0 B17R2.139609 COC1=C(C(=C2C(=O)OC(CC2=C1)C)O)Cl MCULE-5173720503 [0,0,0,0,0,0|3,0,1]=4 1 B16R2.192589 COC1=C(C=C2C(=O)NC(=NC2=C1)C)O MCULE-9170997659 [1,0,0,0,0,0|3,0,0]=4 2 B16R2.192589 COC1=CC2=C(C=C1Br)C(=O)NC(=N2)C MCULE-1363393989 [1,0,0,0,0,0|3,0,0]=4 3 B16R2.192589 COC1=CC2=C(C=C1Cl)C(=CC(=O)O2)C MCULE-2052163035 [1,0,0,0,0,0|3,0,0]=4 4 B16R2.192589 COC1=CC2=C(C=C1Cl)C(=CC(=O)O2)O MCULE-8290097335 [1,0,0,0,0,0|2,0,1]=4 5 B16R2.192589 COC1=CC2=C(C=C1F)C(=O)C=C(N2)C MCULE-7781048389 [1,0,0,0,0,0|2,0,0]=3 6 B16R2.203249 COC1=CC2=C(C(=O)C=C(O2)C)C(=C1)O MCULE-9096757948 [1,0,0,0,0,0|0,0,0]=1 7 B16R2.203249 COC1=CC2=C(C(=O)O[C@@H](C2)C)C(=C1)O MCULE-7251254462 [1,0,0,0,0,0|2,0,1]=4 8 B18R2.2665456 COC1=C(C(=C2C(=O)OC(=CC2=C1Cl)C)O)Cl MCULE-6809935810 [0,1,0,0,0,0|3,0,0]=4 9 B15R1.10148 COC1=CC(=C(C(=C1C(=O)C)O)I)OC MCULE-1664334355 [1,0,1,0,0,0|1,0,1]=4 10 B15R1.10148 COC1=CC(=C(C(=C1C)O)C(=O)C)OC MCULE-3069838607 [1,0,1,0,0,0|0,0,1]=3 11 B15R1.27348 CCOC1=C(C=C(C(=C1)OC)C)C(=O)O MCULE-1833887359 [1,0,1,0,0,0|1,0,1]=4 12 B15R1.1854 COC1=CC(=C(C=C1)C(=O)C=C(C)C)C MCULE-8513211204 [1,0,1,0,0,0|2,0,0]=4 13 B15R1.1854 COC1=CC=C(C(=C1)Cl)C(=O)C=C(C)C MCULE-6736875257 [1,0,1,0,0,0|2,0,0]=4 14 B15R1.3776 COC1=CC=C(C=C1C)C(=O)C=C(C)C MCULE-6539467528 [1,0,1,0,0,0|1,0,0]=3 15 B15R1.3776 COC1=CC=C(C=C1F)C(=O)C=C(C)C MCULE-9419883475 [1,0,1,0,0,0|2,0,0]=4 16 B15R1.10613 CC=CC(=O)C1=CC(=C(C=C1C)OC)C MCULE-7685844088 [1,0,1,0,0,0|1,0,0]=3 17 B15R1.10613 CC=CC(=O)C1=CC(=C(C=C1F)OC)F MCULE-2603806636 [1,0,1,0,0,0|2,0,0]=4 18 B15R2.1824 COC1=C(C=C2C=CC(=NC2=C1)C)C MCULE-4241099164 [2,0,0,0,0,0|1,0,0]=3 19 B15R2.1824 COC1=CC2=C(C=CC(=O)O2)C=C1O MCULE-3897085978 [2,0,0,0,0,0|2,0,0]=4 20 B15R2.59733 CC1=C(C=C2C(=CC(=O)OC2=C1)O)C MCULE-3952089520 [2,0,0,0,0,0|1,0,1]=4 21 B15R2.59733 CC1=CC(=O)C2=CC(=C(C=C2O1)Br)F MCULE-5757270322 [2,0,0,0,0,0|2,0,0]=4 22 B15R2.65793 CC1=CC(=O)C2=C(O1)C=C(C=C2C)O MCULE-2505628766 [2,0,0,0,0,0|1,0,0]=3 23 B15R2.65793 CC1=CC(=O)C2=C(O1)C=C(C=C2O)O MCULE-8637609170 [2,0,0,0,0,0|0,0,0]=2 24 B15R2.65793 CC1=CC(=O)OC2=CC(=CC(=C12)O)O MCULE-2069759263 [2,0,0,0,0,0|2,0,0]=4 25 B15R2.65793 CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)O MCULE-9318891787 [2,0,0,0,0,0|2,0,0]=4 26 B15R2.65793 CC1=CC2=CC(=CC(=C2C(=O)O1)O)O MCULE-2215018242 [2,0,0,0,0,0|2,0,0]=4 27 B15R2.65793 O=C1C=C(C2=C(O1)C=C(C=C2O)O)O MCULE-1992144699 [2,0,0,0,0,0|1,0,1]=4 28 B15R2.89396 COC1=CC2=C(C=C1)C(=CC(=N2)C)O MCULE-3379837758 [2,0,0,0,0,0|1,0,1]=4 29 B15R2.89396 