COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380540
Chemical Name: ethyl(5Z)-5-{4-[(3-fluorobenzyl)oxy]benzylidene}-2-{[(2-methylphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(S/C(=C\c2ccc(cc2)OCc2cccc(c2)F)/C1=O)NC(=O)c1ccccc1C

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Molecular Weight: 517.58
Empirical Formula: C29H24FNO5S

Physical State: Dry powder
Available Amount: 493 mg

Lipinsky:
logP: 6.132
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 4

     

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