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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	CHEMBL51888
Molecular formula	C22H30N2O4S
IUPAC name	N-[2-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propylamino]ethyl]-4-methylbenzenesulfonamide
Molecular weight	418.552
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.9
Synonyms	DKIWOYFHZPJYPI-UHFFFAOYSA-N SCHEMBL9304468 CHEMBL280608 L005752 BDBM50036863 5-METHOXY-3-{N-PROPYL-N-[2-(4-TOLUENESUlFONYLAMINO)ETHYL]AMINO}CHROMAN N-{2-[(5-Methoxy-chroman-3-yl)-propyl-amino]-ethyl}-4-methyl-benzenesulfonamide; compound with oxalic acid [ Show all ]
Inchi Key	DKIWOYFHZPJYPI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H30N2O4S/c1-4-13-24(14-12-23-29(25,26)19-10-8-17(2)9-11-19)18-15-20-21(27-3)6-5-7-22(20)28-16-18/h5-11,18,23H,4,12-16H2,1-3H3
PubChem CID	10364722
ChEMBL	CHEMBL280608
IUPHAR	N/A
BindingDB	50036863
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
62314	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
62317	5-hydroxytryptamine receptor 1B	P28564	Htr1b	Rattus norvegicus (Rat)	386
62315	5-hydroxytryptamine receptor 2A	Q75Z89	HTR2A	Bos taurus (Bovine)	470
62316	Alpha-1A adrenergic receptor	P18130	ADRA1A	Bos taurus (Bovine)	466
62318	Alpha-2A adrenergic receptor	Q28838	ADRA2A	Bos taurus (Bovine)	452
62319	D(1A) dopamine receptor	Q95136	DRD1	Bos taurus (Bovine)	446
62320	D(2) dopamine receptor	P20288	DRD2	Bos taurus (Bovine)	444

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