COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287212
Chemical Name: (2E)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-3-{3-ethoxy-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]phenyl}prop-2-enenitrile
Smiles: CCOc1cc(ccc1OCC(=O)N1CCCC1)/C=C(/c1[nH]c2c(n1)cc(c(c2)C)C)\C#N

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Molecular Weight: 444.53
Empirical Formula: C26H28N4O3

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 4.616
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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