COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL306809
Chemical Name: dimethyl5-{[([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=O)CSc2nnc3n2cccc3)cc(c1)C(=O)OC

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Molecular Weight: 400.42
Empirical Formula: C18H16N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 4.004
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 137
Number of rings: 3

     

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