COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL558887
Chemical Name: 3-[(propan-2-ylsulfanyl)methyl]-6-(3,4,5-triethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: CCOc1cc(cc(c1OCC)OCC)c1nn2c(s1)nnc2CSC(C)C

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Molecular Weight: 422.57
Empirical Formula: C19H26N4O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.021
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 3

     

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