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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	CHEMBL181789
Molecular formula	C29H34Cl2N4O3S
IUPAC name	N-[[(3S,4S)-4-[(3,4-dichlorophenyl)methyl]-1-[1-(quinoline-6-carbonyl)piperidin-4-yl]piperidin-3-yl]methyl]methanesulfonamide
Molecular weight	589.576
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	5.2
Synonyms	BDBM50161414 N-[(3S,4S)-4-(3,4-Dichloro-benzyl)-1''''-(quinoline-6-carbonyl)-[1,4'''']bipiperidinyl-3-ylmethyl]-methanesulfonamide SCHEMBL13389641
Inchi Key	BJPMPSOWBXBZCM-ZJSXRUAMSA-N
Inchi ID	InChI=1S/C29H34Cl2N4O3S/c1-39(37,38)33-18-24-19-35(12-8-21(24)15-20-4-6-26(30)27(31)16-20)25-9-13-34(14-10-25)29(36)23-5-7-28-22(17-23)3-2-11-32-28/h2-7,11,16-17,21,24-25,33H,8-10,12-15,18-19H2,1H3/t21-,24-/m1/s1
PubChem CID	44389868
ChEMBL	CHEMBL181789
IUPHAR	N/A
BindingDB	50161414
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
25348	C-C chemokine receptor type 3	P51677	CCR3	Homo sapiens (Human)	355

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