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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Melanocortin receptor 5
Species	Homo sapiens (Human)
Gene	MC5R
Synonym	melanocortin receptor 5 MC5R MC5-R MC5 receptor MC-2
Disease	Acne vulgaris Seborrhea
Length	325
Amino acid sequence	MNSSFHLHFLDLNLNATEGNLSGPNVKNKSSPCEDMGIAVEVFLTLGVISLLENILVIGAIVKNKNLHSPMYFFVCSLAVADMLVSMSSAWETITIYLLNNKHLVIADAFVRHIDNVFDSMICISVVASMCSLLAIAVDRYVTIFYALRYHHIMTARRSGAIIAGIWAFCTGCGIVFILYSESTYVILCLISMFFAMLFLLVSLYIHMFLLARTHVKRIAALPGASSARQRTSMQGAVTVTMLLGVFTVCWAPFFLHLTLMLSCPQNLYCSRFMSHFNMYLILIMCNSVMDPLIYAFRSQEMRKTFKEIICCRGFRIACSFPRRD
UniProt	P33032
Protein Data Bank	N/A
GPCR-HGmod model	P33032
3D structure model	This predicted structure model is from GPCR-EXP P33032.
BioLiP	N/A
Therapeutic Target Database	T95302
ChEMBL	CHEMBL4608
IUPHAR	286
DrugBank	N/A

Ligand

Name	SCHEMBL2347544
Molecular formula	C31H38N4O2
IUPAC name	N-[[(3S,5S)-3-(2-aminoethyl)-1-(2,2-diphenylethyl)-2-oxo-1,4-diazepan-5-yl]methyl]-3,4-dimethylbenzamide
Molecular weight	498.671
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	4.1
Synonyms	US9340517, 281 CHEMBL3970807 BDBM231894
Inchi Key	BTIWBRIJMDPPKC-YTMVLYRLSA-N
Inchi ID	InChI=1S/C31H38N4O2/c1-22-13-14-26(19-23(22)2)30(36)33-20-27-16-18-35(31(37)29(34-27)15-17-32)21-28(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-14,19,27-29,34H,15-18,20-21,32H2,1-2H3,(H,33,36)/t27-,29-/m0/s1
PubChem CID	57854280
ChEMBL	CHEMBL3970807
IUPHAR	N/A
BindingDB	231894
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	>1000.0 nM	, None	BindingDB,ChEMBL

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