COC1=CC2=C(C=C1)C(=CC(=O)O2)O MCULE-6535627844 [2,0,0,0,0,0|1,0,1]=4 30 B15R2.89396 COC1=CC2=C(C=C1)C(=O)NC(=C2)C MCULE-4333475173 [2,0,0,0,0,0|2,0,0]=4 31 B15R2.89396 COC1=CC2=C(C=C1)C(=O)NC(=N2)C MCULE-3950484608 [2,0,0,0,0,0|2,0,0]=4 32 B15R2.89396 COC1=CC=C2C(=CC(=NC2=C1)C)Br MCULE-3077940795 [2,0,0,0,0,0|2,0,0]=4 33 B15R2.89396 COC1=CC=C2C(=CC(=NC2=C1)C)Cl MCULE-9233061591 [2,0,0,0,0,0|2,0,0]=4 34 B15R2.89396 COC1=CC=C2C(=CC(=NC2=C1)C)N MCULE-8139506926 [2,0,0,0,0,0|2,0,0]=4 35 B15R2.89396 COC1=CC=C2C(=CC(=O)OC2=C1)C MCULE-1379091359 [2,0,0,0,0,0|2,0,0]=4 36 B15R2.89396 COC1=CC=C2C(=CC(=O)OC2=C1)Cl MCULE-8465527407 [2,0,0,0,0,0|2,0,0]=4 37 B15R2.89396 COC1=CC=C2C(=CC(=S)OC2=C1)C MCULE-4703615727 [2,0,0,0,0,0|2,0,0]=4 38 B15R2.89396 COC1=CC=C2C(=O)NC(=O)OC2=C1 MCULE-1699618584 [2,0,0,0,0,0|2,0,0]=4 39 B17R2.1177 COC1=C(C(=C2C=CC(=O)OC2=C1)O)OC MCULE-2325740515 [1,1,0,0,0,0|1,0,0]=3 40 B17R2.1178 COC1=C(C(=C2C=CC(=O)OC2=C1)OC)O MCULE-9786905187 [1,1,0,0,0,0|2,0,0]=4 41 B17R2.15600 CCC1=C(C2=C(C=C1O)OC(CC2=O)C)O MCULE-5547072744 [1,1,0,0,0,0|0,0,2]=4 42 B17R2.15600 COC1=C(C=C2C=C(OC(=O)C2=C1O)C)O MCULE-4126426707 [1,1,0,0,0,0|2,0,0]=4 43 B17R2.881626 CC1=CC(=O)C2=C(C(=C(C(=C2O1)C)O)C)O MCULE-2657796524 [1,1,0,0,0,0|0,0,0]=2 44 B17R2.139606 COC1=C(C=C2C(=CC(=NC2=C1)C)Cl)OC MCULE-6751340599 [1,1,0,0,0,0|2,0,0]=4 45 B17R2.139606 COC1=C(C=C2C(=CC(=NC2=C1)C)O)OC MCULE-9598251353 [1,1,0,0,0,0|1,0,1]=4 46 B17R2.139606 COC1=C(C=C2C(=O)NC(=NC2=C1)C)OC MCULE-7926522965 [1,1,0,0,0,0|2,0,0]=4 47 B17R2.139606 COC1=C(C=C2C(=O)OC(=NC2=C1)C)OC MCULE-9995273127 [1,1,0,0,0,0|2,0,0]=4 48 B17R2.139606 COC1=CC2=C(C=C1OC)C(=CC(=O)O2)C MCULE-4576976946 [1,1,0,0,0,0|2,0,0]=4 49 B17R2.401280 COC1=CC(=C2C(=CC(=O)OC2=C1)C)OC MCULE-5725483513 [1,1,0,0,0,0|2,0,0]=4 50 B17R2.429009 COC1=CC(=C2C(=O)OC(=C(C2=C1)C)C)O MCULE-3193850911 [1,1,0,0,0,0|2,0,0]=4 51 B17R2.1225416 COC1=CC(=C2C(=O)CC(OC2=C1)(C)C)O MCULE-8143016945 [1,1,0,0,0,0|0,0,2]=4 52 B17R2.1225416 COC1=CC2=C(C(=O)OC(O2)(C)C)C(=C1)O MCULE-6784973046 [1,1,0,0,0,0|1,0,1]=4 53 B19R2.4225739 COC1=CC2=C(C(=CC(=O)O2)C)C(=C1OC)OC MCULE-3346855631 [0,2,0,0,0,0|2,0,0]=4 54 B19R2.15274476 COC1=CC(=O)C2=C(C(=C(C=C2C1=O)OC)C)O MCULE-4277111331 [0,2,0,0,0,0|1,0,0]=3 55 B17R2.430459 COC1=CC=C2C(=C(OC2=C1C)C(=O)O)C MCULE-3080377064 [0,0,1,1,0,0|2,0,0]=4 56 B19R3.1114855 O=C1C=C(OC2=C1C(=C3C=COC3=C2)O)CO MCULE-3146362168 [0,1,0,1,0,0|0,0,2]=4 57 B19R3.6098608 COC1=C2C(=O)C=C(OC2=CC3=C1C=CO3)C MCULE-6909437128 [0,1,0,1,0,0|0,0,2]=4