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Name | CHEMBL3958082 |
---|---|
Molecular formula | C33H42N4O2 |
IUPAC name | N-[[(3R,5R)-3-(3-aminopropyl)-1-[cyclohexyl(phenyl)methyl]-2-oxo-1,4-diazepan-5-yl]methyl]naphthalene-2-carboxamide |
Molecular weight | 526.725 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 5.5 |
Synonyms | US9340517, 342 BDBM231955 |
Inchi Key | BGANJFJLMKQWLV-KCUXUGRMSA-N |
Inchi ID | InChI=1S/C33H42N4O2/c34-20-9-16-30-33(39)37(31(25-11-3-1-4-12-25)26-13-5-2-6-14-26)21-19-29(36-30)23-35-32(38)28-18-17-24-10-7-8-15-27(24)22-28/h1,3-4,7-8,10-12,15,17-18,22,26,29-31,36H,2,5-6,9,13-14,16,19-21,23,34H2,(H,35,38)/t29-,30-,31?/m1/s1 |
PubChem CID | 127054172 |
ChEMBL | CHEMBL3958082 |
IUPHAR | N/A |
BindingDB | 231955 |
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 |
---|---|---|---|---|---|
533999 | Melanocortin receptor 5 | P33032 | MC5R | Homo sapiens (Human) | 325 |
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