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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	CHEMBL250978
Molecular formula	C27H32N2O7S
IUPAC name	N-[5-[(3R)-4-[[(1R)-1-(3,4-dimethoxyphenyl)-2-phenylethyl]amino]-3-hydroxybutanoyl]-2-hydroxyphenyl]methanesulfonamide
Molecular weight	528.62
Hydrogen bond acceptor	9
Hydrogen bond donor	4
XlogP	2.5
Synonyms	BDBM50214244 N-(5-((R)-4-((R)-1-(3,4-dimethoxyphenyl)-2-phenylethylamino)-3-hydroxybutanoyl)-2-hydroxyphenyl)methanesulfonamide
Inchi Key	AFMJYZZCXPWXQR-FGZHOGPDSA-N
Inchi ID	InChI=1S/C27H32N2O7S/c1-35-26-12-10-19(15-27(26)36-2)22(13-18-7-5-4-6-8-18)28-17-21(30)16-25(32)20-9-11-24(31)23(14-20)29-37(3,33)34/h4-12,14-15,21-22,28-31H,13,16-17H2,1-3H3/t21-,22-/m1/s1
PubChem CID	44444163
ChEMBL	CHEMBL250978
IUPHAR	N/A
BindingDB	50214244
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
4280	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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