COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK801738
Chemical Name: ethyl(2Z)-cyano(2,2-dimethyltetrahydro-4H-pyran-4-ylidene)ethanoate
Smiles: CCOC(=O)/C(=C\1/CCOC(C1)(C)C)/C#N

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Molecular Weight: 223.27
Empirical Formula: C12H17NO3

Physical State: Dry powder
Available Amount: 1012 mg

Lipinsky:
logP: 1.821
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 1

     

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