COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK022650
Chemical Name: N'-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 553
Empirical Formula: C25H21ClN6O5S

Physical State: Dry powder
Available Amount: 406 mg

Lipinsky:
logP: 7.651
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 161
Number of rings: 4

     

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