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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	Himbacine
Molecular formula	C22H35NO2
IUPAC name	(3R,4R,4aS,8aR)-4-[(E)-2-[(2S,6S)-1,6-dimethylpiperidin-2-yl]ethenyl]-3-methyl-3a,4,4a,5,6,7,8,8a,9,9a-decahydro-3H-benzo[f][2]benzofuran-1-one
Molecular weight	345.527
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	5.0
Synonyms	BDBM50071173 (3R,4R,4aS,8aR)-4-[(E)-2-((2S,6S)-1,6-Dimethyl-piperidin-2-yl)-vinyl]-3-methyl-decahydro-naphtho[2,3-c]furan-1-one CHEMBL59421
Inchi Key	FMPNFDSPHNUFOS-FIUWNGRQSA-N
Inchi ID	InChI=1S/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15+,16+,17-,18-,19+,20?,21?/m0/s1
PubChem CID	44302812
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50071173
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
82126	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
82131	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
82128	Muscarinic acetylcholine receptor M2	P10980	Chrm2	Rattus norvegicus (Rat)	466
82134	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
82130	Muscarinic acetylcholine receptor M3	P08483	Chrm3	Rattus norvegicus (Rat)	589
82133	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590
82127	Muscarinic acetylcholine receptor M4	P32211	Chrm4	Mus musculus (Mouse)	479
82129	Muscarinic acetylcholine receptor M4	P08173	CHRM4	Homo sapiens (Human)	479
82132	Muscarinic acetylcholine receptor M4	P17200	CHRM4	Gallus gallus (Chicken)	490
459962	Muscarinic acetylcholine receptor M4	P08485	Chrm4	Rattus norvegicus (Rat)	478
459961	Muscarinic acetylcholine receptor M5	P08912	CHRM5	Homo sapiens (Human)	532

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