General Property |
Molceule ID (DB) | EGIN0003410 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 5 compound |
IUPAC Name | 4-N-(3-methylphenyl)quinazoline-4,6-diamine |
Formula | C15H14N4 |
Mass | 250.2985 |
Exact Mass | 250.1218465 |
Composition | C (71.98%), H (5.64%), N (22.38%) |
Atom Count | 33 |
PI | 10.78 |
Smiles | c1(c2c(ncn1)ccc(c2)N)Nc1cc(ccc1)C |
InChI | 1S/C15H14N4/c1-10-3-2-4-12(7-10)19-15-13-8-11(16)5-6-14(13)17-9-18-15/h2-9H,16H2,1H3,(H,17,18,19) |
InChIKey | NFBCSWGEYDCCDW-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
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 | 13678409 | 16759097 | |
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 |
10220590
|
Drug Bank Link | - |
ChemSpider Link | 8396082 |
ChEMBL Link | CHEMBL336113 |