COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK249994
Chemical Name: 3-({3-chloro-5-methoxy-4-[(4-nitrobenzyl)oxy]benzyl}amino)benzoicacid
Smiles: COc1cc(CNc2cccc(c2)C(=O)O)cc(c1OCc1ccc(cc1)[N+](=O)[O-])Cl

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Molecular Weight: 442.86
Empirical Formula: C22H19ClN2O6

Physical State: Dry powder
Available Amount: 161 mg

Lipinsky:
logP: 5.055
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 113
Number of rings: 3

     

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