COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806607
Chemical Name: 2-oxo-2-phenylethylN-(2,4-dinitrophenyl)-beta-alaninate
Smiles: O=C(OCC(=O)c1ccccc1)CCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 373.32
Empirical Formula: C17H15N3O7

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.001
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 147
Number of rings: 2

     

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