COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171417
Chemical Name: N'-[(E)-(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-2-{[5-{[(4-methylphenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: C=CCn1c(SCC(=O)N/N=C/c2cc(Cl)cc(c2O)[N+](=O)[O-])nnc1CNc1ccc(cc1)C

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Molecular Weight: 515.98
Empirical Formula: C22H22ClN7O4S

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 6.69
Rotatable bonds: 10
H-donors: 3
H-acceptors: 4
PSA: 175
Number of rings: 3

     

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