COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201568
Chemical Name: (2Z)-3-{3-ethoxy-4-[(4-nitrobenzyl)oxy]phenyl}-2-(5-methoxy-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C(\c1nc2c([nH]1)ccc(c2)OC)/C#N

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Molecular Weight: 470.48
Empirical Formula: C26H22N4O5

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 5.618
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 4

     

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