COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416069
Chemical Name: ethyl(5Z)-2-{[(4-methylphenyl)carbonyl]amino}-4-oxo-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)c2ccc(cc2)C)S/C(=C\c2ccc(o2)c2cccc(c2)C(F)(F)F)/C1=O

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Molecular Weight: 527.52
Empirical Formula: C27H20F3NO5S

Physical State: Dry powder
Available Amount: 212 mg

Lipinsky:
logP: 6.861
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 4

     

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