COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL391485
Chemical Name: (2Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Smiles: CCn1ncc(c1C)/C=C\C(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 298.34
Empirical Formula: C17H18N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.12
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 53
Number of rings: 3

     

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