Prolintan

Prolintan

Klinički podaci
Drugs.com	Monografija
Identifikatori
CAS broj	493-92-5^Y
ATC kod	N06BX14 (WHO)
PubChem	CID 14592
ChemSpider	13930^Y
UNII	EM4YZW677H^Y
Hemijski podaci
Formula	C15H23N
Molarna masa	217,350
SMILES CCCC(Cc1ccccc1)N2CCCC2
InChI InChI=1S/C15H23N/c1-2-8-15(16-11-6-7-12-16)13-14-9-4-3-5-10-14/h3-5,9-10,15H,2,6-8,11-13H2,1H3^Y Key:OJCPSBCUMRIPFL-UHFFFAOYSA-N^Y

Prolintan je organsko jedinjenje, koje sadrži 15 atoma ugljenika i ima molekulsku masu od 217,350 Da.

Osobine

Osobina	Vrednost
Broj akceptora vodonika	1
Broj donora vodonika	0
Broj rotacionih veza	5
Particioni koeficijent[1] (ALogP)	4,0
Rastvorljivost[2] (logS, log(mol/L))	-4,0
Polarna površina[3] (PSA, Å^2)	3,2

Reference

1. 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. 
2. 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. 
3. 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

• 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. 

Spoljašnje veze

• Prolintane

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