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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	CHEMBL3900332
Molecular formula	C31H33F3N6OS
IUPAC name	1'-(2,2-dimethylpropyl)-1-[2-[(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)amino]phenyl]-4-(trifluoromethyl)spiro[2H-indole-3,4'-piperidine]-7-ol
Molecular weight	594.701
Hydrogen bond acceptor	11
Hydrogen bond donor	2
XlogP	7.2
Synonyms	BDBM177969 SCHEMBL16894539 US9120798, 6
Inchi Key	BEAXBJADFUQQRI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C31H33F3N6OS/c1-29(2,3)18-39-16-13-30(14-17-39)19-40(26-24(41)12-11-20(25(26)30)31(32,33)34)23-10-5-4-8-21(23)36-28-38-37-27(42-28)22-9-6-7-15-35-22/h4-12,15,41H,13-14,16-19H2,1-3H3,(H,36,38)
PubChem CID	73053123
ChEMBL	CHEMBL3900332
IUPHAR	N/A
BindingDB	177969
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
459404	P2Y purinoceptor 1	P47900	P2RY1	Homo sapiens (Human)	373

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