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Metoklopramid

Izvor: Wikipedija
Metoklopramid
Klinički podaci
Robne markeApo-Metoclop, Cerucal, Clopra, Clopra-Yellow
AHFS/Drugs.comMonografija
Identifikatori
CAS broj364-62-5
ATC kodA03FA01
PubChem[1][2]4168
DrugBankDB01233
ChemSpider[3]4024
KEGG[4]C07868 DaY
ChEBICHEBI:107736 DaY
ChEMBL[5]CHEMBL86 DaY
Hemijski podaci
FormulaC14H22ClN3O2 
Mol. masa299,796
SMILESeMolekuli &PubHem
InChI
InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)
Key: TTWJBBZEZQICBI-UHFFFAOYSA-N DaY
Fizički podaci
Tačka topljenja147.25 °C (297 °F)
Farmakokinetički podaci
Poluvreme eliminacije5-6 h
IzlučivanjeRenalno, 85%
Farmakoinformacioni podaci
Trudnoća?
Pravni status
Način primeneIntramaskularno, intravenozno, oralno

Metoklopramid jeorgansko jedinjenje, koje sadrži 14atomaugljenika i imamolekulsku masu od 299,796Da.[6][7][8][9]

Osobine

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OsobinaVrednost
Broj akceptora vodonika4
Broj donora vodonika2
Broj rotacionih veza7
Particioni koeficijent[10] (ALogP)1,8
Rastvorljivost[11] (logS, log(mol/L))-3,3
Polarna površina[12] (PSA,Å2)67,6

Reference

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  1. Li Q, Cheng T, Wang Y, Bryant SH (2010). „PubChem as a public resource for drug discovery.”. Drug Discov Today 15 (23-24): 1052-7. DOI:10.1016/j.drudis.2010.10.003. PMID 20970519.  edit
  2. Evan E. Bolton, Yanli Wang, Paul A. Thiessen, Stephen H. Bryant (2008). „Chapter 12 PubChem: Integrated Platform of Small Molecules and Biological Activities”. Annual Reports in Computational Chemistry 4: 217-241. DOI:10.1016/S1574-1400(08)00012-1. 
  3. Hettne KM, Williams AJ, van Mulligen EM, Kleinjans J, Tkachenko V, Kors JA. (2010). „Automatic vs. manual curation of a multi-source chemical dictionary: the impact on text mining”. J Cheminform 2 (1): 3. DOI:10.1186/1758-2946-2-3. PMID 20331846.  edit
  4. Joanne Wixon, Douglas Kell (2000). „Website Review: The Kyoto Encyclopedia of Genes and Genomes — KEGG”. Yeast 17 (1): 48–55. DOI:10.1002/(SICI)1097-0061(200004)17:1<48::AID-YEA2>3.0.CO;2-H. 
  5. Gaulton A, Bellis LJ, Bento AP, Chambers J, Davies M, Hersey A, Light Y, McGlinchey S, Michalovich D, Al-Lazikani B, Overington JP. (2012). „ChEMBL: a large-scale bioactivity database for drug discovery”. Nucleic Acids Res 40 (Database issue): D1100-7. DOI:10.1093/nar/gkr777. PMID 21948594.  edit
  6. JUSTIN-BESANCON L, LAVILLE C: [ANTIEMETIC ACTION OF METOCLOPRAMIDE WITH RESPECT TO APOMORPHINE AND HYDERGINE.] C R Seances Soc Biol Fil. 1964;158:723-7.PMID14186927
  7. Tonini M, Candura SM, Messori E, Rizzi CA: Therapeutic potential of drugs with mixed 5-HT4 agonist/5-HT3 antagonist action in the control of emesis. Pharmacol Res. 1995 May;31(5):257-60.PMID7479521
  8. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS (2011). „DrugBank 3.0: a comprehensive resource for omics research on drugs”. Nucleic Acids Res. 39 (Database issue): D1035-41. DOI:10.1093/nar/gkq1126. PMC 3013709. PMID 21059682. 
  9. David S. Wishart, Craig Knox, An Chi Guo, Dean Cheng, Savita Shrivastava, Dan Tzur, Bijaya Gautam, and Murtaza Hassanali (2008). „DrugBank: a knowledgebase for drugs, drug actions and drug targets”. Nucleic Acids Res 36 (Database issue): D901-6. DOI:10.1093/nar/gkm958. PMC 2238889. PMID 18048412. 
  10. Ghose, A.K., Viswanadhan V.N., and Wendoloski, J.J. (1998). „Prediction of Hydrophobic (Lipophilic) Properties of Small Organic Molecules Using Fragment Methods: An Analysis of AlogP and CLogP Methods”. J. Phys. Chem. A 102: 3762-3772. DOI:10.1021/jp980230o. 
  11. Tetko IV, Tanchuk VY, Kasheva TN, Villa AE. (2001). „Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices”. Chem Inf. Comput. Sci. 41: 1488-1493. DOI:10.1021/ci000392t. PMID 11749573. 
  12. Ertl P., Rohde B., Selzer P. (2000). „Fast calculation of molecular polar surface area as a sum of fragment based contributions and its application to the prediction of drug transport properties”. J. Med. Chem. 43: 3714-3717. DOI:10.1021/jm000942e. PMID 11020286. 

Literatura

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Vanjske veze

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Portal Medicina
Portal Hemija
Metoklopramid naWikimedijinoj ostavi
5-HT3 Antagonisti
CB1Agonisti (Kanabinoidi)
D2/D3 Antagonisti
H1 Antagonisti (Antihistamini)
mAChAntagonisti (Antiholini)
q1 Antagonisti
Drugi
Izvor:https://sh.wikipedia.org/w/index.php?title=Metoklopramid&oldid=42274317
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