COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534426
Chemical Name: (2S,5aR,6aR,9S,9aR)-9-(((1-benzylpiperidin-4-yl)amino)methyl)-2,5a-dimethyloctahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-oneoxalate
Smiles: O=C1O[C@H]2[C@@H](C1CNC1CCN(CC1)Cc1ccccc1)C1OC31[C@](C2)(C)CCC[C@@H]3C

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Saltdata: (COOH)2
Molecular Weight: 438.61
Empirical Formula: C27H38N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.004
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 54
Number of rings: 6

     

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