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Name | Melanocortin receptor 4 |
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Species | Homo sapiens (Human) |
Gene | MC4R |
Synonym | MC4-R MC4 receptor |
Disease | Obesity; Sexual dysfunction Obesity; Diabetes Obesity Metabolic disorders Sexual dysfunction [ Show all ] |
Length | 332 |
Amino acid sequence | MVNSTHRGMHTSLHLWNRSSYRLHSNASESLGKGYSDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVKRVGIIISCIWAACTVSGILFIIYSDSSAVIICLITMFFTMLALMASLYVHMFLMARLHIKRIAVLPGTGAIRQGANMKGAITLTILIGVFVVCWAPFFLHLIFYISCPQNPYCVCFMSHFNLYLILIMCNSIIDPLIYALRSQELRKTFKEIICCYPLGGLCDLSSRY |
UniProt | P32245 |
Protein Data Bank | N/A |
GPCR-HGmod model | P32245 |
3D structure model | This predicted structure model is from GPCR-EXP P32245. |
BioLiP | N/A |
Therapeutic Target Database | T72458 |
ChEMBL | CHEMBL259 |
IUPHAR | 285 |
DrugBank | N/A |
Name | CHEMBL557585 |
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Molecular formula | C35H45F2N3 |
IUPAC name | 1-[3-[2-(3-fluorophenyl)phenyl]propyl]-4-[2-(4-fluorophenyl)-2-(1-propan-2-ylpiperidin-4-yl)ethyl]piperazine |
Molecular weight | 545.763 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 7.5 |
Synonyms | BDBM50203994 (+/-)-1-[3-(30-fluorobiphenyl-2-yl)propyl]-4-[2-(4-fluorophenyl)-2-(1-isopropylpiperidin-4-yl)ethyl]piperazine trihydrochloride CHEMBL1196602 |
Inchi Key | BXMQVSMCTWXOEI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C35H45F2N3/c1-27(2)40-19-16-30(17-20-40)35(29-12-14-32(36)15-13-29)26-39-23-21-38(22-24-39)18-6-9-28-7-3-4-11-34(28)31-8-5-10-33(37)25-31/h3-5,7-8,10-15,25,27,30,35H,6,9,16-24,26H2,1-2H3 |
PubChem CID | 44423382 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50203994 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 23.4 nM | PMID17267226 | BindingDB |
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