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Name | CHEMBL1254711 |
---|---|
Molecular formula | C30H37ClN4O6 |
IUPAC name | N-[(3R,4R,5S,6R)-2-[(4-chlorophenyl)methoxy]-5-hydroxy-6-(methoxymethyl)-4-(naphthalen-2-ylmethoxy)oxan-3-yl]-4-(diaminomethylideneamino)butanamide |
Molecular weight | 585.098 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 4 |
XlogP | 2.1 |
Synonyms | BDBM50326860 N-((3R,4R,5S,6R)-2-(4-chlorobenzyloxy)-5-hydroxy-6-(methoxymethyl)-4-(naphthalen-2-ylmethoxy)tetrahydro-2H-pyran-3-yl)-4-(diaminomethyleneamino)butanamide |
Inchi Key | AKJBLRLZAFYIJF-MTUUNIGCSA-N |
Inchi ID | InChI=1S/C30H37ClN4O6/c1-38-18-24-27(37)28(39-17-20-8-11-21-5-2-3-6-22(21)15-20)26(35-25(36)7-4-14-34-30(32)33)29(41-24)40-16-19-9-12-23(31)13-10-19/h2-3,5-6,8-13,15,24,26-29,37H,4,7,14,16-18H2,1H3,(H,35,36)(H4,32,33,34)/t24-,26-,27-,28-,29?/m1/s1 |
PubChem CID | 10054046 |
ChEMBL | CHEMBL1254711 |
IUPHAR | N/A |
BindingDB | 50326860 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
7599 | Melanin-concentrating hormone receptor 1 | Q99705 | MCHR1 | Homo sapiens (Human) | 422 |
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