COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK635971
Chemical Name: 3-[(1,3-benzodioxol-5-yloxy)methyl]-6-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Brc1ccccc1c1nn2c(s1)nnc2COc1ccc2c(c1)OCO2

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Molecular Weight: 431.27
Empirical Formula: C17H11BrN4O3S

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 4.54
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 99
Number of rings: 5

     

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