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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	CHEMBL136431
Molecular formula	C15H21N3O2
IUPAC name	1-[(3S)-1-(2,3-dihydro-1-benzofuran-4-yl)pyrrolidin-3-yl]-3-ethylurea
Molecular weight	275.352
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	1.8
Synonyms	1-[(3S)-1-(2,3-Dihydrobenzofuran-4-yl)-3-pyrrolidinyl]-3-ethylurea BDBM50136401 SCHEMBL6580126 1-[(S)-1-(2,3-Dihydro-benzofuran-4-yl)-pyrrolidin-3-yl]-3-ethyl-urea
Inchi Key	CDGKTTRAJGRLKP-NSHDSACASA-N
Inchi ID	InChI=1S/C15H21N3O2/c1-2-16-15(19)17-11-6-8-18(10-11)13-4-3-5-14-12(13)7-9-20-14/h3-5,11H,2,6-10H2,1H3,(H2,16,17,19)/t11-/m0/s1
PubChem CID	44358231
ChEMBL	CHEMBL136431
IUPHAR	N/A
BindingDB	50136401
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
39259	Melatonin receptor type 1A	P48039	MTNR1A	Homo sapiens (Human)	350
39258	Melatonin receptor type 1B	P49286	MTNR1B	Homo sapiens (Human)	362

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