COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567003
Chemical Name: 3-(benzylammonio)-4-{[2-(methoxycarbonyl)phenyl]amino}-4-oxobutanoate
Smiles: COC(=O)c1ccccc1NC(=O)C(CC(=O)[O-])[NH2+]Cc1ccccc1

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Molecular Weight: 356.38
Empirical Formula: C19H20N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.024
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 112
Number of rings: 2

     

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