COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK688112
Chemical Name: N-(4,5-dicyano-2-nitrophenyl)valine
Smiles: N#Cc1cc(NC(C(=O)O)C(C)C)c(cc1C#N)[N+](=O)[O-]

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Molecular Weight: 288.26
Empirical Formula: C13H12N4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.036
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 142
Number of rings: 1

     

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