COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL433462
Chemical Name: 3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-oxopropanenitrile
Smiles: COc1ccc(cc1)C(C(=O)c1cc(OC)c2c(c1OC)OCO2)C#N

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Molecular Weight: 355.35
Empirical Formula: C19H17NO6

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 3.075
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 87
Number of rings: 3

     

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