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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	CHEMBL158056
Molecular formula	C27H34FN5O5
IUPAC name	N-[(2R)-1-[4-[3-[3-fluoro-4-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)phenoxy]propyl]-1,4-diazepan-1-yl]-1-oxopropan-2-yl]furan-2-carboxamide
Molecular weight	527.597
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	3.9
Synonyms	Furan-2-carboxylic acid [(R)-2-(4-{3-[3-fluoro-4-(5-isopropyl-[1,2,4]oxadiazol-3-yl)-phenoxy]-propyl}-[1,4]diazepan-1-yl)-1-methyl-2-oxo-ethyl]-amide BDBM50139332
Inchi Key	AKFRORBIZCPZBM-LJQANCHMSA-N
Inchi ID	InChI=1S/C27H34FN5O5/c1-18(2)26-30-24(31-38-26)21-9-8-20(17-22(21)28)36-16-6-11-32-10-5-12-33(14-13-32)27(35)19(3)29-25(34)23-7-4-15-37-23/h4,7-9,15,17-19H,5-6,10-14,16H2,1-3H3,(H,29,34)/t19-/m1/s1
PubChem CID	44373858
ChEMBL	CHEMBL158056
IUPHAR	N/A
BindingDB	50139332
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
7497	Histamine H3 receptor	Q9Y5N1	HRH3	Homo sapiens (Human)	445
7498	Histamine H3 receptor	Q9QYN8	Hrh3	Rattus norvegicus (Rat)	445

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