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Name | CHEMBL433522 |
---|---|
Molecular formula | C31H41N11O5 |
IUPAC name | (2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-N-[(2R)-1-amino-1-oxo-3-pyridin-4-ylpropan-2-yl]-5-(diaminomethylideneamino)pentanamide |
Molecular weight | 647.741 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 8 |
XlogP | -1.2 |
Synonyms | Ac-His-D-Phe-Arg-4Pal-NH2 BDBM50122075 |
Inchi Key | GVMPDJLBXVWWIQ-QYOOZWMWSA-N |
Inchi ID | InChI=1S/C31H41N11O5/c1-19(43)39-26(16-22-17-36-18-38-22)30(47)42-25(15-20-6-3-2-4-7-20)29(46)40-23(8-5-11-37-31(33)34)28(45)41-24(27(32)44)14-21-9-12-35-13-10-21/h2-4,6-7,9-10,12-13,17-18,23-26H,5,8,11,14-16H2,1H3,(H2,32,44)(H,36,38)(H,39,43)(H,40,46)(H,41,45)(H,42,47)(H4,33,34,37)/t23-,24+,25-,26-/m0/s1 |
PubChem CID | 44369166 |
ChEMBL | CHEMBL433522 |
IUPHAR | N/A |
BindingDB | 50122075 |
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 |
---|---|---|---|---|---|
106378 | Melanocortin receptor 3 | P33033 | Mc3r | Mus musculus (Mouse) | 323 |
106375 | Melanocortin receptor 4 | P56450 | Mc4r | Mus musculus (Mouse) | 332 |
106377 | Melanocortin receptor 5 | P41149 | Mc5r | Mus musculus (Mouse) | 325 |
106376 | Melanocyte-stimulating hormone receptor | Q01727 | Mc1r | Mus musculus (Mouse) | 315 |
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