COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564953
Chemical Name: 5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-(4-chlorophenyl)-6-hydroxy-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: COc1cc2c(cc1OC)CCN(C2c1c(O)[nH]c(=S)n(c1=O)c1ccc(cc1)Cl)C(=O)C

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Molecular Weight: 487.96
Empirical Formula: C23H22ClN3O5S

Physical State: Liquid
Available Amount: 55 mg

Lipinsky:
logP: 3.807
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 123
Number of rings: 4

     

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