COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416072
Chemical Name: ethyl(5Z)-5-[5-bromo-2-(prop-2-yn-1-yloxy)benzylidene]-2-{[(2-chlorophenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(S/C(=C\c2cc(Br)ccc2OCC#C)/C1=O)NC(=O)c1ccccc1Cl

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Molecular Weight: 546.83
Empirical Formula: C24H17BrClNO5S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 5.328
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 3

     

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