COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK062895
Chemical Name: ethyl(5Z)-5-[4-(diethylamino)benzylidene]-4-oxo-2-[(phenylcarbonyl)amino]-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(S/C(=C\c2ccc(cc2)N(CC)CC)/C1=O)NC(=O)c1ccccc1

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Molecular Weight: 450.56
Empirical Formula: C25H26N2O4S

Physical State: Dry powder
Available Amount: 297 mg

Lipinsky:
logP: 5.589
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 101
Number of rings: 3

     

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