COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472746
Chemical Name: (2E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-ethoxy-4-[(2-methylbenzyl)oxy]phenyl}prop-2-enamide
Smiles: CCOc1cc(ccc1OCc1ccccc1C)/C=C(/C(=O)Nc1ccc2c(c1)OCCO2)\C#N

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Molecular Weight: 470.52
Empirical Formula: C28H26N2O5

Physical State: Dry powder
Available Amount: 341 mg

Lipinsky:
logP: 5.902
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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