Flufenaminska kiselina

Flufenaminska kiselina je organsko jedinjenje, koje sadrži 14 atoma ugljenika i ima molekulsku masu od 281,230 Da.[1][2]

Flufenaminska kiselina
Klinički podaci
Drugs.comacid.html Monografija
Identifikatori
CAS broj530-78-9 ДаY
ATC kodM01AG03 (WHO)
PubChemCID 3371
IUPHAR/BPS2447
DrugBankDB02266 ДаY
ChemSpider3254 ДаY
KEGGC13038 ДаY
ChEBICHEBI:31619 ДаY
ChEMBLCHEMBL23588 ДаY
Hemijski podaci
FormulaC14H10F3NO2
Molarna masa281,230
  • OC(=O)C1=CC=CC=C1NC1=CC(=CC=C1)C(F)(F)F
  • InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20) ДаY
  • Key:LPEPZBJOKDYZAD-UHFFFAOYSA-N ДаY
Fizički podaci
Tačka topljenja1.335 °C (2.435 °F)

Osobine

uredi
Osobina Vrednost
Broj akceptora vodonika 3
Broj donora vodonika 2
Broj rotacionih veza 4
Particioni koeficijent[3] (ALogP) 4,0
Rastvorljivost[4] (logS, log(mol/L)) -4,8
Polarna površina[5] (PSA, Å2) 49,3

Reference

uredi
  1. ^ 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 3013709 . PMID 21059682. doi:10.1093/nar/gkq1126. 
  2. ^ 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 2238889 . PMID 18048412. doi:10.1093/nar/gkm958. 
  3. ^ 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. 
  4. ^ 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. 
  5. ^ 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

uredi

Spoljašnje veze

uredi


 Molimo Vas, obratite pažnju na važno upozorenje
u vezi sa temama iz oblasti medicine (zdravlja).