COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017894
Chemical Name: 3-benzyl-6-[(E)-2-(3,4-dimethoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(/C=C/c2nn3c(s2)nnc3Cc2ccccc2)ccc1OC

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Molecular Weight: 378.45
Empirical Formula: C20H18N4O2S

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 4.859
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 89
Number of rings: 4

     

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