4-Hidroksi-5-metoksidimetiltriptamin
Izvor: Wikipedia
Klinički podaci | |||
---|---|---|---|
AHFS/Drugs.com | Monografija | ||
Identifikatori | |||
CAS broj | 2433-31-0 | ||
ATC kod | nije dodeljen | ||
ChemSpider[1] | 21106242 | ||
Hemijski podaci | |||
Formula | C13H18N2O2 | ||
Mol. masa | 234,294 | ||
SMILES | eMolekuli & PubHem | ||
|
|||
Farmakoinformacioni podaci | |||
Trudnoća | ? | ||
Pravni status |
4-Hidroksi-5-metoksidimetiltriptamin je organsko jedinjenje, koje sadrži 13 atoma ugljenika i ima molekulsku masu od 234,294 Da.
Sadržaj/Садржај
Osobine[uredi - уреди]
Osobina | Vrednost |
---|---|
Broj akceptora vodonika | 3 |
Broj donora vodonika | 2 |
Broj rotacionih veza | 4 |
Particioni koeficijent[2] (ALogP) | 2,3 |
Rastvorljivost[3] (logS, log(mol/L)) | -2,2 |
Polarna površina[4] (PSA, Å2) | 48,5 |
Reference[uredi - уреди]
- ↑ 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.
- ↑ 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.
- ↑ 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.
- ↑ 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[uredi - уреди]
- 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. http://books.mcgraw-hill.com/medical/goodmanandgilman/.
- 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. http://www.lww.com/productTOC/?ISBN=978-0-7817-6879-5.