COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017929
Chemical Name: methyl2-{[(3,7-dimethyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=O)C1(C)OC(=O)c2c(C1)ccc(c2)C

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Molecular Weight: 353.37
Empirical Formula: C20H19NO5

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 3.48
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 81
Number of rings: 3

     

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