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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	Bunolol
Molecular formula	C17H25NO3
IUPAC name	5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one
Molecular weight	291.391
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	2.4
Synonyms	AC1Q6JRI Bunololum [INN-Latin] DTXSID7022702 W-6412A (+-)-5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydronaphthalen-1(2H)-one 27591-01-1 CC-25267 L000824 (+/-)-Bunolol 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one AB01563321_01 Bunololo [DCIT] CHEMBL293030 SBI-0206800.P001 1(2H)-NAPHTHALENONE, 3,4-DIHYDRO-5-(3-(tert-BUTYLAMINO)-2-HYDROXYPROPOXY)- BRD-A46876182-003-01-0 C-23665 FT-0756863 W-6421A (+/-)-5-[(tert-Butylamino)-2'-hydroxypropoxy]-3,4-dihydro-1(2H)-naphthalenone 3,4-Dihydro-5-(3-(tert-butylamino)-2-hydroxy)propoxy-1(2H)-naphthalenone 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydronaphthalen-1(2H)-one Bunolol [INN] CHEBI:29110 LS-95038 (-)-5-[3-(tert-Butylamino)-2-hydroxypropoxy]-3,4-dihydro-1(2H)- naphthalenone AC1L1GZT Bunololum CTK4F9942 SCHEMBL828612 1(2H)-Naphthalenone,5-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-3,4-dihydro- BRN 1887243 C04883 IXHBTMCLRNMKHZ-UHFFFAOYSA-N (+/-)-5-[(tert-butylaminol)-2'-hydroxypropoxy]-3,4-dihydro-1(2H)-naphthalenone 5-[3-(tert-Butylamino)-2-hydroxypropoxy]-3,4-dihydro-1(2H)-naphthalenone # 591B011 Bunololo NCGC00263903-02 (?)-5-[3-(tert-Butylamino)-2-hydroxypropoxy]-3,4-dihydronaphthalene-1(2H)-one hydrochloride,(?)-Bunolol hydrochloride [ Show all ]
Inchi Key	IXHBTMCLRNMKHZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H25NO3/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3
PubChem CID	3914
ChEMBL	CHEMBL293030
IUPHAR	N/A
BindingDB	N/A
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
143990	Beta-1 adrenergic receptor	P18090	Adrb1	Rattus norvegicus (Rat)	466
143989	Beta-2 adrenergic receptor	P10608	Adrb2	Rattus norvegicus (Rat)	418

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