COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL397222
Chemical Name: (2E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(1-ethyl-5-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Smiles: CCn1ncc(c1C)C(=O)/C=C/c1cc(Br)c(c(c1)OC)O

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Molecular Weight: 365.23
Empirical Formula: C16H17BrN2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.771
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 64
Number of rings: 2

     

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