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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	MLS001106103
Molecular formula	C23H28FN3O2
IUPAC name	N-[2-(2-fluorophenyl)ethyl]-2-[3-oxo-1-(3-phenylpropyl)piperazin-2-yl]acetamide
Molecular weight	397.494
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	3.0
Synonyms	N-[2-(2-fluorophenyl)ethyl]-2-[3-oxo-1-(3-phenylpropyl)piperazin-2-yl]acetamide cid_24791545 N-[2-(2-fluorophenyl)ethyl]-2-[3-oxidanylidene-1-(3-phenylpropyl)piperazin-2-yl]ethanamide SMR000654923 HMS2946H23 MolPort-005-044-187 N-[2-(2-fluorophenyl)ethyl]-2-[3-oxo-1-(3-phenylpropyl)-2-piperazinyl]acetamide CHEMBL1603110 MCULE-6238696652 N-[2-(2-fluorophenyl)ethyl]-2-[3-keto-1-(3-phenylpropyl)piperazin-2-yl]acetamide BDBM96781 [ Show all ]
Inchi Key	BQYUKIZPKQZRBT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H28FN3O2/c24-20-11-5-4-10-19(20)12-13-25-22(28)17-21-23(29)26-14-16-27(21)15-6-9-18-7-2-1-3-8-18/h1-5,7-8,10-11,21H,6,9,12-17H2,(H,25,28)(H,26,29)
PubChem CID	24791545
ChEMBL	CHEMBL1603110
IUPHAR	N/A
BindingDB	96781
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
30781	Trace amine-associated receptor 1	Q96RJ0	TAAR1	Homo sapiens (Human)	339

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