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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	UNII-HD099HOT7H
Molecular formula	C30H37Cl2IN2O2
IUPAC name	2,7-dichloro-N-[1-[[(1E)-cycloocten-1-yl]methyl]-1-ethylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide;iodide
Molecular weight	655.442
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	None
Synonyms	2,7-dichloro-N-[1-[[(1E)-cycloocten-1-yl]methyl]-1-ethylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide iodide B7118 J-113863 SCHEMBL8184177 301648-08-8 CHEMBL34626 Piperidinium, 1-(1-cycloocten-1-ylmethyl)-4-(((2,7-dichloro-9H-xanthen-9-yl)carbonyl)amino)-1-ethyl-, iodide (1:1), cis- UNII-E32U2ESR7J component FOAFBMYSXIGAOX-KEKKVSGZSA-N AC1OCFI1 J 113863 Piperidinium, 1-(1-cycloocten-1-ylmethyl)-4-(((2,7-dichloro-9H-xanthen-9-yl)carbonyl)amino)-1-ethyl-, iodide, trans- 202796-41-6 J-113863, cis- SCHEMBL8187807 353791-85-2 H942HGF14D Piperidinium, 1-(1-cycloocten-1-ylmethyl)-4-(((2,7-dichloro-9H-xanthen-9-yl)carbonyl)amino)-1-ethyl-, iodide (1:1), trans- UNII-E32U2ESR7J component FOAFBMYSXIGAOX-MUMZCOSOSA-N AKOS025295214 J-017805 RT-013393 202796-42-7 CHEMBL277930 J-113863, trans- SCHEMBL8189438 HD099HOT7H Piperidinium, 1-(1-cycloocten-1-ylmethyl)-4-(((2,7-dichloro-9H-xanthen-9-yl)carbonyl)amino)-1-ethyl-, iodide, cis- UNII-H942HGF14D [ Show all ]
Inchi Key	FOAFBMYSXIGAOX-LQGGPMKRSA-N
Inchi ID	InChI=1S/C30H36Cl2N2O2.HI/c1-2-34(20-21-8-6-4-3-5-7-9-21)16-14-24(15-17-34)33-30(35)29-25-18-22(31)10-12-27(25)36-28-13-11-23(32)19-26(28)29;/h8,10-13,18-19,24,29H,2-7,9,14-17,20H2,1H3;1H/b21-8+;
PubChem CID	6918496
ChEMBL	CHEMBL277930
IUPHAR	N/A
BindingDB	50098643
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available.

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
83079	C-C chemokine receptor type 1	P51675	Ccr1	Mus musculus (Mouse)	355
83081	C-C chemokine receptor type 1	P32246	CCR1	Homo sapiens (Human)	355
83085	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374
83082	C-C chemokine receptor type 3	P51677	CCR3	Homo sapiens (Human)	355
83083	C-C chemokine receptor type 4	P51679	CCR4	Homo sapiens (Human)	360
83084	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352
83080	Probable C-C chemokine receptor type 3	P51678	Ccr3	Mus musculus (Mouse)	359

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