General Property |
Molceule ID (DB) | EGIN0000678 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 5h compound |
IUPAC Name | N-(3-bromophenyl)-7-methoxypyrido[4,3-d]pyrimidin-4-amine |
Formula | C14H11BrN4O |
Mass | 331.167 |
Exact Mass | 330.0116236 |
Composition | C (50.77%), H (3.35%), Br (24.13%), N (16.92%), O (4.83%) |
Atom Count | 31 |
PI | 9.77 |
Smiles | c12c(cc(nc1)OC)ncnc2Nc1cccc(c1)Br |
InChI | 1S/C14H11BrN4O/c1-20-13-6-12-11(7-16-13)14(18-8-17-12)19-10-4-2-3-9(15)5-10/h2-8H,1H3,(H,17,18,19) |
InChIKey | VBKYHRRXRGHYHL-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000678.png) | Structure Backbone | ![](./frame/f_EGIN0000678.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 | 8627606 |
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 |
5328254
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Drug Bank Link | - |
ChemSpider Link | 4485419 |
ChEMBL Link | CHEMBL53375 |