reactive blue-2

Ligand id: 1739

Name: reactive blue-2

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 18
Hydrogen bond donors 7
Rotatable bonds 9
Topological polar surface area 323.17
Molecular weight 773.01
XLogP 3.33
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

References
1. Bogdanov YD, Wildman SS, Clements MP, King BF, Burnstock G. (1998)
Molecular cloning and characterization of rat P2Y4 nucleotide receptor.
Br. J. Pharmacol., 124 (3): 428-30. [PMID:9647463]
2. Brunschweiger A, Müller CE. (2006)
P2 receptors activated by uracil nucleotides--an update.
Curr. Med. Chem., 13 (3): 289-312. [PMID:16475938]
3. Communi D, Robaye B, Boeynaems JM. (1999)
Pharmacological characterization of the human P2Y11 receptor.
Br. J. Pharmacol., 128 (6): 1199-206. [PMID:10578132]
4. Janssens R, Paindavoine P, Parmentier M, Boeynaems JM. (1999)
Human P2Y2 receptor polymorphism: identification and pharmacological characterization of two allelic variants.
Br. J. Pharmacol., 127 (3): 709-16. [PMID:10401562]
5. Marteau F, Le Poul E, Communi D, Communi D, Labouret C, Savi P, Boeynaems JM, Gonzalez NS. (2003)
Pharmacological characterization of the human P2Y13 receptor.
Mol. Pharmacol., 64 (1): 104-12. [PMID:12815166]
6. von Kügelgen I, Hoffmann K. (2016)
Pharmacology and structure of P2Y receptors.
Neuropharmacology, 104: 50-61. [PMID:26519900]