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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	MLS000882741
Molecular formula	C30H28FNO
IUPAC name	(3R,3aS,7R,7aS)-2-benzyl-3-[2-fluoro-4-[(E)-2-phenylethenyl]phenyl]-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one
Molecular weight	437.558
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	6.6
Synonyms	(3R,3aS,7R,7aS)-2-benzyl-3-[2-fluoro-4-[(E)-2-phenylethenyl]phenyl]-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one HMS2226H15 (3R,3aS,7R,7aS)-3-[2-fluoro-4-[(E)-2-phenylethenyl]phenyl]-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one SMR000465316 CHEMBL1546150 (3R,3aS,7R,7aS)-2-benzyl-3-[2-fluoro-4-[(E)-styryl]phenyl]-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one KUC101257N BDBM94099 cid_16746494 (3R,3aS,7R,7aS)-3-[2-fluoranyl-4-[(E)-2-phenylethenyl]phenyl]-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one [ Show all ]
Inchi Key	ABMDJMAZWAUPMF-WACQLOJESA-N
Inchi ID	InChI=1S/C30H28FNO/c1-21-9-8-14-26-28(21)30(33)32(20-24-12-6-3-7-13-24)29(26)25-18-17-23(19-27(25)31)16-15-22-10-4-2-5-11-22/h2-8,10-19,21,26,28-29H,9,20H2,1H3/b16-15+/t21-,26+,28+,29+/m1/s1
PubChem CID	16746494
ChEMBL	CHEMBL1546150
IUPHAR	N/A
BindingDB	N/A
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
953	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463

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