Histamin dihidrohlorid : Osobine, Reference, Literatura, Spoljašnje veze Википедија

Histamin dihidrohlorid

Histamin dihidrohlorid
Klinički podaci

Drugs.com	dihydrochloride.html Monografija
Identifikatori
CAS broj	56-92-8^Y
ATC kod	L03AX14 (WHO)
PubChem	CID 11309913
ChemSpider	5613^Y
Hemijski podaci
Formula	C₅H₁₁Cl₂N₃
Molarna masa	184,067
SMILES Cl.Cl.NCCc1cnc[nH]1
InChI InChI=1S/C5H9N3.2ClH/c6-2-1-5-3-7-4-8-5;;/h3-4H,1-2,6H2,(H,7,8);2*1H^Y Key:PPZMYIBUHIPZOS-UHFFFAOYSA-N^Y

Histamin dihidrohlorid je organsko jedinjenje, koje sadrži 5 atoma ugljenika i ima molekulsku masu od 184,067 Da.

Osobine

Osobina	Vrednost
Broj akceptora vodonika	2
Broj donora vodonika	2
Broj rotacionih veza	2
Particioni koeficijent^[1] (ALogP)	-0,1
Rastvorljivost^[2] (logS, log(mol/L))	0,3
Polarna površina^[3] (PSA, Å²)	54,7

^ 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.