COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK776516
Chemical Name: 2-[2-(3,4-diethoxyphenyl)-1-(pyrrolidin-1-yl)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
Smiles: CCOc1cc(ccc1OCC)CC(=C1C(=O)CC(CC1=O)(C)C)N1CCCC1

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Molecular Weight: 399.53
Empirical Formula: C24H33NO4

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 4.412
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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