COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418817
Chemical Name: (2E)-N-benzyl-2-[5-(4-methylpiperazin-1-yl)-2-nitrobenzylidene]hydrazinecarbothioamide
Smiles: CN1CCN(CC1)c1ccc(c(c1)/C=N/NC(=S)NCc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 412.52
Empirical Formula: C20H24N6O2S

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 3.965
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 120
Number of rings: 3

     

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