Cefminoks

Cefminoks
Klinički podaci

Drugs.com	Monografija
Identifikatori
CAS broj	84305-41-9^Y
ATC kod	J01DC12 (WHO)
PubChem	CID 71141
ChemSpider	64286^Y
UNII	PW08Y13465^Y
KEGG	D07642^Y
Hemijski podaci
Formula	C₁₆H₂₁N₇O₇S₃
Molarna masa	519,576
SMILES CO[C@@]1(\N=C(/O)\CSC[C@@H](N)C(=O)O)[C@H]2SCC(=C(N2C1=O)C(=O)O)CSc3nnnn3C
InChI InChI=1S/C16H21N7O7S3/c1-22-15(19-20-21-22)33-4-7-3-32-14-16(30-2,13(29)23(14)10(7)12(27)28)18-9(24)6-31-5-8(17)11(25)26/h8,14H,3-6,17H2,1-2H3,(H,18,24)(H,25,26)(H,27,28)/t8-,14-,16-/m1/s1^Y Key:JSDXOWVAHXDYCU-UQJDEFAZSA-N^Y

Cefminoks je organsko jedinjenje, koje sadrži 16 atoma ugljenika i ima molekulsku masu od 519,576 Da.

Osobine

Osobina	Vrednost
Broj akceptora vodonika	15
Broj donora vodonika	4
Broj rotacionih veza	11
Particioni koeficijent^[1] (ALogP)	-3,4
Rastvorljivost^[2] (logS, log(mol/L))	-3,1
Polarna površina^[3] (PSA, Å²)	282,2

^ 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 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.
^ 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.

Hardman JG, Limbird LE, Gilman AG (2001). Goodman & Gilman's The Pharmacological Basis of Therapeutics (10. изд.). New York: McGraw-Hill. ISBN 0071354697. doi:10.1036/0071422803.
Thomas L. Lemke; David A. Williams, ур. (2007). Foye's Principles of Medicinal Chemistry (6. изд.). Baltimore: Lippincott Willams & Wilkins. ISBN 0781768799.