General Property |
Molceule ID (DB) | EGIN0000260 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 20 compound |
IUPAC Name | N-(3-bromophenyl)-1H-pyrazolo[4,3-g]quinazolin-5-amine |
Formula | C15H10BrN5 |
Mass | 340.177 |
Exact Mass | 339.011958 |
Composition | C (52.96%), H (2.96%), Br (23.49%), N (20.59%) |
Atom Count | 31 |
PI | 8.12 |
Smiles | c12c(cc3c(c1)cn[nH]3)ncnc2Nc1cccc(c1)Br |
InChI | 1S/C15H10BrN5/c16-10-2-1-3-11(5-10)20-15-12-4-9-7-19-21-13(9)6-14(12)17-8-18-15/h1-8H,(H,19,21)(H,17
,18,20) |
InChIKey | ORCWMSOZENFEDR-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 | 8632415 | 9154973 | 10639288 | |
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 |
5328242
|
Drug Bank Link | - |
ChemSpider Link | 4485407 |
ChEMBL Link | CHEMBL39337 |