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Ligand

NameCHEMBL600053
Molecular formulaC18H18FNO
IUPAC nameN-[(3-fluorophenyl)methyl]-5-oxahexacyclo[5.4.1.02,6.03,10.04,8.09,12]dodecan-4-amine
Molecular weight283.346
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.5
SynonymsBDBM50305344
8-(3''-Fluorobenzyl)amino-4-oxapentacyclo[5.4.1.02,6.03,10.05,9.08,11]dodecane
Inchi KeyBKYSPAJPVPEZOE-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H18FNO/c19-8-3-1-2-7(4-8)6-20-18-15-10-5-9-11-12(10)16(18)14(11)17(21-18)13(9)15/h1-4,9-17,20H,5-6H2
PubChem CID46225028
ChEMBLCHEMBL600053
IUPHARN/A
BindingDBN/A
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: 28
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
262925-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
262895-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
262865-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
262885-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
262995-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
262955-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
263025-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
263085-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
262855-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
263055-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
26298Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
26297Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
26293Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
26304Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
26284Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
26307Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
26281Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
26283Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
26296Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
26287D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446

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