COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511103
Chemical Name: 3-[(tert-butylsulfanyl)methyl]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: CC(SCc1nnc2n1nc(s2)c1ccc2c(c1)OCCO2)(C)C

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Molecular Weight: 362.48
Empirical Formula: C16H18N4O2S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.753
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 4

     

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