Structure details of probe GSK620
| GSK620 | |
|---|---|
|
|
| IUPAC name | 1-benzyl-5-(cyclopropylamino-formyl)-3-(methylamino-formyl)-1,2-dihydro-pyridin-2-one |
| Molecular weight | 325.14 g/mol |
| SMILES | CNC(C1=CC(=CN(Cc2ccccc2)C1=O)C(NC1CC1)=O)=O |
| InChi | InChI=1S/C18H19N3O3/c1-19-17(23)15-9-13(16(22)20-14-7-8-14)11-21(18(15)24)10-12-5-3-2-4-6-12/h2-6,9,11,14H,7-8,10H2,1H3,(H,19,23)(H,20,22) |
| InChi key | QZZCUOVXHPAQRQ-UHFFFAOYSA-N |
| Molecular formular | C18H19N3O3 |
| Number of chiral centres | 0 |
| Number of rotational bonds | 7 |
| Number of hydrogen bond acceptors | 6 |
| Number of hydrogen bond donors | 2 |