COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149628
Chemical Name: 2-{(E)-[2-({[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-ethoxyphenolate
Smiles: CCOc1cccc(c1[O-])/C=N/NC(=O)CSc1[nH+]nc(n1CC)c1ccc(c(c1)OC)OC

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Molecular Weight: 485.56
Empirical Formula: C23H27N5O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.02
Rotatable bonds: 11
H-donors: 2
H-acceptors: 5
PSA: 149
Number of rings: 3

     

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