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Name | CHEMBL366275 |
---|---|
Molecular formula | C23H30N4O3S |
IUPAC name | (3S)-3-[[5-(4-hydroxyphenyl)thiophene-2-carbonyl]-methylamino]-N-methyl-N-[(3R)-1-methylpyrrolidin-3-yl]pyrrolidine-1-carboxamide |
Molecular weight | 442.578 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 2.6 |
Synonyms | (S)-3-{[5-(4-Hydroxy-phenyl)-thiophene-2-carbonyl]-methyl-amino}-pyrrolidine-1-carboxylic acid methyl-((R)-1-methyl-pyrrolidin-3-yl)-amide BDBM50168604 |
Inchi Key | ACAQLIGFZSPXGR-MSOLQXFVSA-N |
Inchi ID | InChI=1S/C23H30N4O3S/c1-24-12-10-17(14-24)26(3)23(30)27-13-11-18(15-27)25(2)22(29)21-9-8-20(31-21)16-4-6-19(28)7-5-16/h4-9,17-18,28H,10-15H2,1-3H3/t17-,18+/m1/s1 |
PubChem CID | 44397203 |
ChEMBL | CHEMBL366275 |
IUPHAR | N/A |
BindingDB | 50168604 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
1377 | Melanin-concentrating hormone receptor 1 | Q99705 | MCHR1 | Homo sapiens (Human) | 422 |
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