COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK506393
Chemical Name: (2E)-3-[4-(1,3-benzodioxol-5-ylmethoxy)-3-ethoxyphenyl]-2-cyano-N-(3-methoxypropyl)prop-2-enamide
Smiles: COCCCNC(=O)/C(=C/c1ccc(c(c1)OCC)OCc1ccc2c(c1)OCO2)/C#N

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Molecular Weight: 438.48
Empirical Formula: C24H26N2O6

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 3.204
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 99
Number of rings: 3

     

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