COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL104326
Chemical Name: 4-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-(4-chlorophenyl)isoquinolin-1(2H)-one
Smiles: Clc1ccc(cc1)n1cc(c2onc(n2)c2ccc3c(c2)OCO3)c2c(c1=O)cccc2

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Molecular Weight: 443.85
Empirical Formula: C24H14ClN3O4

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 5.366
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 77
Number of rings: 6

     

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