COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK612751
Chemical Name: 3-(3,4-dimethoxyphenyl)-7-[(4-nitrobenzyl)oxy]-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: COc1ccc(cc1OC)c1c(=O)c2ccc(cc2oc1C(F)(F)F)OCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 501.42
Empirical Formula: C25H18F3NO7

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.674
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 99
Number of rings: 4

     

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