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Ligand

Nameakuammigine
Molecular formulaC21H24N2O3
IUPAC namemethyl (1R,15S,16S,20S)-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,18-pentaene-19-carboxylate
Molecular weight352.434
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.7
SynonymsOxayohimban-16-carboxylic acid, 16,17-didehydro-19-methyl-, methyl ester, (3beta,19alpha,20alpha)-
1E21YYE0UM
BDBM50030622
UNII-1E21YYE0UM
642-17-1
[ Show all ]
Inchi KeyGRTOGORTSDXSFK-BMYCAMMWSA-N
Inchi IDInChI=1S/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t12-,15-,16-,19+/m0/s1
PubChem CID1268096
ChEMBLCHEMBL122404
IUPHARN/A
BindingDB50030622
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
103735Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
103739Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450
460151Alpha-2A adrenergic receptorQ28838ADRA2ABos taurus (Bovine)452
103734Alpha-2B adrenergic receptorP19328Adra2bRattus norvegicus (Rat)453
103738Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
103737Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462

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