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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	CHEMBL52396
Molecular formula	C25H30N2O4
IUPAC name	2-[4-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propylamino]butyl]isoindole-1,3-dione
Molecular weight	422.525
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	4.3
Synonyms	CHEMBL283207 2-{4-[(5-Methoxy-chroman-3-yl)-propyl-amino]-butyl}-isoindole-1,3-dione; compound with oxalic acid LS-84564 BDBM50036844 3-[N-PROPYL-N-(4-PHTHALIMIDOBUTYL)AMINO]-5-METHOXYCHROMAN SCHEMBL9304776 2-[4-[[(5-Methoxy-3,4-dihydro-2H-1-benzopyran)-3-yl]propylamino]butyl]-1H-isoindole-1,3(2H)-dione ISIUTFCGQWDGHC-UHFFFAOYSA-N [ Show all ]
Inchi Key	ISIUTFCGQWDGHC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H30N2O4/c1-3-13-26(18-16-21-22(30-2)11-8-12-23(21)31-17-18)14-6-7-15-27-24(28)19-9-4-5-10-20(19)25(27)29/h4-5,8-12,18H,3,6-7,13-17H2,1-2H3
PubChem CID	10251673
ChEMBL	CHEMBL283207
IUPHAR	N/A
BindingDB	50036844
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
140729	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
140734	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
140731	5-hydroxytryptamine receptor 1B	P28564	Htr1b	Rattus norvegicus (Rat)	386
140735	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
140732	5-hydroxytryptamine receptor 2A	Q75Z89	HTR2A	Bos taurus (Bovine)	470
140733	Alpha-1A adrenergic receptor	P18130	ADRA1A	Bos taurus (Bovine)	466
140737	Alpha-2A adrenergic receptor	Q28838	ADRA2A	Bos taurus (Bovine)	452
140736	D(1A) dopamine receptor	Q95136	DRD1	Bos taurus (Bovine)	446
140730	D(2) dopamine receptor	P20288	DRD2	Bos taurus (Bovine)	444

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