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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	CHEMBL42472
Molecular formula	C26H29NO4
IUPAC name	2-(2,6-dimethoxyphenoxy)-N-[[(2S,4R)-4-phenyl-3,4-dihydro-2H-chromen-2-yl]methyl]ethanamine
Molecular weight	419.521
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	5.0
Synonyms	BDBM50409690
Inchi Key	DASDCIRXSWKVTA-RBBKRZOGSA-N
Inchi ID	InChI=1S/C26H29NO4/c1-28-24-13-8-14-25(29-2)26(24)30-16-15-27-18-20-17-22(19-9-4-3-5-10-19)21-11-6-7-12-23(21)31-20/h3-14,20,22,27H,15-18H2,1-2H3/t20-,22+/m0/s1
PubChem CID	11742834
ChEMBL	CHEMBL42472
IUPHAR	N/A
BindingDB	50409690
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
55301	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
55299	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
55302	Alpha-1A adrenergic receptor	P43140	Adra1a	Rattus norvegicus (Rat)	466
55298	Alpha-1B adrenergic receptor	P15823	Adra1b	Rattus norvegicus (Rat)	515
55303	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
55300	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572
55304	Alpha-1D adrenergic receptor	P23944	Adra1d	Rattus norvegicus (Rat)	561

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