General Property |
Molceule ID (DB) | EGIN0000663 |
Inhibitor Class | Pyrimido-Pyrimidine |
Molecule Name in Refrence Article | 6a compound |
IUPAC Name | 6-chloro-N-(3-methylphenyl)-[1,3]diazino[5,4-d]pyrimidin-4-amine |
Formula | C13H10ClN5 |
Mass | 271.705 |
Exact Mass | 271.0624731 |
Composition | C (57.47%), H (3.71%), Cl (13.05%), N (25.78%) |
Atom Count | 29 |
PI | 7.5 |
Smiles | c12c(cnc(n1)Cl)ncnc2Nc1cccc(c1)C |
InChI | 1S/C13H10ClN5/c1-8-3-2-4-9(5-8)18-12-11-10(16-7-17-12)6-15-13(14)19-11/h2-7H,1H3,(H,16,17,18) |
InChIKey | QMOSIXMIXVFZRG-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000663.png) | Structure Backbone | ![](./frame/f_EGIN0000663.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 | 9191958 |
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 |
5328344
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Drug Bank Link | - |
ChemSpider Link | 4485509 |
ChEMBL Link | CHEMBL52823 |