COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL506763
Chemical Name: 3-[1-(methylsulfonyl)piperidin-4-yl]-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(/C=C/c2nn3c(s2)nnc3C2CCN(CC2)S(=O)(=O)C)cc(c1OC)OC

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Molecular Weight: 479.58
Empirical Formula: C20H25N5O5S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.945
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 144
Number of rings: 4

     

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