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GLASS

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GPCR

Name	Olfactory receptor 5K1
Species	Homo sapiens (Human)
Gene	OR5K1
Synonym	HTPCRX10 Olfactory receptor OR3-8
Disease	N/A
Length	308
Amino acid sequence	MAEENHTMKNEFILTGFTDHPELKTLLFVVFFAIYLITVVGNISLVALIFTHRRLHTPMYIFLGNLALVDSCCACAITPKMLENFFSENKRISLYECAVQFYFLCTVETADCFLLAAMAYDRYVAICNPLQYHIMMSKKLCIQMTTGAFIAGNLHSMIHVGLVFRLVFCGSNHINHFYCDILPLYRLSCVDPYINELVLFIFSGSVQVFTIGSVLISYLYILLTIFKMKSKEGRAKAFSTCASHFLSVSLFYGSLFFMYVRPNLLEEGDKDIPAAILFTIVVPLLNPFIYSLRNREVISVLRKILMKK
UniProt	Q8NHB7
Protein Data Bank	N/A
GPCR-HGmod model	Q8NHB7
3D structure model	This predicted structure model is from GPCR-EXP Q8NHB7.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3721312
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Amberlyn
Molecular formula	C16H28O
IUPAC name	3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran
Molecular weight	236.399
Hydrogen bond acceptor	1
Hydrogen bond donor	0
XlogP	4.7
Synonyms	I14-24279 Tetramethyl-perhydronaphthofuran (?)-Ambroxide 3a,6,6,9a-Tetramethyl-dodecahydro-naphtho[2,1-b]furan AKOS024304456 Bicyclofarnesyl epoxide Dodecahydro-3a,6,6,9a-tetramethylnaphto(2,1-b)furan Naphtho(2,1-b)furan, dodecahydro-3a,6,6,9a-tetramethyl- 193980-58-4 3a,6,6,9a-tetramethylperhydronaphtho[2,1-b]furan Ambronide CHEMBL3728760 EC 223-118-6 SCHEMBL236500 3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e]benzofuran AC1Q70LC Ambroxide Dodecahydro-3a,6,6,9a-tetramethylnaphtho[2,1-.beta.]furan FEMA No. 3471 MCULE-9265330037 YPZUZOLGGMJZJO-UHFFFAOYSA-N 1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.04,9]tridecane 3a,6,6,9a-tetramethyl-dodecahydronaphtho[2,1-b]furan amber naphthofuran Cetalox Dodecahydrotetramethyl naphthofuran Naphtho[2,1-b]furan, dodecahydro-3a,6,6,9a-tetramethyl- 21582-36-5 A6613 Ambrotech Dodecahydro-3a,6,6,9a-tetramethylnaphtho(2,1-b)furan EINECS 223-118-6 ST50232842 3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran AKOS000621409 BAS 00511836 dodecahydro-3a,6,6,9a-tetramethylnaphtho[2,1-b]furan FT-0625565 N-Epoxide 1,6,10,10-tetramethyl-5-oxatricyclo[7.4.0.0<2,6>]tridecane 3a,6,6,9a-Tetramethyldodecahydronaphtho[2,1-b]furan DTXSID2048119 Naphtho[2,1-b]furan, dodecahydro-3a,6,6,9a-tetramethyl-, (3aR,5aS,9aS,9bR)- 3738-00-9 AC1L31L2 Ambrox Dodecahydro-3a,6,6,9a-tetramethylnaphtho(2,1-beta)furan FEMA 3471 [ Show all ]
Inchi Key	YPZUZOLGGMJZJO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3
PubChem CID	107166
ChEMBL	CHEMBL3728760
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Inhibition	50.0 %	None	ChEMBL

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