COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473295
Chemical Name: 5-bromo-4-{(1E)-2-cyano-3-oxo-3-[(thiophen-2-ylmethyl)amino]prop-1-en-1-yl}-2-ethoxyphenylacetate
Smiles: CCOc1cc(/C=C(/C(=O)NCc2cccs2)\C#N)c(cc1OC(=O)C)Br

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Molecular Weight: 449.33
Empirical Formula: C19H17BrN2O4S

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 3.793
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 2

     

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