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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	913064-47-8
Molecular formula	C29H29ClN4O2
IUPAC name	7-chloro-2-[3-(9-pyridin-4-yl-3,9-diazaspiro[5.5]undecane-3-carbonyl)phenyl]-3H-isoindol-1-one
Molecular weight	501.027
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	4.4
Synonyms	FT-0762514 7-Chloro-2-[3-(9-pyridin-4-yl-3,9-diaza-spiro[5.5]undecane-3-carbonyl)-phenyl]-2,3-dihydro-isoindol-1-one BDBM50326710 KB-76774 1H-Isoindol-1-one, 7-chloro-2,3-dihydro-2-(3-((9-(4-pyridinyl)-3,9-diazaspiro(5.5)undec-3-yl)carbonyl)phenyl)- AKOS025293444 CS-4807 ELN441958 UNII-G62X909Y89 7-Chloro-2-(3-((9-(pyridin-4-yl)-3,9-diazaspiro(5.5)undecan-3-yl)carbonyl)phenyl)-2,3-dihydroisoindol-1-one BC600612 G62X909Y89 7-chloro-2-{3-[9-(pyridin-4-yl)-3,9-diazaspiro[5.5]undecane-3-carbonyl]phenyl}-2,3-dihydro-1H-isoindol-1-one ELN 441958 NCGC00485481-01 3,9-Diazaspiro(5.5)undecane, 3-(3-(7-chloro-1,3-dihydro-1-oxo-2H-isoindol-2-yl)benzoyl)-9-(4-pyridinyl)- ARYQHSWJGHCGJS-UHFFFAOYSA-N EX-A2054 ZINC36475212 7-chloro-2-(3-(9-(pyridin-4-yl)-3,9-diazaspiro[5.5]undecane-3-carbonyl)phenyl)isoindolin-1-one BCP23812 HY-15043 CHEMBL1254945 ELN-441958 SCHEMBL1712902 B5925 [ Show all ]
Inchi Key	ARYQHSWJGHCGJS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H29ClN4O2/c30-25-6-2-4-22-20-34(28(36)26(22)25)24-5-1-3-21(19-24)27(35)33-17-11-29(12-18-33)9-15-32(16-10-29)23-7-13-31-14-8-23/h1-8,13-14,19H,9-12,15-18,20H2
PubChem CID	11848206
ChEMBL	CHEMBL1254945
IUPHAR	N/A
BindingDB	50326710
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
12902	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353

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