0 B37R6.106812465 O=C1OC2=CC(=CC=C2C3=C1CCC3)OCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5 MCULE-6871822930 [0,0,0,0,0,0|0,0,0]=0 1 B37R6.106812465 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5C(=C4)OC(=O)C6=C5CCC6 MCULE-4007393122 [0,0,0,0,0,0|0,0,0]=0 2 B38R6.349338352 CC1=C2OC(=O)C3=C(C2=CC=C1OCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5)CCC3 MCULE-7587967190 [0,1,0,0,0,0|0,0,0]=1 3 B38R6.349338352 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5C6=C(CCC6)C(=O)OC5=C4C MCULE-4288230319 [0,1,0,0,0,0|0,0,0]=1 4 B38R6.955154074 O=C1OC2=CC(=C(C=C2C3=C1CCC3)Cl)OCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5 MCULE-2276345084 [0,1,0,0,0,0|0,0,0]=1 5 B38R6.955154074 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=C(C=C5C(=C4)OC(=O)C6=C5CCC6)Cl MCULE-9284752021 [0,1,0,0,0,0|0,0,0]=1 6 B36R5.1111168972 CCC1=C(C(=O)OC2=CC(=CC=C12)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4)Br MCULE-5801086011 [0,0,1,0,0,0|1,0,0]=2 7 B36R5.1654347323 CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4 MCULE-2277563851 [0,0,1,0,0,0|0,0,0]=1 8 B36R5.1654347323 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5C(=CC(=O)OC5=C4)CCC MCULE-1758048974 [0,0,1,0,0,0|0,0,0]=1 9 B38R6.200973822 O=C1OC2=CC(=CC=C2C3=C1C=CC=C3)OCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5 MCULE-7332291093 [0,0,0,0,0,1|0,0,3]=4 10 B38R6.200973822 O=C1OC2=CC(=CC=C2C3=C1CCCC3)OCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5 MCULE-2608142130 [0,0,0,0,0,1|0,0,0]=1 11 B38R6.200973822 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5C(=C4)OC(=O)C6=C5C=CC=C6 MCULE-2240506292 [0,0,0,0,0,1|0,0,3]=4 12 B35R5.691137448 CC1=C(C(=O)OC2=CC(=CC=C12)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4)Br MCULE-9583412262 [1,0,1,0,0,0|1,0,0]=3 13 B35R5.691137448 CC1=C(C2=C(C=C(C=C2)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4)OC1=O)C MCULE-7536533085 [1,0,1,0,0,0|0,0,0]=2 14 B35R5.838155072 CCC1=CC(=O)OC2=CC(=CC=C12)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4 MCULE-5604631441 [1,0,1,0,0,0|0,0,0]=2 15 B37R5.1561574185 CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4 MCULE-6224750399 [0,1,1,0,0,0|0,0,0]=2 16 B37R5.1561574185 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5C(=CC(=O)OC5=C4)CCCC MCULE-4244680319 [0,1,1,0,0,0|0,0,0]=2 17 B37R5.1718220119 CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4 MCULE-9311853309 [0,1,1,0,0,0|0,0,0]=2 18 B37R5.1718220119 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5C(=CC(=O)OC5=C4C)CCC MCULE-9892817631 [0,1,1,0,0,0|0,0,0]=2 19 B37R5.2309325792 CCCC1=CC(=O)OC2=C1C=C(C(=C2)OCC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4)Cl MCULE-1476316233 [0,1,1,0,0,0|0,0,0]=2 20 B39R6.80912098 CC1=C2OC(=O)C3=C(C2=CC=C1OCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5)CCCC3 MCULE-7554949393 [0,1,0,0,0,1|0,0,0]=2 21 B39R6.80912098 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5C6=C(CCCC6)C(=O)OC5=C4C MCULE-3285480243 [0,1,0,0,0,1|0,0,0]=2 22 B39R6.174337180 O=C1OC2=CC(=C(C=C2C3=C1CCCC3)Cl)OCC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5 MCULE-8285099510 [0,1,0,0,0,1|0,0,0]=2 23 B39R6.174337180 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=C(C=C5C(=C4)OC(=O)C6=C5CCCC6)Cl MCULE-2459776470 [0,1,0,0,0,1|0,0,0]=2 24 B39R6.174330395 CC1=C2OC(=O)C3=C(C2=CC=C1OC(C)C(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5)CCC3 MCULE-9998419836 [0,2,0,0,0,0|0,0,0]=2 25 B39R6.174330395 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)C(C)OC4=CC=C5C6=C(CCC6)C(=O)OC5=C4C MCULE-5712127006 [0,2,0,0,0,0|0,0,0]=2 26 B39R6.304828921 CC(OC1=C(C=C2C(=C1)OC(=O)C3=C2CCC3)Cl)C(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5 MCULE-5831700982 [0,2,0,0,0,0|0,0,0]=2 27 B39R6.304828921 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)C(C)OC4=C(C=C5C(=C4)OC(=O)C6=C5CCC6)Cl MCULE-6490977416 [0,2,0,0,0,0|0,0,0]=2 28 B37R6.106816330 O=C(COC1=CC=C2N=C3CCCN3C(=O)C2=C1)N4CC5CC(C4)C6=CC=CC(=O)N6C5 MCULE-2578192106 [0,0,0,0,1,1|1,0,0]=3 29 B37R6.106816330 [C@@H]12CN(C[C@@H](C1)CN3C2=CC=CC3=O)C(=O)COC4=CC=C5N=C6CCCN6C(=O)C5=C4 MCULE-9580991771 [0,0,0,0,1,1|1,0,0]=3