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Name | CHEMBL61681 |
---|---|
Molecular formula | C27H28N4O2 |
IUPAC name | (2S)-2-(benzylcarbamoylamino)-3-(1H-indol-3-yl)-N-[(3-methylphenyl)methyl]propanamide |
Molecular weight | 440.547 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 4 |
XlogP | 4.0 |
Synonyms | 2-(3-Benzyl-ureido)-3-(1H-indol-3-yl)-N-(3-methyl-benzyl)-propionamide BDBM50129183 |
Inchi Key | IBFSTESMBHZKAL-VWLOTQADSA-N |
Inchi ID | InChI=1S/C27H28N4O2/c1-19-8-7-11-21(14-19)17-29-26(32)25(15-22-18-28-24-13-6-5-12-23(22)24)31-27(33)30-16-20-9-3-2-4-10-20/h2-14,18,25,28H,15-17H2,1H3,(H,29,32)(H2,30,31,33)/t25-/m0/s1 |
PubChem CID | 44305815 |
ChEMBL | CHEMBL61681 |
IUPHAR | N/A |
BindingDB | 50129183 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
129055 | Melanocortin receptor 3 | P33033 | Mc3r | Mus musculus (Mouse) | 323 |
129054 | Melanocortin receptor 4 | P56450 | Mc4r | Mus musculus (Mouse) | 332 |
129056 | Melanocortin receptor 5 | P41149 | Mc5r | Mus musculus (Mouse) | 325 |
129057 | Melanocyte-stimulating hormone receptor | Q01727 | Mc1r | Mus musculus (Mouse) | 315 |
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