COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172437
Chemical Name: 1-(2-chloro-4-nitrophenyl)-4-[(3,4-dimethoxyphenyl)sulfonyl]piperazine
Smiles: COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 441.89
Empirical Formula: C18H20ClN3O6S

Physical State: Dry powder
Available Amount: 187 mg

Lipinsky:
logP: 4.995
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 113
Number of rings: 3

     

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