COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295858
Chemical Name: ethyl5-({(Z)-[1-(3-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl

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Molecular Weight: 458.88
Empirical Formula: C20H15ClN4O5S

Physical State: Dry powder
Available Amount: 218 mg

Lipinsky:
logP: 3.498
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 156
Number of rings: 3

     

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