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Name | Melanocortin receptor 5 |
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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 |
Name | CHEMBL558787 |
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Molecular formula | C34H56Cl2FN5O3 |
IUPAC name | (2S,5S)-5-tert-butyl-N-[(2R)-1-[4-(tert-butylcarbamoyl)-4-cyclohexylpiperidin-1-yl]-3-(4-fluorophenyl)-1-oxopropan-2-yl]piperazine-2-carboxamide;dihydrochloride |
Molecular weight | 672.752 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 6 |
XlogP | None |
Synonyms | N/A |
Inchi Key | CFUPIPMTRHVHLI-MBLUMGMJSA-N |
Inchi ID | InChI=1S/C34H54FN5O3.2ClH/c1-32(2,3)28-22-36-27(21-37-28)29(41)38-26(20-23-12-14-25(35)15-13-23)30(42)40-18-16-34(17-19-40,24-10-8-7-9-11-24)31(43)39-33(4,5)6;;/h12-15,24,26-28,36-37H,7-11,16-22H2,1-6H3,(H,38,41)(H,39,43);2*1H/t26-,27+,28-;;/m1../s1 |
PubChem CID | 45263245 |
ChEMBL | CHEMBL558787 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Accumulation | 46.0 % | PMID15808454 | ChEMBL |
EC50 | 360.0 nM | PMID15808454 | ChEMBL |
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