0 B14R1.27331 CC1=C(C(=O)C(=C(C1=O)Br)C(C)C)Br MCULE-6223177303 [0,0,0,0,0,0|0,0,0]=0 1 B13R1.2812 CC1=C(C(=C(C(=C1)Br)C(C)C)Br)O MCULE-3242174480 [1,0,0,0,0,0|1,0,1]=3 2 B13R1.2812 CC1=C(C(=O)N(C(=O)N1)C(C)C)Br MCULE-7294557753 [1,0,0,0,0,0|3,0,0]=4 3 B13R1.2812 CC1=CC(=C(C(=C1Br)C)[C@@H](C)N)O MCULE-1551870903 [1,0,0,0,0,0|3,0,0]=4 4 B13R1.2812 CC1=CC(=C(C(=C1Br)C)[C@@H](C)N)O MCULE-4719424453 [1,0,0,0,0,0|3,0,0]=4 5 B13R1.2812 CC1=CC(=C(C(=C1Br)C)[C@H](C)N)O MCULE-4357061418 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.2812 CC1=CC(=C(C(=C1Br)C)[C@H](C)N)O MCULE-7850588286 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.232 CC(C)C1=C(C=C(C(=C1)Br)O)O MCULE-5711623766 [2,0,0,0,0,0|2,0,0]=4 8 B12R1.232 CC1=C(C=C(C(=C1)Cl)C(C)C)[NH3+] MCULE-1667155781 [2,0,0,0,0,0|1,1,0]=4 9 B12R1.232 CC1=C(C=C(C(=C1)Cl)C(C)C)[NH3+] MCULE-1958768189 [2,0,0,0,0,0|1,1,0]=4 10 B12R1.232 CC1=C(C=C(C(=C1)O)C(C)C)O MCULE-6916835293 [2,0,0,0,0,0|0,0,2]=4 11 B12R1.232 CC1=CC(=C(C=C1Br)C(C)C)O MCULE-1089315484 [2,0,0,0,0,0|1,0,0]=3 12 B12R1.232 CC1=CC(=C(C=C1Cl)C(C)C)O MCULE-1376914978 [2,0,0,0,0,0|1,0,1]=4 13 B12R1.232 CC1=CC(=C(C=C1N)C(C)C)O MCULE-2075835744 [2,0,0,0,0,0|1,0,1]=4 14 B12R1.232 CC1=CC(=C(C=C1N)C(C)C)O MCULE-3196514017 [2,0,0,0,0,0|1,0,1]=4 15 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)Br MCULE-8592696648 [2,0,0,0,0,0|1,0,0]=3 16 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)Cl MCULE-8944008049 [2,0,0,0,0,0|1,0,1]=4 17 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)C MCULE-9899033250 [2,0,0,0,0,0|0,0,0]=2 18 B12R1.511 CC(C)C1=C(C(=CC(=C1)Br)Br)N MCULE-2192733172 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.511 CC(C)C1=C(C(=CC(=C1)F)Br)N MCULE-4756184027 [2,0,0,0,0,0|2,0,0]=4 20 B12R1.511 CC(C)C1=CC(=CC(=C1Cl)Br)Br MCULE-3528604865 [2,0,0,0,0,0|1,1,0]=4 21 B12R1.511 CC(C)C1=CC(=CC(=C1O)I)Br MCULE-4546546122 [2,0,0,0,0,0|2,0,0]=4 22 B12R1.511 CC1=C(C(=CC(=C1)Br)C(C)C)F MCULE-9214504277 [2,0,0,0,0,0|1,1,0]=4 23 B12R1.511 CC1=C(C(=CC(=C1)Br)C(C)C)N MCULE-2456787250 [2,0,0,0,0,0|2,0,0]=4 24 B12R1.1005 CC(C)C1=CC(=C(C(=C1)Br)Br)Br MCULE-7881792372 [2,0,0,0,0,0|2,0,0]=4 25 B12R1.1005 CC(C)C1=CC(=C(C(=C1)Br)Cl)Br MCULE-9408597415 [2,0,0,0,0,0|2,0,0]=4 26 B12R1.1005 CC(C)C1=CC(=C(C(=C1)Br)Cl)O MCULE-6951050033 [2,0,0,0,0,0|1,0,1]=4 27 B12R1.1005 CC(C)C1=CC(=C(C(=C1)Br)I)Br MCULE-1248011601 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.1005 CC(C)C1=CC(=C(C(=C1)Br)N)Br MCULE-5025796924 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.1005 CC(C)C1=CC(=C(C(=C1)Br)O)Br MCULE-2310002323 [2,0,0,0,0,0|2,0,0]=4 30 B12R1.1005 CC(C)C1=CC(=C(C(=C1)I)F)Br MCULE-9581115676 [2,0,0,0,0,0|2,0,0]=4 31 B12R1.1005 CC1=C(C=C(C=C1Br)C(C)C)Br MCULE-3090686021 [2,0,0,0,0,0|1,0,0]=3 32 B12R1.1005 CC1=C(C=C(C=C1Br)C(C)C)N MCULE-2451072301 [2,0,0,0,0,0|1,0,0]=3 33 B12R1.894 C[C@@H](N)C1=C(C=CC(=C1O)Br)Br MCULE-7447972775 [2,0,0,0,0,0|1,0,1]=4 34 B12R1.894 C[C@@H](N)C1=C(C=CC(=C1O)Br)Br MCULE-9504098367 [2,0,0,0,0,0|1,0,1]=4 35 B12R1.894 C[C@H](N)C1=C(C=CC(=C1O)Br)Br MCULE-2836455242 [2,0,0,0,0,0|1,0,1]=4 36 B12R1.894 C[C@H](N)C1=C(C=CC(=C1O)Br)Br MCULE-5165668679 [2,0,0,0,0,0|1,0,1]=4 37 B12R1.3795 CC1=C(C(=C(C(=C1Br)Br)C)Br)Br MCULE-2434511553 [2,0,0,0,0,0|2,0,0]=4 38 B12R1.3795 CC1=C(C(=C(C(=C1Br)C)C)Br)C MCULE-9032905470 [2,0,0,0,0,0|2,0,0]=4 39 B12R1.3795 CC1=C(C(=O)C(=C(C1=O)Br)C)Br MCULE-3077651003 [2,0,0,0,0,0|0,0,0]=2 40 B12R1.3795 CC1=C(C(=O)C(=C(C1=O)C)C)C MCULE-4663973266 [2,0,0,0,0,0|2,0,0]=4 41 B12R1.3795 CC1=C(C(=O)C(=C(C1=O)Cl)C)Cl MCULE-5846334035 [2,0,0,0,0,0|0,2,0]=4 42 B12R1.3795 O=C1C(=C(C(=O)C(=C1Br)Br)Br)Br MCULE-3432540520 [2,0,0,0,0,0|2,0,0]=4 43 B12R1.3795 O=C1C(=C(C(=O)C(=C1Br)O)Br)O MCULE-8656945820 [2,0,0,0,0,0|2,0,0]=4 44 B14R1.569 CC1=C(C(=C(C=C1N=O)C(C)C)O)Br MCULE-9340568392 [1,1,0,0,0,0|0,0,1]=3 45 B14R1.569 CC1=C(C(=C(C=C1N=O)C(C)C)O)I MCULE-1089655304 [1,1,0,0,0,0|0,1,1]=4 46 B14R1.3142 CC(C)(C)C1=CC(=O)C(=C(C1=O)Br)Cl MCULE-9046382124 [1,1,0,0,0,0|1,0,0]=3 47 B14R1.3144 CC1=CC(=O)C(=C(C1=O)O)C(C)(C)C MCULE-6038622816 [1,1,0,0,0,0|1,0,0]=3 48 B14R1.3930 CCC1=C(C(=O)C(=C(C1=O)O)CC)O MCULE-6881034869 [1,1,0,0,0,0|2,0,0]=4 49 B16R1.130399 CC(C)C1=C(C(=O)C(=C(C1=O)O)C(C)C)O MCULE-5464294367 [0,2,0,0,0,0|2,0,0]=4