COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL029021
Chemical Name: 2-(3,4-dimethoxyphenyl)-3-methylbutanenitrile
Smiles: N#CC(c1ccc(c(c1)OC)OC)C(C)C

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Molecular Weight: 219.28
Empirical Formula: C13H17NO2

Physical State: Dry powder
Available Amount: 1024 mg

Lipinsky:
logP: 2.412
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 1

     

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