COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK787855
Chemical Name: 3-(1,3-benzodioxol-5-yl)-6-(4-methoxybenzyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)Cc1nn2c(s1)nnc2c1ccc2c(c1)OCO2

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Molecular Weight: 366.4
Empirical Formula: C18H14N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.816
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 99
Number of rings: 5

     

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