COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK376318
Chemical Name: (2E)-3-(4-tert-butylphenyl)-1-(3,5-dimethyl-1H-pyrazol-1-yl)prop-2-en-1-one
Smiles: Cc1nn(c(c1)C)C(=O)/C=C/c1ccc(cc1)C(C)(C)C

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Molecular Weight: 282.39
Empirical Formula: C18H22N2O

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 5.326
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 34
Number of rings: 2

     

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