COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK372668
Chemical Name: N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-(2,4,5-trichlorophenoxy)acetohydrazide
Smiles: O=C(COc1cc(Cl)c(cc1Cl)Cl)N/N=C/c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 446.63
Empirical Formula: C16H10Cl3N3O6

Physical State: Dry powder
Available Amount: 580 mg

Lipinsky:
logP: 5.387
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 114
Number of rings: 3

     

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