COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL134221
Chemical Name: ethyl4-[4-amino-5-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-2-thioxo-1,3-thiazol-3(2H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(=S)sc(c1N)C(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 439.56
Empirical Formula: C22H21N3O3S2

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 2.545
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 133
Number of rings: 4

     

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