Abametin

Abametin je organsko jedinjenje, koje sadrži 95 atoma ugljenika i ima molekulsku masu od 1732,127 Da.

Abametin

Klinički podaci
AHFS/Drugs.com	Monografija
Identifikatori
CAS broj	71751-41-2
ATCvet kod	QP54AA02
ChemSpider[1]	8095964
UNII	5U8924T11H Y
KEGG[2]	D02777 Y
ChEMBL[3]	CHEMBL1630577 Y
Hemijski podaci
Formula	C95H142O28
Mol. masa	1732,127
SMILES	eMolekuli & PubHem
Sinonimi	avermectin B1 (CAS name), MK-936
Farmakoinformacioni podaci
Trudnoća	?
Pravni status

Osobine

Osobina	Vrednost
Broj akceptora vodonika	28
Broj donora vodonika	6
Broj rotacionih veza	15
Particioni koeficijent[4] (ALogP)	8,9
Rastvorljivost[5] (logS, log(mol/L))	-17,5
Polarna površina[6] (PSA, Å2)	340,1

Reference

1. 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
2. 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.
3. 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
4. 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.
5. 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.
6. 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

• Hardman JG, Limbird LE, Gilman AG. (2001). Goodman & Gilman's The Pharmacological Basis of Therapeutics (10 izd.). New York: McGraw-Hill. DOI:10.1036/0071422803. ISBN 0-07-135469-7.
• Thomas L. Lemke, David A. Williams, ur. (2007). Foye's Principles of Medicinal Chemistry (6 izd.). Baltimore: Lippincott Willams & Wilkins. ISBN 0-7817-6879-9.

Spoljašnje veze

	Portal Medicina
	Portal Hemija

Abametin na Wikimedijinoj ostavi

• Abamectin