COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK111413
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-[4-(benzyloxy)-3-bromo-5-ethoxyphenyl]prop-2-enenitrile
Smiles: CCOc1cc(cc(c1OCc1ccccc1)Br)/C=C(/c1nc2c([nH]1)cccc2)\C#N

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Molecular Weight: 474.36
Empirical Formula: C25H20BrN3O2

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 6.725
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 4

     

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