COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401137
Chemical Name: 3-[(2E)-3-(1-ethyl-1H-pyrazol-5-yl)prop-2-enoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
Smiles: CCn1nccc1/C=C/C(=O)c1c(O)cc(oc1=O)C

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Molecular Weight: 274.28
Empirical Formula: C14H14N2O4

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 0.87
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 81
Number of rings: 2

     

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