COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201305
Chemical Name: (2Z)-3-[3-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: CCOc1cc(ccc1OCC#C)/C=C(\c1nc2c([nH]1)cc(cc2)C)/C#N

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Molecular Weight: 357.41
Empirical Formula: C22H19N3O2

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 4.814
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 3

     

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