0 B23R2.343575737 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)NCC(=O)O MCULE-5034669829 [0,0,0,0,0,0|0,0,0]=0 1 B22R2.120748461 CC1=C(C(=O)OC2=CC(=CC=C12)O)CC(=O)NCC(=O)O MCULE-4315927559 [1,0,0,0,0,0|0,0,0]=1 2 B22R2.120748461 CC1=C(C(=O)OC2=CC(=CC=C12)O)CC(=O)NCC(C)C MCULE-7284795935 [1,0,0,0,0,0|2,0,1]=4 3 B22R2.120748461 CC1=C(C(=O)OC2=CC(=CC=C12)O)CC(=O)NCC(C)O MCULE-9550046717 [1,0,0,0,0,0|1,0,1]=3 4 B22R2.120748461 [C@H](C)(O)CNC(=O)CC1=C(C2=CC=C(C=C2OC1=O)O)C MCULE-6733406499 [1,0,0,0,0,0|1,0,1]=3 5 B24R2.45631030 COC1=CC2=C(C=C1Cl)C(=C(C(=O)O2)CC(=O)NCC(=O)O)C MCULE-6726786119 [0,1,0,0,0,0|0,0,0]=1 6 B24R2.580216008 COC1=CC=C2C(=C(C(=O)OC2=C1C)CC(=O)NCC(=O)O)C MCULE-7745918876 [0,1,0,0,0,0|0,0,0]=1 7 B24R2.580216062 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)N(C)CC(=O)O MCULE-2532663965 [0,1,0,0,0,0|0,0,0]=1 8 B24R2.580216071 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)NCC(O)CO MCULE-1890765718 [0,1,0,0,0,0|0,0,2]=3 9 B24R2.580216628 COC1=CC2=C(C=C1)C(=C(C(=O)O2)CC(=O)N[C@H](C)C(=O)O)C MCULE-3186090568 [0,1,0,0,0,0|0,0,0]=1 10 B24R2.580216628 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)NC(C)C(=O)O MCULE-7582368597 [0,1,0,0,0,0|0,0,0]=1 11 B24R2.580216628 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)N[C@@H](C)C(=O)O MCULE-5089870502 [0,1,0,0,0,0|0,0,0]=1 12 B24R2.580216064 COC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)NCC(=O)O)C MCULE-7334542692 [0,0,0,0,0,1|0,0,0]=1 13 B24R2.580216064 [C@H](C)(O)CNC(=O)CCC1=C(C2=CC=C(C=C2OC1=O)OC)C MCULE-8103292559 [0,0,0,0,0,1|1,0,1]=3 14 B24R2.580216358 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)NCCC(=O)O MCULE-4235618038 [0,0,0,0,0,1|0,0,0]=1 15 B23R2.16061641 C(C)(O)CNC(=O)CC1=C(C2=CC(=C(C=C2OC1=O)O)Cl)C MCULE-8248019195 [1,1,0,0,0,0|1,0,1]=4 16 B23R2.16061641 CC1=C(C(=O)OC2=C1C=C(C(=C2)O)Cl)CC(=O)NCC(=O)O MCULE-2998646557 [1,1,0,0,0,0|0,0,0]=2 17 B23R2.16061641 [C@H](C)(O)CNC(=O)CC1=C(C2=CC(=C(C=C2OC1=O)O)Cl)C MCULE-4855213526 [1,1,0,0,0,0|1,0,1]=4 18 B23R2.198523943 CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)NCC(=O)O MCULE-1185137049 [1,1,0,0,0,0|0,0,0]=2 19 B23R2.198523943 CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)NCC(C)O MCULE-1875850020 [1,1,0,0,0,0|1,0,1]=4 20 B23R2.198523943 CC1=CC2=C(C(=C1)O)C(=C(C(=O)O2)CC(=O)NCC(=O)O)C MCULE-6112981604 [1,1,0,0,0,0|0,0,0]=2 21 B23R2.198523943 [C@H](C)(O)CNC(=O)CC1=C(C2=C(C=C(C=C2OC1=O)O)O)C MCULE-1947213130 [1,1,0,0,0,0|1,0,1]=4 22 B23R2.232995106 C(C)(O)CNC(=O)CC1=C(C2=CC=C(C(=C2OC1=O)O)O)C MCULE-2190055957 [1,1,0,0,0,0|1,0,1]=4 23 B23R2.232995106 CC1=C(C(=O)OC2=C(C(=CC=C12)O)O)CC(=O)NCC(=O)O MCULE-4218378606 [1,1,0,0,0,0|0,0,0]=2 24 B23R2.232995106 CC1=C(C=CC2=C1OC(=O)C(=C2C)CC(=O)NCC(=O)O)O MCULE-8346842317 [1,1,0,0,0,0|0,0,0]=2 25 B23R2.232995106 [C@H](C)(O)CNC(=O)CC1=C(C2=CC=C(C(=C2OC1=O)O)O)C MCULE-1094252199 [1,1,0,0,0,0|1,0,1]=4 26 B23R2.232995115 CC1=C(C(=O)OC2=CC(=CC=C12)O)CC(=O)N(C)CC(=O)O MCULE-8427283183 [1,1,0,0,0,0|0,0,0]=2 27 B23R2.232995277 CC1=C(C(=O)OC2=CC(=CC=C12)O)CC(=O)N[C@@H](C)C(=O)O MCULE-3759872658 [1,1,0,0,0,0|0,0,0]=2 28 B23R2.232995277 CC1=C(C(=O)OC2=CC(=CC=C12)O)CC(=O)N[C@H](C)C(=O)O MCULE-7561835620 [1,1,0,0,0,0|0,0,0]=2 29 B25R2.961336367 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CCC(=O)N(C)CC(=O)O MCULE-1460147190 [0,1,0,0,0,1|0,0,0]=2 30 B25R2.961336475 COC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)NC(C)C(=O)O)C MCULE-6350047634 [0,1,0,0,0,1|0,0,0]=2 31 B25R2.961336475 COC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)N[C@H](C)C(=O)O)C MCULE-9210051528 [0,1,0,0,0,1|0,0,0]=2 32 B25R2.961336475 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CCC(=O)N[C@@H](C)C(=O)O MCULE-7644189136 [0,1,0,0,0,1|0,0,0]=2 33 B25R2.961340673 COC1=CC=C2C(=C(C(=O)OC2=C1C)CCC(=O)NCC(=O)O)C MCULE-1078720338 [0,1,0,0,0,1|0,0,0]=2 34 B25R2.961341090 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CCC(=O)NCC(O)CO MCULE-3421689115 [0,1,0,0,0,1|0,0,2]=4 35 B25R2.68043938 COC1=C(C=C2C(=C1)OC(=O)C(=C2C)CC(=O)NCCC(=O)O)Cl MCULE-8902673195 [0,1,0,0,0,1|0,0,0]=2 36 B25R2.961335369 COC1=CC=C2C(=C(C(=O)OC2=C1C)CC(=O)NCCC(=O)O)C MCULE-7511155420 [0,1,0,0,0,1|0,0,0]=2 37 B25R2.68043412 COC1=CC2=C(C=C1OC)C(=C(C(=O)O2)CC(=O)NCC(=O)O)C MCULE-2361386208 [0,2,0,0,0,0|0,0,0]=2 38 B25R2.68044422 COC1=C(C=C2C(=C1)OC(=O)C(=C2C)CC(=O)N[C@@H](C)C(=O)O)Cl MCULE-4138520394 [0,2,0,0,0,0|0,0,0]=2 39 B25R2.68044422 COC1=CC2=C(C=C1Cl)C(=C(C(=O)O2)CC(=O)NC(C)C(=O)O)C MCULE-4289041035 [0,2,0,0,0,0|0,0,0]=2 40 B25R2.68044422 COC1=CC2=C(C=C1Cl)C(=C(C(=O)O2)CC(=O)N[C@H](C)C(=O)O)C MCULE-5103625699 [0,2,0,0,0,0|0,0,0]=2 41 B25R2.68059263 COC1=C(C=C2C(=C1)OC(=O)C(=C2C)CC(=O)NCC(O)CO)Cl MCULE-9855244002 [0,2,0,0,0,0|0,0,2]=4 42 B25R2.961335191 COC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC(=O)NCC(=O)O)C)OC MCULE-5737297824 [0,2,0,0,0,0|0,0,0]=2 43 B25R2.961335191 COC1=CC=C2C(=C(C(=O)OC2=C1OC)CC(=O)NCC(C)O)C MCULE-3224985040 [0,2,0,0,0,0|1,0,1]=4 44 B25R2.961335558 COC1=CC=C2C(=C(C(=O)OC2=C1C)CC(=O)NC(C)C(=O)O)C MCULE-7297746008 [0,2,0,0,0,0|0,0,0]=2 45 B25R2.961335558 COC1=CC=C2C(=C(C(=O)OC2=C1C)CC(=O)N[C@@H](C)C(=O)O)C MCULE-1764812982 [0,2,0,0,0,0|0,0,0]=2 46 B25R2.961335558 COC1=CC=C2C(=C(C(=O)OC2=C1C)CC(=O)N[C@H](C)C(=O)O)C MCULE-5488344587 [0,2,0,0,0,0|0,0,0]=2 47 B25R2.961340666 COC1=CC=C2C(=C(C(=O)OC2=C1C)CC(=O)N(C)CC(=O)O)C MCULE-8665812069 [0,2,0,0,0,0|0,0,0]=2 48 B25R2.961340741 CCC(NC(=O)CC1=C(C2=CC=C(C=C2OC1=O)OC)C)C(=O)O MCULE-1990526615 [0,2,0,0,0,0|0,0,0]=2 49 B25R2.68057106 COC1=CC(=C2C(=C1)OC(=O)C(=C2C)CC(=O)NCC(=O)O)OC MCULE-2970237562 [0,2,0,0,0,0|0,0,0]=2 50 B25R2.68057106 [C@H](C)(O)CNC(=O)CC1=C(C2=C(C=C(C=C2OC1=O)OC)OC)C MCULE-9356294893 [0,2,0,0,0,0|1,0,1]=4 51 B23R3.220833140 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)NC3CC3 MCULE-1099984020 [1,0,0,1,0,0|1,0,1]=4 52 B23R2.232995117 CC1=C(C(=O)OC2=CC(=CC=C12)O)CCC(=O)NCC(=O)O MCULE-6031711577 [1,0,0,0,0,1|0,0,0]=2 53 B23R2.232995117 [C@H](C)(O)CNC(=O)CCC1=C(C2=CC=C(C=C2OC1=O)O)C MCULE-6433786337 [1,0,0,0,0,1|1,0,1]=4 54 B23R2.232995216 CC1=C(C(=O)OC2=CC(=CC=C12)O)CC(=O)NCCC(=O)O MCULE-4054681565 [1,0,0,0,0,1|0,0,0]=2 55 B25R2.961336359 COC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)NCCC(=O)O)C MCULE-2267839456 [0,0,0,0,0,2|0,0,0]=2 56 B25R2.961341591 COC1=CC=C2C(=C1)OC(=O)C(=C2C)CC(=O)NCCCC(=O)O MCULE-3144180423 [0,0,0,0,0,2|0,0,0]=2