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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	CHEMBL496452
Molecular formula	C29H46O5
IUPAC name	[(1R,2S,5S,7R,8S,11R,14R,15R,17R)-5,7-dihydroxy-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadec-9-en-8-yl] acetate
Molecular weight	474.682
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	5.3
Synonyms	19-Deoxydysideasterol A BDBM50269198 9alpha,11alpha-epoxycholest-7-ene-3beta,5alpha,6alpha-triol 6-acetate
Inchi Key	CEJPYZZCYLZKRP-ANNVCDRBSA-N
Inchi ID	InChI=1S/C29H46O5/c1-17(2)8-7-9-18(3)21-10-11-22-23-14-24(33-19(4)30)28(32)15-20(31)12-13-27(28,6)29(23)25(34-29)16-26(21,22)5/h14,17-18,20-22,24-25,31-32H,7-13,15-16H2,1-6H3/t18-,20+,21-,22+,24+,25-,26-,27+,28+,29+/m1/s1
PubChem CID	11798740
ChEMBL	CHEMBL496452
IUPHAR	N/A
BindingDB	50269198
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
39950	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350

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