COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158372
Chemical Name: ethyl(5Z)-5-[4-(dimethylamino)benzylidene]-2-[(4-methylphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)C)S/C(=C\c2ccc(cc2)N(C)C)/C1=O

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Molecular Weight: 408.52
Empirical Formula: C23H24N2O3S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 5.786
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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