COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455216
Chemical Name: 4-[(4-chlorophenyl)sulfonyl]-N-(3-nitrophenyl)piperazine-1-carbothioamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=S)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 440.93
Empirical Formula: C17H17ClN4O4S2

Physical State: Dry powder
Available Amount: 415 mg

Lipinsky:
logP: 3.462
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 138
Number of rings: 3

     

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