COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK640772
Chemical Name: 3-[(1,3-benzodioxol-5-yloxy)methyl]-6-(4-chlorobenzyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Clc1ccc(cc1)Cc1sc2n(n1)c(nn2)COc1ccc2c(c1)OCO2

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Molecular Weight: 400.85
Empirical Formula: C18H13ClN4O3S

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 4.372
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 99
Number of rings: 5

     

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