COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL104284
Chemical Name: 2-(3,4-dimethylphenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one
Smiles: CSc1ccc(cc1)c1noc(n1)c1cn(c2ccc(c(c2)C)C)c(=O)c2c1cccc2

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Molecular Weight: 439.54
Empirical Formula: C26H21N3O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.125
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 84
Number of rings: 5

     

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