COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK350867
Chemical Name: 3-(1,3-benzodioxol-5-yl)-3-oxopropanenitrile
Smiles: N#CCC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 189.17
Empirical Formula: C10H7NO3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 0.382
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 2

     

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