COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080947
Chemical Name: ethyl(5Z)-2-[(4-chlorophenyl)amino]-4-oxo-5-(pyridin-4-ylmethylidene)-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)Cl)S/C(=C\c2ccncc2)/C1=O

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Molecular Weight: 386.86
Empirical Formula: C19H15ClN2O3S

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 4.318
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 3

     

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