COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079951
Chemical Name: 2-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)Cn1nc2n(c1=O)c(nc(c2)C)N1CCc2c(C1)cccc2)C

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Molecular Weight: 456.55
Empirical Formula: C26H28N6O2

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 2.598
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 80
Number of rings: 5

     

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