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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	CHEMBL2443003
Molecular formula	C20H28FN5O5
IUPAC name	(2S,3S,4S,5R,6R)-2-(fluoromethyl)-6-[4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]triazol-1-yl]oxane-3,4,5-triol
Molecular weight	437.472
Hydrogen bond acceptor	10
Hydrogen bond donor	3
XlogP	-0.6
Synonyms	BDBM50442753
Inchi Key	WHDATORJGMRETC-OUUBHVDSSA-N
Inchi ID	InChI=1S/C20H28FN5O5/c1-30-15-5-3-2-4-14(15)25-8-6-24(7-9-25)11-13-12-26(23-22-13)20-19(29)18(28)17(27)16(10-21)31-20/h2-5,12,16-20,27-29H,6-11H2,1H3/t16-,17-,18+,19-,20-/m1/s1
PubChem CID	72545010
ChEMBL	CHEMBL2443003
IUPHAR	N/A
BindingDB	50442753
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
373216	Beta-1 adrenergic receptor	Q28998	ADRB1	Sus scrofa (Pig)	468
373217	D(1A) dopamine receptor	P50130	DRD1	Sus scrofa (Pig)	446
373215	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
373214	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
532036	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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