COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065478
Chemical Name: 1-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-[(4-methylphenyl)sulfonyl]piperazine
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[N+](=O)[O-]

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Molecular Weight: 455.54
Empirical Formula: C22H25N5O4S

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 4.986
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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