COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079958
Chemical Name: N-(3-acetylphenyl)-2-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Smiles: O=C(Cn1nc2n(c1=O)c(nc(c2)C)N1CCc2c(C1)cccc2)Nc1cccc(c1)C(=O)C

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Molecular Weight: 456.5
Empirical Formula: C25H24N6O3

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 1.163
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 5

     

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