COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110739
Chemical Name: N-{3-methyl-1-oxo-1-[(2E)-2-(3,4,5-trimethoxybenzylidene)hydrazinyl]butan-2-yl}-3-nitrobenzamide(non-preferredname)
Smiles: COc1cc(/C=N/NC(=O)C(C(C)C)NC(=O)c2cccc(c2)[N+](=O)[O-])cc(c1OC)OC

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Molecular Weight: 458.47
Empirical Formula: C22H26N4O7

Physical State: Dry powder
Available Amount: 277 mg

Lipinsky:
logP: 3.889
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 144
Number of rings: 2

     

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