COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374990
Chemical Name: ethyl(5Z)-5-[4-ethoxy-2-methyl-5-(propan-2-yl)benzylidene]-4-oxo-2-[(phenylcarbonyl)amino]-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(S/C(=C\c2cc(C(C)C)c(cc2C)OCC)/C1=O)NC(=O)c1ccccc1

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Molecular Weight: 479.6
Empirical Formula: C27H29NO5S

Physical State: Dry powder
Available Amount: 590 mg

Lipinsky:
logP: 6.295
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 3

     

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