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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	CHEMBL3355958
Molecular formula	C33H36F2N2O2S
IUPAC name	ethyl 4-[2-ethyl-6-fluoro-3-[1-[3-(4-fluorophenyl)sulfanylpropyl]piperidin-4-yl]indol-1-yl]benzoate
Molecular weight	562.72
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	8.1
Synonyms	SCHEMBL2565773 BDBM50041196 JRCSAKBNGXSAGM-UHFFFAOYSA-N 4-(2-ETHYL-6-FLUORO-3-{1-[3-(4-FLUORO-PHENYLSULFANYL)-PROPYL]-PIPERIDIN-4-YL}-INDOL-1-YL)-BENZOIC ACID ETHYL ESTER
Inchi Key	JRCSAKBNGXSAGM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C33H36F2N2O2S/c1-3-30-32(23-16-19-36(20-17-23)18-5-21-40-28-13-8-25(34)9-14-28)29-15-10-26(35)22-31(29)37(30)27-11-6-24(7-12-27)33(38)39-4-2/h6-15,22-23H,3-5,16-21H2,1-2H3
PubChem CID	11952525
ChEMBL	CHEMBL3355958
IUPHAR	N/A
BindingDB	50041196
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
447917	C-C chemokine receptor type 3	O54814	Ccr3	Rattus norvegicus (Rat)	359
447918	C-C chemokine receptor type 3	P51677	CCR3	Homo sapiens (Human)	355
447919	Probable C-C chemokine receptor type 3	P51678	Ccr3	Mus musculus (Mouse)	359

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