COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432802
Chemical Name: (2E)-3-(3,4-diethoxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: CCOc1cc(ccc1OCC)/C=C(/c1nc2c([nH]1)cc(cc2)C)\C#N

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Molecular Weight: 347.42
Empirical Formula: C21H21N3O2

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 5.308
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 3

     

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