COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023300
Chemical Name: 2-acetyl-4-methylphenyl3,7-dimethyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxylate
Smiles: Cc1ccc2c(c1)C(=O)OC(C2)(C)C(=O)Oc1ccc(cc1C(=O)C)C

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Molecular Weight: 352.39
Empirical Formula: C21H20O5

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 3.107
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 69
Number of rings: 3

     

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