COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431716
Chemical Name: 4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-ethoxyphenylacetate
Smiles: CCOc1cc(ccc1OC(=O)C)/C=C(/c1nc2c([nH]1)cc(cc2)C)\C#N

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Molecular Weight: 361.4
Empirical Formula: C21H19N3O3

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 4.272
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 88
Number of rings: 3

     

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