General Property |
Molceule ID (DB) | EGIN0000266 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 21 compound |
IUPAC Name | N-(3-bromophenyl)-8H-pyrrolo[3,2-g]quinazolin-4-amine |
Formula | C16H11BrN4 |
Mass | 339.189 |
Exact Mass | 338.016709 |
Composition | C (56.66%), H (3.27%), Br (23.56%), N (16.52%) |
Atom Count | 32 |
PI | 9.37 |
Smiles | c12c(cc3c(c1)cc[nH]3)ncnc2Nc1cccc(c1)Br |
InChI | 1S/C16H11BrN4/c17-11-2-1-3-12(7-11)21-16-13-6-10-4-5-18-14(10)8-15(13)19-9-20-16/h1-9,18H,(H,19,20,2
1) |
InChIKey | BBFWQWIFLDQYQQ-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000266.png) | Structure Backbone | ![](./frame/f_EGIN0000266.png) |
|
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 |
5328243
|
Drug Bank Link | - |
ChemSpider Link | 4485408 |
ChEMBL Link | CHEMBL40734 |