COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035003
Chemical Name: 2-[(E)-{[5-(butan-2-yl)-2-hydroxyphenyl]imino}methyl]-4,6-dinitrophenol
Smiles: CCC(c1ccc(c(c1)/N=C/c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-])O)C

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Molecular Weight: 359.34
Empirical Formula: C17H17N3O6

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 4.76
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 144
Number of rings: 2

     

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