General Property |
Molceule ID (DB) | EGIN0003267 |
Inhibitor Class | Iso-quinolinone |
Molecule Name in Refrence Article | 20 compound |
IUPAC Name | 2-[(2,6-dichlorophenyl)amino]-6,7-dimethyl-1H,8H,9H-imidazo[4,5-h]isoquinolin-9-one |
Formula | C18H14Cl2N4O |
Mass | 373.236 |
Exact Mass | 372.0544665 |
Composition | C (57.92%), H (3.78%), Cl (19%), N (15.01%), O (4.29%) |
Atom Count | 39 |
PI | 6.8 |
Smiles | c12c(c([nH]c(=O)c1c1c(cc2)nc([nH]1)Nc1c(Cl)cccc1Cl)C)C |
InChI | 1S/C18H14Cl2N4O/c1-8-9(2)21-17(25)14-10(8)6-7-13-16(14)24-18(22-13)23-15-11(19)4-3-5-12(15)20/h3-7H,
1-2H3,(H,21,25)(H2,22,23,24) |
InChIKey | YDEDKRCWCCZXBE-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0003267.png) | Structure Backbone | ![](./frame/f_EGIN0003267.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 | 12139450 | 12166950 | |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | ZAP70 | Syk | c-Src | Lck | ALL |
Pub Chem Link |
10248747
|
Drug Bank Link | - |
ChemSpider Link | 8424234 |
ChEMBL Link | CHEMBL27085 |