COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149590
Chemical Name: 2-ethoxy-4-{(E)-[2-({[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Smiles: CCOc1cc(/C=N/NC(=O)CSc2[nH+]nc(n2CC)c2ccc(cc2)C)ccc1[O-]

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Molecular Weight: 439.54
Empirical Formula: C22H25N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.917
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 131
Number of rings: 3

     

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