COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL545614
Chemical Name: methyl4-[3-methoxy-3-oxo-1-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propyl]benzoate
Smiles: COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1ccc(cc1)C(=O)OC

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Molecular Weight: 490.47
Empirical Formula: C27H22O9

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.832
Rotatable bonds: 8
H-donors: 3
H-acceptors: 9
PSA: 139
Number of rings: 4

     

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