COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511148
Chemical Name: 3-[(methylsulfanyl)methyl]-6-(3,4,5-triethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: CSCc1nnc2n1nc(s2)c1cc(OCC)c(c(c1)OCC)OCC

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Molecular Weight: 394.52
Empirical Formula: C17H22N4O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.142
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 3

     

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