COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK682314
Chemical Name: 2-[1-amino-2-(3,4-diethoxyphenyl)ethylidene]-5,5-dimethylcyclohexane-1,3-dione
Smiles: CCOc1cc(ccc1OCC)CC(=C1C(=O)CC(CC1=O)(C)C)N

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Molecular Weight: 345.44
Empirical Formula: C20H27NO4

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 3.05
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 78
Number of rings: 2

     

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