COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047437
Chemical Name: 2-[(E)-(2-{[(4,5-diphenyl-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(n1c1ccccc1)c1ccccc1

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Molecular Weight: 473.56
Empirical Formula: C25H23N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.44
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 131
Number of rings: 4

     

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