COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK862374
Chemical Name: 3-(5,5-dimethyl-1,3-dioxan-2-yl)benzonitrile
Smiles: N#Cc1cccc(c1)C1OCC(CO1)(C)C

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Molecular Weight: 217.27
Empirical Formula: C13H15NO2

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 2.378
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 2

     

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