COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406596
Chemical Name: 3-(3-methyl-1-benzofuran-2-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)nnc3c2oc3c(c2C)cccc3)cc(c1OC)OC

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Molecular Weight: 448.5
Empirical Formula: C23H20N4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.577
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 112
Number of rings: 5

     

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