General Property |
Molceule ID (DB) | EGIN0000932 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 12 compound |
IUPAC Name | N-(3-methoxyphenyl)quinazolin-4-amine |
Formula | C15H13N3O |
Mass | 251.2832 |
Exact Mass | 251.1058621 |
Composition | C (71.7%), H (5.21%), N (16.72%), O (6.37%) |
Atom Count | 32 |
PI | 9.8 |
Smiles | c12c(cccc1)ncnc2Nc1cccc(c1)OC |
InChI | 1S/C15H13N3O/c1-19-12-6-4-5-11(9-12)18-15-13-7-2-3-8-14(13)16-10-17-15/h2-10H,1H3,(H,16,17,18) |
InChIKey | LCYPRFCDTJTQPG-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 |
712193
|
Drug Bank Link | - |
ChemSpider Link | 621213 |
ChEMBL Link | CHEMBL117697 |