COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287182
Chemical Name: (2Z)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-3-{2-[(4-nitrobenzyl)oxy]phenyl}prop-2-enenitrile
Smiles: N#C/C(=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])/c1[nH]c2c(n1)cc(c(c2)C)C

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Molecular Weight: 424.46
Empirical Formula: C25H20N4O3

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 6.269
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 4

     

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