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Name | CHEMBL3912899 |
---|---|
Molecular formula | C24H29F4N5O3 |
IUPAC name | (2S)-1-[2-(2,2-difluoroethylamino)-3-[4-(2,4-difluorophenoxy)piperidin-1-yl]-7,8-dihydro-5H-pyrido[3,4-b]pyrazin-6-yl]-2-methoxypropan-1-one |
Molecular weight | 511.522 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 1 |
XlogP | 3.5 |
Synonyms | US9181249, 99 BDBM190986 FQWWKVZBYLUHMI-AWEZNQCLSA-N (S)-1-(2-(2,2-difluoroethylamino)-3-(4-(2,4-difluorophenoxy)piperidin-1-yl)-7,8-dihydropyrido[3,4-b]pyrazin-6(5H)-yl)-2-methoxypropan-1-one SCHEMBL16818157 |
Inchi Key | FQWWKVZBYLUHMI-AWEZNQCLSA-N |
Inchi ID | InChI=1S/C24H29F4N5O3/c1-14(35-2)24(34)33-10-7-18-19(13-33)31-23(22(30-18)29-12-21(27)28)32-8-5-16(6-9-32)36-20-4-3-15(25)11-17(20)26/h3-4,11,14,16,21H,5-10,12-13H2,1-2H3,(H,29,30)/t14-/m0/s1 |
PubChem CID | 118159176 |
ChEMBL | CHEMBL3912899 |
IUPHAR | N/A |
BindingDB | 190986 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
538094 | G-protein coupled receptor 6 | P46095 | GPR6 | Homo sapiens (Human) | 362 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218