COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK637153
Chemical Name: 3-[(1,3-benzodioxol-5-yloxy)methyl]-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(cc(c1OC)OC)c1nn2c(s1)nnc2COc1ccc2c(c1)OCO2

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Molecular Weight: 442.45
Empirical Formula: C20H18N4O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.38
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 126
Number of rings: 5

     

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