COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017311
Chemical Name: (2E)-3-[4-(benzyloxy)-3-ethoxyphenyl]-2-(phenylcarbonyl)prop-2-enenitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1)/C=C(/C(=O)c1ccccc1)\C#N

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Molecular Weight: 383.45
Empirical Formula: C25H21NO3

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 5.679
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 3

     

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