COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL392575
Chemical Name: (2E)-3-(3,4,5-trimethoxyphenyl)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Smiles: COc1c(OC)cc(cc1OC)/C=C/C(=O)c1c(C)nn(c1C)C

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Molecular Weight: 330.38
Empirical Formula: C18H22N2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.891
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 62
Number of rings: 2

     

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