COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054355
Chemical Name: 5-{[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-3-ium-2-yl)ethenyl]amino}-2-hydroxybenzoate
Smiles: N#C/C(=C\Nc1ccc(c(c1)C(=O)[O-])O)/c1scc([nH+]1)c1ccccc1

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Molecular Weight: 363.4
Empirical Formula: C19H13N3O3S

Physical State: Dry powder
Available Amount: 219 mg

Lipinsky:
logP: 4.537
Rotatable bonds: 2
H-donors: 3
H-acceptors: 3
PSA: 138
Number of rings: 3

     

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