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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	SQ-29548
Molecular formula	C21H29N3O4
IUPAC name	(Z)-7-[(1R,2R,3R,4S)-3-[[2-(phenylcarbamoyl)hydrazinyl]methyl]-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid
Molecular weight	387.48
Hydrogen bond acceptor	5
Hydrogen bond donor	4
XlogP	0.3
Synonyms	98672-91-4 [3H]-SQ29548 [3H]SQ29548 GTPL1980 7-(3-((2-((Phenylamino)carbonyl)hydrazino)methyl)-7-oxabicyclo(2.2.1)hept-2-yl)-5-heptenoic acid SQ-28053 (Z)-7-[(1R,4S,5R,6R)-5-[(2-(phenylcarbamoyl)hydrazinyl)methyl]-7-oxabicyclo[2.2.1]heptan-6-yl]hept-5-enoic acid D02IBM [3H]SQ-28053 5-Heptenoic acid, 7-((1R,2R,3R,4S)-3-((2-((phenylamino)carbonyl)hydrazino)methyl)-7-oxabicyclo(2.2.1)hept-2-yl)-, (5Z)-rel- GTPL1985 98299-61-7 D05RAV [3H]SQ-29548 5-Heptenoic acid, 7-(3-((2-((phenylamino)carbonyl)hydrazino)methyl)-7-oxabicyclo(2.2.1)hept-2-yl)-, (1alpha,2beta(Z),3beta,4alpha)-(+-)- SQ 28053 [ Show all ]
Inchi Key	RJNDVCNWVBWHLY-OQMICVBCSA-N
Inchi ID	InChI=1S/C21H29N3O4/c25-20(26)11-7-2-1-6-10-16-17(19-13-12-18(16)28-19)14-22-24-21(27)23-15-8-4-3-5-9-15/h1,3-6,8-9,16-19,22H,2,7,10-14H2,(H,25,26)(H2,23,24,27)/b6-1-/t16-,17+,18-,19+/m1/s1
PubChem CID	6437074
ChEMBL	N/A
IUPHAR	1985, 1980
BindingDB	N/A
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
554740	Thromboxane A2 receptor	P34978	Tbxa2r	Rattus norvegicus (Rat)	341
554741	Thromboxane A2 receptor	P30987	Tbxa2r	Mus musculus (Mouse)	341
554742	Thromboxane A2 receptor	P21731	TBXA2R	Homo sapiens (Human)	343

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