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Name | CHEMBL499582 |
---|---|
Molecular formula | C33H37N5O4 |
IUPAC name | 3-[4-[1-[[2-(6,7-dimethyl-2-oxoquinoxalin-1-yl)acetyl]-methylamino]-2-morpholin-4-ylethyl]phenyl]-N-methylbenzamide |
Molecular weight | 567.69 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.2 |
Synonyms | BDBM50244018 SCHEMBL2948389 4''-(1-{[2-(6,7-Dimethyl-2-oxo-2H-quinoxalin-1-yl)-acetyl]-methyl-amino}-2-morpholin-4-yl-ethyl)-biphenyl-3-carboxylic acid methylamide |
Inchi Key | DWAGGUQJLSNEEU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C33H37N5O4/c1-22-16-28-29(17-23(22)2)38(31(39)19-35-28)21-32(40)36(4)30(20-37-12-14-42-15-13-37)25-10-8-24(9-11-25)26-6-5-7-27(18-26)33(41)34-3/h5-11,16-19,30H,12-15,20-21H2,1-4H3,(H,34,41) |
PubChem CID | 44561237 |
ChEMBL | CHEMBL499582 |
IUPHAR | N/A |
BindingDB | 50244018 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
70420 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
70421 | Urotensin-2 receptor | Q9UKP6 | UTS2R | Homo sapiens (Human) | 389 |
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