corbadrine   Click here for help

GtoPdb Ligand ID: 508

Synonyms: α-Me-NE | α-methylnoradrenaline | α-methylnorepinephrine | levonordefrin | Neo-Cobefrin® | Nordefrin®
Approved drug
corbadrine is an approved drug (FDA (1960), in combination with mepivacaine hydrochloride)
Compound class: Synthetic organic
Comment: α-methylnoradrenaline (corbadrine) is a catecholamine sympathomimetic drug.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 4
Rotatable bonds 2
Topological polar surface area 86.71
Molecular weight 183.09
XLogP 0.35
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CC(C(c1ccc(c(c1)O)O)O)N
Isomeric SMILES C[C@@H]([C@@H](c1ccc(c(c1)O)O)O)N
InChI InChI=1S/C9H13NO3/c1-5(10)9(13)6-2-3-7(11)8(12)4-6/h2-5,9,11-13H,10H2,1H3/t5-,9-/m0/s1
InChI Key GEFQWZLICWMTKF-CDUCUWFYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1960), in combination with mepivacaine hydrochloride)
IUPAC Name Click here for help
4-[(1R,2S)-2-amino-1-hydroxypropyl]benzene-1,2-diol
International Nonproprietary Names Click here for help
INN number INN
50 corbadrine
Synonyms Click here for help
α-Me-NE | α-methylnoradrenaline | α-methylnorepinephrine | levonordefrin | Neo-Cobefrin® | Nordefrin®
Database Links Click here for help
BindingDB Ligand 50029048
CAS Registry No. 829-74-3 (source: Scifinder)
ChEMBL Ligand CHEMBL677
DrugBank Ligand DB06707
DrugCentral Ligand 4482
GtoPdb PubChem SID 135649925
PubChem CID 164739
Search Google for chemical match using the InChIKey GEFQWZLICWMTKF-CDUCUWFYSA-N
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Search PubMed clinical trials corbadrine
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Search UniChem for chemical match using the InChIKey GEFQWZLICWMTKF-CDUCUWFYSA-N
Search UniChem for chemicals with the same backbone GEFQWZLICWMTKF
Wikipedia Corbadrine