General Property |
Molceule ID (DB) | EGIN0001102 |
Inhibitor Class | Pyrimidine |
Molecule Name in Refrence Article | 18 Compound |
IUPAC Name | 4-N-(3H-indazol-5-ylmethyl)-5-[(1E)-(methoxyimino)methyl]pyrimidine-4,6-diamine |
Formula | C14H15N7O |
Mass | 297.3152 |
Exact Mass | 297.1338081 |
Composition | C (56.56%), H (5.09%), N (32.98%), O (5.38%) |
Atom Count | 37 |
PI | 10 |
Smiles | N(c1c(c(ncn1)N)/C=N/OC)Cc1cc2c(cc1)N=NC2 |
InChI | 1S/C14H15N7O/c1-22-20-7-11-13(15)17-8-18-14(11)16-5-9-2-3-12-10(4-9)6-19-21-12/h2-4,7-8H,5-6H2,1H3,(
H3,15,16,17,18)/b20-7+ |
InChIKey | QKXBPASIGUJGGA-IFRROFPPSA-N |
2D Structure | ![](./image/EGIN0001102.png) | Structure Backbone | ![](./frame/f_EGIN0001102.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 | 18508264 |
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 |
-
|
Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | CHEMBL255866 |