COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307529
Chemical Name: (2E)-1-(2,5-dimethoxyphenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Smiles: COc1ccc(c(c1)C(=O)/C=C/c1c(C)nn(c1C)C)OC

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Molecular Weight: 300.36
Empirical Formula: C17H20N2O3

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 2.828
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 53
Number of rings: 2

     

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