COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047930
Chemical Name: N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C2CCCCC2)c2ccc(cc2)C)cc(c1O)Br

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Molecular Weight: 558.5
Empirical Formula: C25H28BrN5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.223
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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