COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL506762
Chemical Name: 6-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-3-[1-(methylsulfonyl)piperidin-4-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(/C=C/c2nn3c(s2)nnc3C2CCN(CC2)S(=O)(=O)C)ccc1OC

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Molecular Weight: 449.55
Empirical Formula: C19H23N5O4S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.183
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 135
Number of rings: 4

     

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