COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541874
Chemical Name: methyl3-(3,4,5-trifluorophenyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
Smiles: COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1cc(F)c(c(c1)F)F

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Molecular Weight: 486.4
Empirical Formula: C25H17F3O7

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.867
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 113
Number of rings: 4

     

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