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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	CHEMBL550445
Molecular formula	C25H29N3O3S
IUPAC name	1-[4-[2-[[(2S)-2-hydroxy-3-phenoxypropyl]amino]ethyl]phenyl]-3-(3-methoxyphenyl)thiourea
Molecular weight	451.585
Hydrogen bond acceptor	5
Hydrogen bond donor	4
XlogP	3.9
Synonyms	CHEMBL1203996 BDBM50378075
Inchi Key	AQIABZRVTYPRIL-QFIPXVFZSA-N
Inchi ID	InChI=1S/C25H29N3O3S/c1-30-24-9-5-6-21(16-24)28-25(32)27-20-12-10-19(11-13-20)14-15-26-17-22(29)18-31-23-7-3-2-4-8-23/h2-13,16,22,26,29H,14-15,17-18H2,1H3,(H2,27,28,32)/t22-/m0/s1
PubChem CID	44517694
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50378075
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
11772	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
459322	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
11771	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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