COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473621
Chemical Name: (2Z)-N-(1,3-benzodioxol-5-ylmethyl)-3-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-2-cyanoprop-2-enamide
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)/C=C(\C(=O)NCc1ccc2c(c1)OCO2)/C#N

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Molecular Weight: 490.94
Empirical Formula: C27H23ClN2O5

Physical State: Dry powder
Available Amount: 234 mg

Lipinsky:
logP: 5.568
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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