COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK671863
Chemical Name: 2-[(E)-{[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]imino}methyl]-4,6-dinitrophenol
Smiles: [O-][N+](=O)c1cc(/C=N/c2ccc3c(c2)nc(o3)c2ccc(c(c2)C)C)c(c(c1)[N+](=O)[O-])O

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Molecular Weight: 432.39
Empirical Formula: C22H16N4O6

Physical State: Dry powder
Available Amount: 21 mg

Lipinsky:
logP: 6.419
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 150
Number of rings: 4

     

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