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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	CHEMBL97333
Molecular formula	C29H33FN6O
IUPAC name	3-[2-[4-[1-(4-fluorophenyl)-5-(1-methyl-1,2,4-triazol-3-yl)indol-3-yl]piperidin-1-yl]ethyl]-1-methylpyrrolidin-2-one
Molecular weight	500.622
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	4.0
Synonyms	BDBM50122809 3-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-[1,2,4]triazol-3-yl)-1H-indol-3-yl]-piperidin-1-yl}-ethyl)-1-methyl-pyrrolidin-2-one
Inchi Key	NLEVDCFBQNJLSW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H33FN6O/c1-33-13-9-21(29(33)37)12-16-35-14-10-20(11-15-35)26-18-36(24-6-4-23(30)5-7-24)27-8-3-22(17-25(26)27)28-31-19-34(2)32-28/h3-8,17-21H,9-16H2,1-2H3
PubChem CID	11071135
ChEMBL	CHEMBL97333
IUPHAR	N/A
BindingDB	50122809
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
226123	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
226122	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
226131	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
226124	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
226128	Alpha-1A adrenergic receptor	P18130	ADRA1A	Bos taurus (Bovine)	466
226126	Alpha-1B adrenergic receptor	P18841	ADRA1B	Mesocricetus auratus (Golden hamster)	515
226127	Alpha-1D adrenergic receptor	P23944	Adra1d	Rattus norvegicus (Rat)	561
226130	D(1A) dopamine receptor	P18901	Drd1	Rattus norvegicus (Rat)	446
226129	D(2) dopamine receptor	P61169	Drd2	Rattus norvegicus (Rat)	444
226125	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
226132	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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