COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444336
Chemical Name: methylN-[(3,5-dinitrophenyl)carbonyl]valinate
Smiles: COC(=O)C(C(C)C)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 325.28
Empirical Formula: C13H15N3O7

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 1.805
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 147
Number of rings: 1

     

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