COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL513209
Chemical Name: 4-methyl-3-(3-methylbutyl)-7-[(4-nitrobenzyl)oxy]-2H-chromen-2-one
Smiles: CC(CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 381.43
Empirical Formula: C22H23NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.286
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 3

     

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