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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	CHEMBL104481
Molecular formula	C29H42N4O4
IUPAC name	N-cyclohexyl-4-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]anilino]piperidine-1-carboxamide
Molecular weight	510.679
Hydrogen bond acceptor	6
Hydrogen bond donor	5
XlogP	4.1
Synonyms	BDBM50106973 N-Cyclohexyl-4-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]anilino]-1-piperidinecarboxamide 4-(4-{2-[(S)-2-Hydroxy-3-(4-hydroxy-phenoxy)-propylamino]-ethyl}-phenylamino)-piperidine-1-carboxylic acid cyclohexylamide SCHEMBL7090670
Inchi Key	AGOJNUPIGRPSJZ-MHZLTWQESA-N
Inchi ID	InChI=1S/C29H42N4O4/c34-26-10-12-28(13-11-26)37-21-27(35)20-30-17-14-22-6-8-24(9-7-22)31-25-15-18-33(19-16-25)29(36)32-23-4-2-1-3-5-23/h6-13,23,25,27,30-31,34-35H,1-5,14-21H2,(H,32,36)/t27-/m0/s1
PubChem CID	10142284
ChEMBL	CHEMBL104481
IUPHAR	N/A
BindingDB	50106973
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
5075	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
5076	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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