COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528266
Chemical Name: 4-{[2-(methoxycarbonyl)phenyl]amino}-4-oxo-3-{[2-(propan-2-yl)tetrahydro-2H-pyran-4-yl]ammonio}butanoate
Smiles: COC(=O)c1ccccc1NC(=O)C([NH2+]C1CCOC(C1)C(C)C)CC(=O)[O-]

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Molecular Weight: 392.45
Empirical Formula: C20H28N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.437
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 121
Number of rings: 2

     

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