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| Name | CHEMBL566760 |
|---|---|
| Molecular formula | C32H37N9O5 |
| IUPAC name | N-[(2S)-1-[[(2R)-1-[[(2R)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-6-hydroxynaphthalene-2-carboxamide |
| Molecular weight | 627.706 |
| Hydrogen bond acceptor | 7 |
| Hydrogen bond donor | 8 |
| XlogP | 1.1 |
| Synonyms | BDBM50301139 N-((S)-1-((R)-1-((S)-1-amino-5-guanidino-1-oxopentan-2-ylamino)-1-oxo-3-phenylpropan-2-ylamino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl)-6-hydroxy-2-naphthamide |
| Inchi Key | DLOCVLGKPMETOO-PFBJBMPXSA-N |
| Inchi ID | InChI=1S/C32H37N9O5/c33-28(43)25(7-4-12-37-32(34)35)39-30(45)26(13-19-5-2-1-3-6-19)41-31(46)27(16-23-17-36-18-38-23)40-29(44)22-9-8-21-15-24(42)11-10-20(21)14-22/h1-3,5-6,8-11,14-15,17-18,25-27,42H,4,7,12-13,16H2,(H2,33,43)(H,36,38)(H,39,45)(H,40,44)(H,41,46)(H4,34,35,37)/t25-,26-,27+/m1/s1 |
| PubChem CID | 45487285 |
| ChEMBL | CHEMBL566760 |
| IUPHAR | N/A |
| BindingDB | 50301139 |
| DrugBank | N/A |
Structure |  |
| Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. |
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| GLASS ID | Name | UniProt | Gene | Species | Length |
|---|---|---|---|---|---|
| 63206 | Melanocortin receptor 5 | P41149 | Mc5r | Mus musculus (Mouse) | 325 |
| 63207 | Melanocyte-stimulating hormone receptor | Q01727 | Mc1r | Mus musculus (Mouse) | 315 |
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