General Property |
Molceule ID (DB) | EGIN0004571 |
Inhibitor Class | Pyrimidine |
Molecule Name in Refrence Article | 2b |
IUPAC Name | 2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine |
Formula | C18H18N4O2 |
Mass | 322.3611 |
Exact Mass | 322.1429758 |
Composition | C (67.07%), H (5.63%), N (17.38%), O (9.93%) |
Atom Count | 42 |
PI | 8.53 |
Smiles | c1nc(nc(c1)Nc1ccccc1OC)Nc1c(cccc1)OC |
InChI | 1S/C18H18N4O2/c1-23-15-9-5-3-7-13(15)20-17-11-12-19-18(22-17)21-14-8-4-6-10-16(14)24-2/h3-12H,1-2H3,
(H2,19,20,21,22) |
InChIKey | RPHIAMNJFYVZHV-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 | 22227214 |
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 |
16004616
|
Drug Bank Link | - |
ChemSpider Link | 13134888 |
ChEMBL Link | CHEMBL1947046 |