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Name | CHEMBL249277 |
---|---|
Molecular formula | C33H44ClN7O2 |
IUPAC name | (3R)-N-[(2S)-3-(4-chlorophenyl)-1-[4-hexyl-4-[(1-methyltetrazol-5-yl)methyl]piperidin-1-yl]-1-oxopropan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
Molecular weight | 606.212 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 6.3 |
Synonyms | BDBM50220700 (R)-N-((S)-3-(4-chlorophenyl)-1-(4-hexyl-4-((1-methyl-1H-tetrazol-5-yl)methyl)piperidin-1-yl)-1-oxopropan-2-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
Inchi Key | AZJWJBAXGKDQCY-WDYNHAJCSA-N |
Inchi ID | InChI=1S/C33H44ClN7O2/c1-3-4-5-8-15-33(22-30-37-38-39-40(30)2)16-18-41(19-17-33)32(43)29(20-24-11-13-27(34)14-12-24)36-31(42)28-21-25-9-6-7-10-26(25)23-35-28/h6-7,9-14,28-29,35H,3-5,8,15-23H2,1-2H3,(H,36,42)/t28-,29+/m1/s1 |
PubChem CID | 44441645 |
ChEMBL | CHEMBL249277 |
IUPHAR | N/A |
BindingDB | 50220700 |
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. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
18245 | Melanocortin receptor 3 | P41968 | MC3R | Homo sapiens (Human) | 323 |
18244 | Melanocortin receptor 4 | P32245 | MC4R | Homo sapiens (Human) | 332 |
18246 | Melanocortin receptor 5 | P33032 | MC5R | Homo sapiens (Human) | 325 |
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