COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112791
Chemical Name: (2E)-3-(3-ethoxy-4-hydroxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: CCOc1cc(ccc1O)/C=C(/c1nc2c([nH]1)cc(cc2)C)\C#N

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Saltdata: HCI
Molecular Weight: 319.36
Empirical Formula: C19H17N3O2

Physical State: Dry powder
Available Amount: 168 mg

Lipinsky:
logP: 4.178
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 81
Number of rings: 3

     

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