General Property |
Molceule ID (DB) | EGIN0001379 |
Inhibitor Class | Pyrrolo-triazine |
Molecule Name in Refrence Article | 5d compound |
IUPAC Name | ethyl 4-(benzylamino)-5-ethylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate |
Formula | C18H20N4O2 |
Mass | 324.377 |
Exact Mass | 324.1586259 |
Composition | C (66.65%), H (6.21%), N (17.27%), O (9.86%) |
Atom Count | 44 |
PI | 9.33 |
Smiles | n1cnn2c(c1NCc1ccccc1)c(c(c2)C(=O)OCC)CC |
InChI | 1S/C18H20N4O2/c1-3-14-15(18(23)24-4-2)11-22-16(14)17(20-12-21-22)19-10-13-8-6-5-7-9-13/h5-9,11-12H,3
-4,10H2,1-2H3,(H,19,20,21) |
InChIKey | FKTDPTZOFGBLDH-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0001379.png) | Structure Backbone | ![](./frame/f_EGIN0001379.png) |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 16111887 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
44403081
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Drug Bank Link | - |
ChemSpider Link | 23261315 |
ChEMBL Link | CHEMBL371863 |