COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL485675
Chemical Name: methyl3-{[(3-ethyl-5,6-dimethyl-1-benzofuran-2-yl)carbonyl]amino}-5-nitrobenzoate
Smiles: COC(=O)c1cc(cc(c1)[N+](=O)[O-])NC(=O)c1oc2c(c1CC)cc(c(c2)C)C

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Molecular Weight: 396.4
Empirical Formula: C21H20N2O6

Available Amount: 0 mg

Lipinsky:
logP: 5.222
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 114
Number of rings: 3

     

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