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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	477313-09-0
Molecular formula	C19H21Cl2NO2
IUPAC name	3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-4H-isochromen-1-one;hydrochloride
Molecular weight	366.282
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	None
Synonyms	1H-2-Benzopyran-1-one,3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-,hydrochloride ( inverted exclamation markA)-3-(4-Chlorophenyl)-3-(2-(dimethylamino)ethyl)isochroman-1-one hydrochloride DTXSID80432683 (+/-)-3-(4-Chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1H-2-benzopyran-1-one hydrochloride ACM477313090 MolPort-003-940-002 1H-2-Benzopyran-1-one,3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-,hydrochloride(1:1) CHEMBL535141 ( inverted exclamation markA)-AC 7954 hydrochloride AC-7954 KB-65125 (+/-)-AC 7954 HYDROCHLORIDE AKOS024457127 RT-011125 ( )-AC 7954 hydrochloride 3-(4-Chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1H-2-benzopyran-1-one--hydrogen chloride (1/1) CTK8E8399 (+/-)-3-(4-Chlorophenyl)-3-(2-(dimethylamino)ethyl)isochroman-1-one hydrochloride AC-7954, >=98% (HPLC), solid MFCD07784497 [ Show all ]
Inchi Key	AJPGLOWFIBOGMH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H20ClNO2.ClH/c1-21(2)12-11-19(15-7-9-16(20)10-8-15)13-14-5-3-4-6-17(14)18(22)23-19;/h3-10H,11-13H2,1-2H3;1H
PubChem CID	9907171
ChEMBL	CHEMBL535141
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	Partition coefficient log P of this ligand is not available.

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
7099	Urotensin-2 receptor	Q9UKP6	UTS2R	Homo sapiens (Human)	389
7100	Urotensin-2 receptor	P49684	Uts2r	Rattus norvegicus (Rat)	386

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