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Name | CHEMBL3701931 |
---|---|
Molecular formula | C16H18ClN3O |
IUPAC name | N-[(6-chloropyridin-3-yl)methyl]-4-[(2S)-morpholin-2-yl]aniline |
Molecular weight | 303.79 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 2.3 |
Synonyms | US8802673, 32 BDBM129390 SCHEMBL12609757 |
Inchi Key | KKRDGEPWROLZPG-OAHLLOKOSA-N |
Inchi ID | InChI=1S/C16H18ClN3O/c17-16-6-1-12(10-20-16)9-19-14-4-2-13(3-5-14)15-11-18-7-8-21-15/h1-6,10,15,18-19H,7-9,11H2/t15-/m1/s1 |
PubChem CID | 86766833 |
ChEMBL | CHEMBL3701931 |
IUPHAR | N/A |
BindingDB | 129390 |
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 |
---|---|---|---|---|---|
171435 | Trace amine-associated receptor 1 | Q923Y8 | Taar1 | Mus musculus (Mouse) | 332 |
171436 | Trace amine-associated receptor 7b | Q923X8 | Taar7b | Rattus norvegicus (Rat) | 358 |
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