COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL082341
Chemical Name: 6-{[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-3-(3-chlorobenzyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Smiles: Clc1cccc(c1)Cn1nnc2c1ncn(c2=O)Cc1onc(n1)c1ccc2c(c1)OCO2

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Molecular Weight: 463.84
Empirical Formula: C21H14ClN7O4

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 3.146
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 120
Number of rings: 6

     

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