COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183016
Chemical Name: 3-[(2-chloro-4-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}-6-ethoxyphenoxy)methyl]benzoicacid
Smiles: CCOc1cc(/C=C(/C(=O)NCc2ccco2)\C#N)cc(c1OCc1cccc(c1)C(=O)O)Cl

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Molecular Weight: 480.9
Empirical Formula: C25H21ClN2O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.736
Rotatable bonds: 11
H-donors: 2
H-acceptors: 6
PSA: 121
Number of rings: 3

     

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