COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526917
Chemical Name: 3-({5-[4-(2-chlorophenyl)piperazin-1-yl]-2,4-dinitrophenyl}amino)benzoicacid
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c(cc1N1CCN(CC1)c1ccccc1Cl)Nc1cccc(c1)C(=O)O

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Molecular Weight: 497.89
Empirical Formula: C23H20ClN5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.133
Rotatable bonds: 2
H-donors: 2
H-acceptors: 6
PSA: 147
Number of rings: 4

     

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