COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171005
Chemical Name: N'-[(E)-(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-2-[(5-{[(4-chloro-2-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccccc1)CNc1ccc(cc1C)Cl)N/N=C/c1cc(Cl)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 586.46
Empirical Formula: C25H21Cl2N7O4S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 8.808
Rotatable bonds: 8
H-donors: 3
H-acceptors: 4
PSA: 175
Number of rings: 4

     

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