Movatterモバイル変換


[0]ホーム

URL:


Prijeđi na sadržaj
Wikipedija
Pretraga

Debrisokvin

Izvor: Wikipedija
Debrisokvin
Drugi naziviDeclinax, Equitonil, Tendor
Identifikacija
CAS registarski broj1131-64-2 DaY
PubChem[1][2]2966
ChemSpider[3]2860 DaY
DrugBankDB04840
KEGG[4]C13650
ChEBI34665
ChEMBL[5]CHEMBL169901 DaY
ATC codeC02CC04
Jmol-3D slikeSlika 1

NC(=N)N1CCC2=CC=CC=C2C1

InChI=1S/C10H13N3/c11-10(12)13-6-5-8-3-1-2-4-9(8)7-13/h1-4H,5-7H2,(H3,11,12) DaY
Kod: JWPGJSVJDAJRLW-UHFFFAOYSA-N DaY


InChI=1/C10H13N3/c11-10(12)13-6-5-8-3-1-2-4-9(8)7-13/h1-4H,5-7H2,(H3,11,12)

Svojstva
Molekulska formulaC10H13N3
Molarna masa175.23 g mol−1
Tačka topljenja

278-280

 DaY (šta je ovo?)  (verifikuj)

Ukoliko nije drugačije napomenuto, podaci se odnose nastandardno stanje (25 °C, 100 kPa) materijala

Infobox references

Debrisokvin jeorgansko jedinjenje, koje sadrži 10atomaugljenika i imamolekulsku masu od 175,230Da.[6][7]

Osobine

[uredi |uredi kod]
OsobinaVrednost
Broj akceptora vodonika1
Broj donora vodonika2
Broj rotacionih veza1
Particioni koeficijent[8] (ALogP)1,1
Rastvorljivost[9] (logS, log(mol/L))-0,9
Polarna površina[10] (PSA,Å2)53,1

Reference

[uredi |uredi kod]
  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. 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. 
  7. 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. 
  8. 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. 
  9. 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. 
  10. 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

[uredi |uredi kod]

Vanjske veze

[uredi |uredi kod]
Portal Hemija
Debrisokvin naWikimedijinoj ostavi
Simpatolitici
(antagonizirajuα-adrenergičku
vazokonstrikciju)
Centralni
Inhibitori otpuštanja adrenalina
Periferalni
Indirektni
Direktni
Neselektivni α blokator
Drugiantagonisti
dualni (Bosentan) *selektivni (Ambrisentan,Sitaksentan)
Izvor:https://sh.wikipedia.org/w/index.php?title=Debrisokvin&oldid=42281673
Kategorije:

[8]ページ先頭

©2009-2025 Movatter.jp