 B21R3.3759272 O=C1C(=COC2=CC(=CC=C12)O)C3=CC=C(C=C3)Cl MCULE-6142563463 [2,0,0,0,0,0|1,0,0]=3 30 B21R3.3759272 O=C1C2=CC=C(C=C2OCC1C3=CC=C(C=C3)O)O MCULE-5855528622 [2,0,0,0,0,0|0,0,2]=4 31 B21R3.3759272 O=C1C2=CC=C(C=C2OC[C@@H]1C3=CC=C(C=C3)O)O MCULE-1112895889 [2,0,0,0,0,0|0,0,2]=4 32 B21R3.3759272 O=C1C2=CC=C(C=C2OC[C@@H]1C3=CC=C(C=C3)O)O MCULE-3900223280 [2,0,0,0,0,0|0,0,2]=4 33 B23R2.917354 COC1=CC(=C(C=C1OC)C(=O)NC2=CC=C(C=C2)O)OC MCULE-6716634307 [0,1,1,0,0,0|1,0,1]=4 34 B23R3.1597248 COC1=CC=C2OC(=O)C(=C(C2=C1)C)C3=CC=C(C=C3)Br MCULE-4712336396 [1,1,0,0,0,0|2,0,0]=4 35 B23R3.119174 CC1=C(C2=C(C=C1O)OC=C(C2=O)C3=CC=C(C=C3)O)O MCULE-5728196105 [1,1,0,0,0,0|0,0,0]=2 36 B23R3.119174 O=C1C(=COC2=CC(=C(C(=C12)O)O)O)C3=CC=C(C=C3)O MCULE-4243524600 [1,1,0,0,0,0|0,0,0]=2 37 B23R3.224376 COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=C(C(=C3)O)O MCULE-1027180042 [1,1,0,0,0,0|0,0,0]=2 38 B23R3.80894 CCC1=CC2=C(C=C1OC)OC=C(C2=O)C3=CC=CC=C3 MCULE-1472732346 [1,1,0,0,0,0|1,0,0]=3 39 B23R3.80894 CCC1=CC2=C(C=C1OC)OC=C(C2=O)C3=CC=CC=N3 MCULE-3797783499 [1,1,0,0,0,0|2,0,0]=4 40 B23R3.13149012 CCCC1=C(C=C2OC=C(C(=O)C2=C1)C3=NC=CC=C3)O MCULE-3222887486 [1,1,0,0,0,0|2,0,0]=4 41 B23R3.13149012 CCCC1=CC2=C(C=C1O)OC=C(C2=O)C3=CC=CC=C3 MCULE-1693585554 [1,1,0,0,0,0|1,0,0]=3 42 B23R3.27038390 CCC1=CC2=C(C=C1O)OC(=C(C2=O)C3=CC=CC=C3)C MCULE-8430856853 [1,1,0,0,0,0|1,0,0]=3 43 B23R3.205094348 CCC1=C(C=C2OC=C(C(=O)C2=C1)C3=C(C=CC=C3)Cl)O MCULE-5582373155 [1,1,0,0,0,0|1,0,0]=3 44 B23R3.205094348 CCC1=C(C=C2OC=C(C(=O)C2=C1)N3C=CC=CC3=O)O MCULE-9985488655 [1,1,0,0,0,0|2,0,0]=4 45 B25R3.144429 CCC1=CC2=C(C=C1OC)OC=C(C2=O)OC3=CC=C(C=C3)Cl MCULE-9717587307 [0,1,0,0,0,1|2,0,0]=4 46 B25R3.144429 CCC1=CC2=C(C=C1OC)OC=C(C2=O)OC3=CC=C(C=C3)F MCULE-2836730485 [0,1,0,0,0,1|2,0,0]=4 47 B25R3.144429 COC1=CC2=C(C=C1OC)C(=O)C(=CC3=CC=C(C=C3)O)CC2 MCULE-4674673260 [0,1,0,0,0,1|1,0,1]=4 48 B25R3.328763797 CCC1=C(C=C2OC(=C(C(=O)C2=C1)OC3=CC=C(C=C3)F)C)O MCULE-1507302470 [0,1,0,0,0,1|2,0,0]=4 49 B25R3.328763797 CCC1=C(C=C2OC(=C(C(=O)C2=C1)OC3=CC=C(C=C3)I)C)O MCULE-5809683327 [0,1,0,0,0,1|2,0,0]=4 50 B25R3.12571126 CCC1=CC2=C(C=C1OC)OC(=C(C2=O)C3=CC=C(C=C3)F)C MCULE-7756705453 [0,2,0,0,0,0|2,0,0]=4 51 B25R3.16307152 CCC1=CC2=C(C=C1OC)OC=C(C2=O)C3=CC=C(C=C3)OC MCULE-9377347266 [0,2,0,0,0,0|1,0,0]=3 52 B25R3.16307152 COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=C(C(=C3)OC)OC MCULE-6356670157 [0,2,0,0,0,0|0,0,0]=2 53 B25R3.2790490 COC1=CC=C(C=C1)C2=COC3=CC(=C(C(=C3C2=O)O)OC)O MCULE-2000781948 [0,2,0,0,0,0|0,0,0]=2 54 B23R3.27037618 CCC1=CC2=C(C=C1O)OC=C(C2=O)OC3=CC=CC=C3 MCULE-5220807364 [1,0,0,0,0,1|1,0,0]=3 55 B23R3.29719259 COC1=C2C(=O)C(=COC2=CC(=C1)O)C3=CC=C(C=C3)O MCULE-4609929478 [0,0,0,0,1,1|0,0,0]=2