Fenoksimetilpenicilin

Fenoksimetilpenicilin
Klinički podaci
Prodajno ime	Acipen V, Apopen, Beepen-Vk, Beromycin
Drugs.com	Monografija
Način primene	Oralno
Farmakokinetički podaci
Poluvreme eliminacije	30 - 40 minuta
Identifikatori
CAS broj	87-08-1
ATC kod	J01CE02 (WHO), J01CE10
PubChem	CID 6869
DrugBank	DB00417
ChemSpider	6607
KEGG	C08126
ChEBI	CHEBI:27446
ChEMBL	CHEMBL615
Hemijski podaci
Formula	C16H18N2O5S
Molarna masa	350,390
	SMILES [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)COC1=CC=CC=C1)C(O)=O; ;
	InChI InChI=1S/C16H18N2O5S/c1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1 ; Key:BPLBGHOLXOTWMN-MBNYWOFBSA-N ;
Fizički podaci
Tačka topljenja	120—128 °C (248—262 °F)

Fenoksimetilpenicilin je organsko jedinjenje, koje sadrži 16 atoma ugljenika i ima molekulsku masu od 350,390 Da.^[1]^[2]^[3]^[4]

Osobine

Osobina	Vrednost
Broj akceptora vodonika	6
Broj donora vodonika	2
Broj rotacionih veza	5
Particioni koeficijent^[5] (ALogP)	0,9
Rastvorljivost^[6] (logS, log(mol/L))	-3,0
Polarna površina^[7] (PSA, Å²)	121,2

Reference

^ Centers for Disease Control and Prevention (CDC) (2005). „Inadvertent use of Bicillin C-R to treat syphilis infection--Los Angeles, California, 1999-2004”. MMWR. Morbidity and Mortality Weekly Report. 54 (9): 217—219. PMC 6820132  . PMID 15758893.
^ Gruchalla, R. S.; Pirmohamed, M. (2006). „Clinical practice. Antibiotic allergy”. The New England Journal of Medicine. 354 (6): 601—609. PMID 16467547. doi:10.1056/NEJMcp043986.
^ 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, A. C.; Wishart, D. S. (2011). „DrugBank 3.0: A comprehensive resource for 'omics' research on drugs”. Nucleic Acids Research. 39 (Database issue): D1035—41. PMC 3013709  . PMID 21059682. doi:10.1093/nar/gkq1126.
^ Wishart, D. S.; Knox, C.; Guo, A. C.; Cheng, D.; Shrivastava, S.; Tzur, D.; Gautam, B.; Hassanali, M. (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.
^ 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.
^ Tetko, I. V.; Tanchuk, V. Y.; Kasheva, T. N.; Villa, A. E. (2001). „Estimation of aqueous solubility of chemical compounds using E-state indices”. Journal of Chemical Information and Computer Sciences. 41 (6): 1488—1493. PMID 11749573. doi:10.1021/ci000392t.
^ 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”. Journal of Medicinal Chemistry. 43 (20): 3714—3717. PMID 11020286. doi:10.1021/jm000942e.