COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534630
Chemical Name: 8-{[butyl(methyl)ammonio]methyl}-3-(2,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-chromen-7-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1oc(=O)c(c2C)c1ccc(cc1OC)OC)C

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Molecular Weight: 411.5
Empirical Formula: C24H29NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.752
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 3

     

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