amphetamine   Click here for help

GtoPdb Ligand ID: 4804

Synonyms: (±)-amphetamine | Amphetamine Sulfate® | DL-amphetamine
Approved drug
amphetamine is an approved drug (FDA (no history prior to 1976))
Compound class: Synthetic organic
Comment: Amphetamine is a central nervous system stimulant and an appetite suppressant.
Amphetamine can activate carbonic anhydrases, and is most potent at the CA5A and CA7 isoforms (KA values 810 and 910 nM respectively) [1].
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 26.02
Molecular weight 135.1
XLogP 1.76
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES CC(Cc1ccccc1)N
Isomeric SMILES CC(Cc1ccccc1)N
InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (no history prior to 1976))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
377 amfetamine
Synonyms Click here for help
(±)-amphetamine | Amphetamine Sulfate® | DL-amphetamine
Database Links Click here for help
CAS Registry No. 300-62-9 (source: Scifinder)
DrugBank Ligand DB00182
DrugCentral Ligand 195
GtoPdb PubChem SID 178101506
PubChem CID 3007
Search Google for chemical match using the InChIKey KWTSXDURSIMDCE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KWTSXDURSIMDCE
Search PubMed clinical trials amfetamine
Search PubMed titles amfetamine
Search PubMed titles/abstracts amfetamine
UniChem Compound Search for chemical match using the InChIKey KWTSXDURSIMDCE-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey KWTSXDURSIMDCE-UHFFFAOYSA-N
Wikipedia Amphetamine