COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK415785
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-1-(3,5-dimethyl-1H-pyrazol-1-yl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)n2nc(cc2C)C)ccc1OC

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Molecular Weight: 286.33
Empirical Formula: C16H18N2O3

Physical State: Dry powder
Available Amount: 700 mg

Lipinsky:
logP: 3.464
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 53
Number of rings: 2

     

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