COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540501
Chemical Name: 2-{5-[3-methoxy-3-oxo-1-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propyl]furan-2-yl}benzoicacid
Smiles: COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1ccc(o1)c1ccccc1C(=O)O

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Molecular Weight: 542.5
Empirical Formula: C30H22O10

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.825
Rotatable bonds: 11
H-donors: 4
H-acceptors: 10
PSA: 163
Number of rings: 5

     

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