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Name | CHEMBL1784212 |
---|---|
Molecular formula | C23H23ClN4O3 |
IUPAC name | ethyl 5-chloro-6-[4-(naphthalen-1-ylcarbamoyl)piperazin-1-yl]pyridine-3-carboxylate |
Molecular weight | 438.912 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.1 |
Synonyms | SCHEMBL3927682 AYLATHCHTKLRSS-UHFFFAOYSA-N ZINC71295055 BDBM50345326 ethyl 5-chloro-6-{4-[(1-naphthylamino)carbonyl]piperazin-1-yl}nicotinate |
Inchi Key | AYLATHCHTKLRSS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H23ClN4O3/c1-2-31-22(29)17-14-19(24)21(25-15-17)27-10-12-28(13-11-27)23(30)26-20-9-5-7-16-6-3-4-8-18(16)20/h3-9,14-15H,2,10-13H2,1H3,(H,26,30) |
PubChem CID | 24751997 |
ChEMBL | CHEMBL1784212 |
IUPHAR | N/A |
BindingDB | 50345326 |
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 |
---|---|---|---|---|---|
17548 | P2Y purinoceptor 12 | Q9H244 | P2RY12 | Homo sapiens (Human) | 342 |
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