General Property |
Molceule ID (DB) | EGIN0004993 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 8 |
IUPAC Name | 6,7â€dimethoxyâ€Nâ€[(1R)â€1â€(pyridinâ€2â€yl)ethyl]quinazolinâ€4â€amine |
Formula | C17H18N4O2 |
Mass | 310.3504 |
Exact Mass | 310.14297584 |
Composition | C (65.79%), H (5.85%), N (18.05%), O (10.31%) |
Atom Count | 41 |
PI | 11.4 |
Smiles | [H]N(C1=C2C([H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C([H])C2=NC([H])=N1)[C@@]([H])(C1=C([H])C([H])=C([H])C([H])=N1)C([H])([H])[H] |
InChI | 1S/C17H18N4O2/c1-11(13-6-4-5-7-18-13)21-17-12-8-15(22-2)16(23-3)9-14(12)19-10-20-17/h4-11H,1-3H3,(H,
19,20,21)/t11-/m1/s1 |
InChIKey | GXKPAVTVBCJIRK-LLVKDONJSA-N |
2D Structure | ![](./image/EGIN0004993.png) | Structure Backbone | ![](./frame/f_EGIN0004993.png) |
|
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 | 22607878 |
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 |
41235797
|
Drug Bank Link | - |
ChemSpider Link | 10959121 |
ChEMBL Link | - |