COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK084724
Chemical Name: ethyl(5Z)-5-[4-(dimethylamino)benzylidene]-2-(naphthalen-1-ylamino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(S/C(=C\c2ccc(cc2)N(C)C)/C1=O)Nc1cccc2c1cccc2

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Molecular Weight: 444.55
Empirical Formula: C26H24N2O3S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 6.557
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 4

     

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