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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	BDBM86273
Molecular formula	C18H17BrF3NO2
IUPAC name	(5S)-9-bromo-3-methyl-5-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol
Molecular weight	416.238
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	4.6
Synonyms	MCL-211
Inchi Key	FTKZFGGKMRGKQD-AWEZNQCLSA-N
Inchi ID	InChI=1S/C18H17BrF3NO2/c1-23-6-5-12-13(8-15(24)17(25)16(12)19)14(9-23)10-3-2-4-11(7-10)18(20,21)22/h2-4,7-8,14,24-25H,5-6,9H2,1H3/t14-/m0/s1
PubChem CID	57340518
ChEMBL	N/A
IUPHAR	N/A
BindingDB	86273
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
555792	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
86842	Alpha-2C adrenergic receptor	P22086	Adra2c	Rattus norvegicus (Rat)	458
86841	D(1A) dopamine receptor	P18901	Drd1	Rattus norvegicus (Rat)	446
555791	D(2) dopamine receptor	P61169	Drd2	Rattus norvegicus (Rat)	444
555793	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400

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