COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK293052
Chemical Name: (2E)-2-(1,3-benzodioxol-5-yl)-3-(5-chloro-2-ethoxyphenyl)prop-2-enenitrile
Smiles: CCOc1ccc(cc1/C=C(\c1ccc2c(c1)OCO2)/C#N)Cl

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Molecular Weight: 327.77
Empirical Formula: C18H14ClNO3

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 5.839
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 3

     

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