COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079913
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-ethyl-N-(3-methylphenyl)acetamide
Smiles: CCN(C(=O)Cn1nc2n(c1=O)c(nc(c2)C)N1CCc2c(C1)cccc2)c1cccc(c1)C

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Molecular Weight: 456.55
Empirical Formula: C26H28N6O2

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 2.125
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 71
Number of rings: 5

     

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