COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK344852
Chemical Name: N-{[2-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl}-2-nitrobenzamide
Smiles: S=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1ccccc1N1CCN(CC1)C(=O)C

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Molecular Weight: 427.48
Empirical Formula: C20H21N5O4S

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 1.022
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 142
Number of rings: 3

     

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