COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL028977
Chemical Name: ethyl(2E)-2-cyano-3-(2-ethyl-2-methyltetrahydro-2H-pyran-4-yl)prop-2-enoate
Smiles: CCOC(=O)/C(=C/C1CCOC(C1)(C)CC)/C#N

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Molecular Weight: 251.33
Empirical Formula: C14H21NO3

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 2.014
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 1

     

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