COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041675
Chemical Name: 2-(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-2-yl)benzoate
Smiles: [O-]C(=O)c1ccccc1c1nc2n([nH+]1)cnc1c2c2CCCCc2s1

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Molecular Weight: 350.4
Empirical Formula: C18H14N4O2S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.974
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 112
Number of rings: 5

     

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