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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	CHEMBL205851
Molecular formula	C28H35Cl2FN4O2
IUPAC name	1-acetyl-N-(3,4-dichlorophenyl)-N-[3-[4-(4-fluoroanilino)piperidin-1-yl]propyl]piperidine-4-carboxamide
Molecular weight	549.512
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	5.2
Synonyms	AQKXSWOKSKKJQI-UHFFFAOYSA-N 1-acetyl-N-(3,4-dichlorophenyl)-N-[3-[4-(4-fluoroanilino)-1-piperidyl]propyl]piperidine-4-carboxamide 4-Piperidinecarboxamide, 1-acetyl-N-(3,4-dichlorophenyl)-N-[3-[4-[(4-fluorophenyl)amino]-1-piperidinyl]propyl]- BDBM50185965 SCHEMBL4768836 1-Acetyl-N-(3,4-dichlorophenyl)-N-{3-[4-(4-fluoroanilino)-1-piperidinyl]propyl}-4-piperidinecarboxamide 1-acetyl-N-(3,4-dichlorophenyl)-N-{3-[4-(4-fluoroanilino)piperidin-1-yl]propyl}piperidine-4-carboxamide [ Show all ]
Inchi Key	AQKXSWOKSKKJQI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H35Cl2FN4O2/c1-20(36)34-17-9-21(10-18-34)28(37)35(25-7-8-26(29)27(30)19-25)14-2-13-33-15-11-24(12-16-33)32-23-5-3-22(31)4-6-23/h3-8,19,21,24,32H,2,9-18H2,1H3
PubChem CID	11693007
ChEMBL	CHEMBL205851
IUPHAR	N/A
BindingDB	50185965
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
11870	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352

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