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Ligand

NameSK&F-104078
Molecular formulaC16H22ClNO
IUPAC name6-chloro-3-methyl-9-(3-methylbut-2-enoxy)-1,2,4,5-tetrahydro-3-benzazepine
Molecular weight279.808
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.4
SynonymsSkf 104078
SK&F 104078
UNII-22XBK6DY1E
110857-22-2
22XBK6DY1E
[ Show all ]
Inchi KeyMBYSTKNEMJZSIK-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H22ClNO/c1-12(2)8-11-19-16-5-4-15(17)13-6-9-18(3)10-7-14(13)16/h4-5,8H,6-7,9-11H2,1-3H3
PubChem CID122295
ChEMBLCHEMBL114166
IUPHARN/A
BindingDB50030623
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: 13
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
201801Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
201788Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
201794Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
201789Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450
201790Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
201791Alpha-2A adrenergic receptorQ28838ADRA2ABos taurus (Bovine)452
201799Alpha-2A adrenergic receptorP18871ADRA2ASus scrofa (Pig)450
201793Alpha-2B adrenergic receptorO77715ADRA2BDidelphis virginiana (North American opossum)382
201797Alpha-2B adrenergic receptorP19328Adra2bRattus norvegicus (Rat)453
201798Alpha-2B adrenergic receptorO77830ADRA2BOryctolagus cuniculus (Rabbit)394
201800Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
201792Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
201796Alpha-2C adrenergic receptorP22086Adra2cRattus norvegicus (Rat)458

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