Karbamazepin

Karbamazepin
Klinički podaci
Prodajno imeApo-Carbamazepine, Atretol, Biston, Calepsin
Drugs.comMonografija
Način primeneOralno
Farmakokinetički podaci
Poluvreme eliminacije25-65 h
IzlučivanjeRenalno 72%
Identifikatori
CAS broj298-46-4 ДаY
ATC kodN03AF01 (WHO)
PubChemCID 2554
DrugBankDB00564 ДаY
ChemSpider2457 ДаY
KEGGC06868 ДаY
ChEBICHEBI:3387 ДаY
ChEMBLCHEMBL108 ДаY
Hemijski podaci
FormulaC15H12N2O
Molarna masa236,269
  • NC(=O)N1C2=CC=CC=C2C=CC2=CC=CC=C12
  • InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18) ДаY
  • Key:FFGPTBGBLSHEPO-UHFFFAOYSA-N ДаY
Fizički podaci
Tačka topljenja1.902 °C (3.456 °F)

Karbamazepin je organsko jedinjenje, koje sadrži 15 atoma ugljenika i ima molekulsku masu od 236,269 Da.[1][2][3][4]

Osobine

Osobina Vrednost
Broj akceptora vodonika 1
Broj donora vodonika 1
Broj rotacionih veza 0
Particioni koeficijent[5] (ALogP) 2,7
Rastvorljivost[6] (logS, log(mol/L)) -3,8
Polarna površina[7] (PSA, Å2) 46,3

Reference

  1. ^ Staines AG, Coughtrie MW, Burchell B: N-glucuronidation of carbamazepine in human tissues is mediated by UGT2B7. J Pharmacol Exp Ther. 2004 Dec;311(3):1131-7. Epub 2004 Aug 3. PMID 15292462
  2. ^ Sisodiya SM, Goldstein DB: Drug resistance in epilepsy: more twists in the tale. Epilepsia. 2007 Dec;48(12):2369-70. PMID 18088268
  3. ^ 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. PMC 3013709Слободан приступ. PMID 21059682. doi:10.1093/nar/gkq1126. 
  4. ^ David S. Wishart; Craig Knox; An Chi Guo; Dean Cheng; Savita Shrivastava; Dan Tzur; Bijaya Gautam; Murtaza Hassanali (2008). „DrugBank: a knowledgebase for drugs, drug actions and drug targets”. Nucleic acids research. 36 (Database issue): D901—6. PMC 2238889Слободан приступ. PMID 18048412. doi:10.1093/nar/gkm958. 
  5. ^ Ghose, A.K.; Viswanadhan V.N. & 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. 
  6. ^ 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. PMID 11749573. doi:10.1021/ci000392t. 
  7. ^ 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. PMID 11020286. doi:10.1021/jm000942e. 

Literatura

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