COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114059
Chemical Name: (2E)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: CCOc1cc(cc(c1O)Br)/C=C(/c1[nH]c2c(n1)ccc(c2)C)\C#N

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Molecular Weight: 398.26
Empirical Formula: C19H16BrN3O2

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 5.348
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 81
Number of rings: 3

     

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