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Ligand

NameCHEMBL1643901
Molecular formulaC19H22FN
IUPAC name(8S)-N-[(3-fluorophenyl)methyl]-N-methylpentacyclo[5.4.0.02,6.03,10.05,9]undecan-8-amine
Molecular weight283.39
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP3.9
SynonymsN-(3-Fluorobenzyl)-N-methyl-8-aminopentacyclo[5.4.0.02,6.03,10.05,9]undecane
BDBM50334458
Inchi KeyGACBJAOXQGFNDL-RAOGCBAWSA-N
Inchi IDInChI=1S/C19H22FN/c1-21(8-9-3-2-4-10(20)5-9)19-16-12-7-13-15-11(12)6-14(16)17(15)18(13)19/h2-5,11-19H,6-8H2,1H3/t11?,12?,13?,14?,15?,16?,17?,18?,19-/m0/s1
PubChem CID53321869
ChEMBLCHEMBL1643901
IUPHARN/A
BindingDB50334458
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: 36
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
914835-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
914665-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
914525-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
914515-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
914705-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
914565-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
914575-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
914815-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
914635-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
914715-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
91460Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
91482Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
91462Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
91473Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
91477Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
91449Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
91453Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
91465Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
91458Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408
91474D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446

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