COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555871
Chemical Name: N'-[(1E)-1-(2,4-dimethoxyphenyl)ethylidene]-2-{[4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(c(c1)OC)/C(=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)[N+](=O)[O-])/C

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Molecular Weight: 470.51
Empirical Formula: C21H22N6O5S

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: 3.704
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 161
Number of rings: 3

     

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