COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL086177
Chemical Name: 3-(azepan-1-ylmethyl)-6-(1-benzofuran-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: C1CCCN(CC1)Cc1nnc2n1nc(s2)c1cc2c(o1)cccc2

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Molecular Weight: 353.45
Empirical Formula: C18H19N5OS

Physical State: Dry powder
Available Amount: 398 mg

Lipinsky:
logP: 4.607
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 87
Number of rings: 5

     

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