COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526078
Chemical Name: ethyl(2E)-3-(5-amino-3,3-dimethyl-3,4-dihydro-2H-pyran-6-yl)-2-cyanoprop-2-enoate
Smiles: CCOC(=O)/C(=C/C1=C(N)CC(CO1)(C)C)/C#N

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Molecular Weight: 250.3
Empirical Formula: C13H18N2O3

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 0.714
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 85
Number of rings: 1

     

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