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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	HEAT
Molecular formula	C19H21NO2
IUPAC name	2-[[2-(4-hydroxyphenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-one
Molecular weight	295.382
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.8
Synonyms	PDSP2_000819 1(2H)-Naphthalenone, 3,4-dihydro-2-(((2-(4-hydroxyphenyl)ethyl)amino)methyl)- AC1L1S9R CHEMBL1515808 2-Heat BE 2254, (+-)-isomer L000762 40077-13-2 CAS_34772 NSC_34772 SCHEMBL6413372 2-(((2-(4-Hydroxyphenyl)ethyl)amino)methyl)-3,4-dihydro-1(2H)-naphthalenone BDBM81809 CTK4I2425 2-[beta-(4-hydroxyphenyl)ethylaminomethyl]tetralone BE-2254 LS-177614 CHEBI:91598 PDSP1_000832 2-(beta-(4-Hydroxyphenyl)ethylaminomethyl)tetralone BE 2254 2-[[2-(4-hydroxyphenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-one BRD-A24429032-003-01-6 NCGC00024637-02 [ Show all ]
Inchi Key	PZZOEXPDTYIBPI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H21NO2/c21-17-9-5-14(6-10-17)11-12-20-13-16-8-7-15-3-1-2-4-18(15)19(16)22/h1-6,9-10,16,20-21H,7-8,11-13H2
PubChem CID	34772
ChEMBL	N/A
IUPHAR	N/A
BindingDB	81809
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
273152	5-hydroxytryptamine receptor 2A	P50129	HTR2A	Sus scrofa (Pig)	470
273153	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
273151	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
273154	Alpha-2B adrenergic receptor	P19328	Adra2b	Rattus norvegicus (Rat)	453

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