General Property |
Molceule ID (DB) | EGIN0002691 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 7w compound |
IUPAC Name | 3-({7-aminopyrido[4,3-d]pyrimidin-4-yl}amino)phenol |
Formula | C13H11N5O |
Mass | 253.2593 |
Exact Mass | 253.09636 |
Composition | C (61.65%), H (4.38%), N (27.65%), O (6.32%) |
Atom Count | 30 |
PI | 7.45 |
Smiles | c1(c2c(cc(nc2)N)ncn1)Nc1cc(O)ccc1 |
InChI | 1S/C13H11N5O/c14-12-5-11-10(6-15-12)13(17-7-16-11)18-8-2-1-3-9(19)4-8/h1-7,19H,(H2,14,15)(H,16,17,18
) |
InChIKey | UNRPCVUDZXTDLE-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 | 7562908 |
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 |
5328072
|
Drug Bank Link | - |
ChemSpider Link | 4485239 |
ChEMBL Link | CHEMBL123322 |