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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	CHEMBL81649
Molecular formula	C21H27N3O3S
IUPAC name	4-[4-[2-[(1R)-3,4-dihydro-1H-isochromen-1-yl]ethyl]piperazin-1-yl]benzenesulfonamide
Molecular weight	401.525
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	2.2
Synonyms	4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]-benzenesulfonamide ZINC5162669 BDBM50051563 (+)-U-101387 SCHEMBL7397229 (R)-(+)-4-[4-[2-(Isochroman-1-yl)ethyl]piperazin-1-yl]benzenesulfonamide WNUQCGWXPNGORO-OAQYLSRUSA-N B7607 [ Show all ]
Inchi Key	WNUQCGWXPNGORO-OAQYLSRUSA-N
Inchi ID	InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1
PubChem CID	10811059
ChEMBL	CHEMBL81649
IUPHAR	N/A
BindingDB	50051563
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
377930	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
557056	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
377928	5-hydroxytryptamine receptor 6	P50406	HTR6	Homo sapiens (Human)	440
377931	Alpha-1A adrenergic receptor	P43140	Adra1a	Rattus norvegicus (Rat)	466
377924	Alpha-2C adrenergic receptor	P22086	Adra2c	Rattus norvegicus (Rat)	458
377929	D(1A) dopamine receptor	P18901	Drd1	Rattus norvegicus (Rat)	446
377932	D(2) dopamine receptor	P61169	Drd2	Rattus norvegicus (Rat)	444
377925	D(3) dopamine receptor	P19020	Drd3	Rattus norvegicus (Rat)	446
377927	D(4) dopamine receptor	P30729	Drd4	Rattus norvegicus (Rat)	387
557057	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467
377926	Histamine H1 receptor	P30546	HRH1	Bos taurus (Bovine)	491

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