COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540723
Chemical Name: methyl3-(1,3-benzodioxol-5-yl)-3-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
Smiles: COC(=O)CC(c1c(O)cc(c2c1oc(cc2=O)c1ccccc1)O)c1ccc2c(c1)OCO2

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Molecular Weight: 460.44
Empirical Formula: C26H20O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.284
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 111
Number of rings: 5

     

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