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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	RS-17053
Molecular formula	C24H29ClN2O2
IUPAC name	1-(5-chloro-1H-indol-3-yl)-N-[2-[2-(cyclopropylmethoxy)phenoxy]ethyl]-2-methylpropan-2-amine
Molecular weight	412.958
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	5.5
Synonyms	CHEMBL88272 Tocris-0985 [2-(5-Chloro-1H-indol-3-yl)-1,1-dimethyl-ethyl]-[2-(2-cyclopropylmethoxy-phenoxy)-ethyl]-amine alpha,alpha-Dimethyl-N-[2-[2-(cyclopropylmethoxy)phenoxy]ethyl]-5-chloro-1H-indole-3-(ethanamine) NCGC00024916-01 CHEBI:93348 RS17053 GTPL495 ZINC1542749 BDBM50160165 NCGC00024916-02 1-(5-chloro-1H-indol-3-yl)-N-[2-[2-(cyclopropylmethoxy)phenoxy]ethyl]-2-methylpropan-2-amine SCHEMBL9265406 AC1MZ9G2 L000525 [2-(2-Cyclopropylmethoxy-phenoxy)-ethyl]-[2-(1H-indol-3-yl)-1,1-dimethyl-ethyl]-amine BRD-K76840893-003-01-7 [ Show all ]
Inchi Key	XLZHXAXXJVKTFM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H29ClN2O2/c1-24(2,14-18-15-26-21-10-9-19(25)13-20(18)21)27-11-12-28-22-5-3-4-6-23(22)29-16-17-7-8-17/h3-6,9-10,13,15,17,26-27H,7-8,11-12,14,16H2,1-2H3
PubChem CID	3894573
ChEMBL	CHEMBL88272
IUPHAR	495
BindingDB	50160165
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
395353	Alpha-1A adrenergic receptor	P18130	ADRA1A	Bos taurus (Bovine)	466
395355	Alpha-1A adrenergic receptor	O02824	ADRA1A	Oryctolagus cuniculus (Rabbit)	466
395356	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
395354	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
395357	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572

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