COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455333
Chemical Name: 4-ethyl-N-(3-nitrophenyl)piperazine-1-carbothioamide
Smiles: CCN1CCN(CC1)C(=S)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 294.38
Empirical Formula: C13H18N4O2S

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 1.849
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 96
Number of rings: 2

     

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