mirtazapine

Ligand id: 7241

Name: mirtazapine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 0
Topological polar surface area 19.37
Molecular weight 265.16
XLogP 3.61
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Fernández J, Alonso JM, Andrés JI, Cid JM, Díaz A, Iturrino L, Gil P, Megens A, Sipido VK, Trabanco AA. (2005)
Discovery of new tetracyclic tetrahydrofuran derivatives as potential broad-spectrum psychotropic agents.
J. Med. Chem.48 (6): 1709-12. [PMID:15771415]
2. Kennis LE, Bischoff FP, Mertens CJ, Love CJ, Van den Keybus FA, Pieters S, Braeken M, Megens AA, Leysen JE. (2000)
New 2-substituted 1,2,3,4-tetrahydrobenzofuro[3,2-c]pyridine having highly active and potent central alpha 2-antagonistic activity as potential antidepressants.
Bioorg. Med. Chem. Lett.10 (1): 71-4. [PMID:10636247]
3. Langham JJ, Cleves AE, Spitzer R, Kirshner D, Jain AN. (2009)
Physical binding pocket induction for affinity prediction.
J. Med. Chem.52 (19): 6107-25. [PMID:19754201]
4. Preston TC, Shelton RC. (2013)
Treatment resistant depression: strategies for primary care.
Curr Psychiatry Rep15 (7): 370. [PMID:23712721]
5. Thase ME. (2013)
Antidepressant combinations: cutting edge psychopharmacology or passing fad?.
Curr Psychiatry Rep15 (10): 403. [PMID:24052267]