COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044537
Chemical Name: 4-[(E)-{2-[(1,3-benzothiazol-3-ium-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]-2-ethoxyphenolate
Smiles: CCOc1cc(/C=N/NC(=O)CSc2sc3c([nH+]2)cccc3)ccc1[O-]

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Molecular Weight: 387.48
Empirical Formula: C18H17N3O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.161
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 141
Number of rings: 3

     

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