COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL509636
Chemical Name: 3-[(benzylsulfanyl)methyl]-6-[(2-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1ccccc1OCc1nn2c(s1)nnc2CSCc1ccccc1

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Molecular Weight: 398.51
Empirical Formula: C19H18N4O2S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.45
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 4

     

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