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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	CHEMBL3806205
Molecular formula	C22H36NO4P
IUPAC name	[(1R,3S)-1-amino-3-[(6R)-6-hexyl-5,6,7,8-tetrahydronaphthalen-2-yl]cyclopentyl]methyl dihydrogen phosphate
Molecular weight	409.507
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	2.0
Synonyms	BWKSEIHXZRSETR-VOQZNFBZSA-N ((1R,3S)-1-amino-3-((R)-6-hexyl-5,6,7,8-tetrahydronaphthalen-2-yl) cyclopentyl)methyl dihydrogen phosphate J3.582.855I BDBM50169441 ((1R,3S)-1-amino-3-((R)-6-hexyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopentyl)methyl dihydrogen phosphate SCHEMBL15953620 BMS-986104-P [ Show all ]
Inchi Key	BWKSEIHXZRSETR-VOQZNFBZSA-N
Inchi ID	InChI=1S/C22H36NO4P/c1-2-3-4-5-6-17-7-8-19-14-20(10-9-18(19)13-17)21-11-12-22(23,15-21)16-27-28(24,25)26/h9-10,14,17,21H,2-8,11-13,15-16,23H2,1H3,(H2,24,25,26)/t17-,21+,22-/m1/s1
PubChem CID	78321974
ChEMBL	CHEMBL3806205
IUPHAR	N/A
BindingDB	50169441
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
522572	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
522571	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378
522574	Sphingosine 1-phosphate receptor 4	O95977	S1PR4	Homo sapiens (Human)	384
522573	Sphingosine 1-phosphate receptor 5	Q9H228	S1PR5	Homo sapiens (Human)	398

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