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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	MLS000089771
Molecular formula	C23H30N2O2
IUPAC name	1-[4-(4-methylphenyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol
Molecular weight	366.505
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.3
Synonyms	1-(2-allylphenoxy)-3-[4-(p-tolyl)piperazino]propan-2-ol Oprea1_031090 HMS2471N17 SR-01000460024-1 AKOS021994733 MLS002585143 1-[4-(4-methylphenyl)-1-piperazinyl]-3-(2-prop-2-enylphenoxy)-2-propanol CHEMBL1548605 SMR000024389 AC1MME82 MCULE-3891300974 1-(2-allylphenoxy)-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol BDBM61795 MolPort-007-560-794 1-[4-(4-methylphenyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol cid_3237370 SR-01000460024 AKOS001644934 [ Show all ]
Inchi Key	BEYGANIWMHXXHZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H30N2O2/c1-3-6-20-7-4-5-8-23(20)27-18-22(26)17-24-13-15-25(16-14-24)21-11-9-19(2)10-12-21/h3-5,7-12,22,26H,1,6,13-18H2,2H3
PubChem CID	3237370
ChEMBL	CHEMBL1548605
IUPHAR	N/A
BindingDB	61795
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
22038	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
22039	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384
22037	Neuropeptide Y receptor type 2	P49146	NPY2R	Homo sapiens (Human)	381

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