COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547633
Chemical Name: methyl4,6-dihydroxy-5-(3-methoxy-1-{4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-3-oxopropyl)pyridine-3-carboxylate
Smiles: COC(=O)CC(c1c(O)ncc(c1O)C(=O)OC)c1ccc(cc1)OCC(=C)C

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Molecular Weight: 401.42
Empirical Formula: C21H23NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.498
Rotatable bonds: 10
H-donors: 2
H-acceptors: 7
PSA: 115
Number of rings: 2

     

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