General Property |
Molceule ID (DB) | EGIN0000933 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 13 compound |
IUPAC Name | N-(3-methylphenyl)quinazolin-4-amine |
Formula | C15H13N3 |
Mass | 235.2838 |
Exact Mass | 235.1109474 |
Composition | C (76.57%), H (5.57%), N (17.86%) |
Atom Count | 31 |
PI | 10.05 |
Smiles | c12c(cccc1)ncnc2Nc1cccc(c1)C |
InChI | 1S/C15H13N3/c1-11-5-4-6-12(9-11)18-15-13-7-2-3-8-14(13)16-10-17-15/h2-10H,1H3,(H,16,17,18) |
InChIKey | AHFDWKXLJCGQHE-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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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 | 7658435 | 8825124 | |
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 |
659954
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Drug Bank Link | - |
ChemSpider Link | 573869 |
ChEMBL Link | CHEMBL441083 |