COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK100029
Chemical Name: ethyl(5Z)-5-[4-(dimethylamino)benzylidene]-2-{[(4-methoxyphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)c2ccc(cc2)OC)S/C(=C\c2ccc(cc2)N(C)C)/C1=O

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Molecular Weight: 452.53
Empirical Formula: C24H24N2O5S

Available Amount: 0 mg

Lipinsky:
logP: 4.693
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 3

     

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