General Property |
Molceule ID (DB) | EGIN0002032 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 7j compound |
IUPAC Name | N-(4-methoxyphenyl)-3-(3-methoxypropyl)-2-(propan-2-yl)-3H-imidazo[4,5-g]quinazolin-8-amine |
Formula | C23H27N5O2 |
Mass | 405.4928 |
Exact Mass | 405.2164751 |
Composition | C (68.13%), H (6.71%), N (17.27%), O (7.89%) |
Atom Count | 57 |
PI | 10.99 |
Smiles | COCCCn1c(nc2cc3c(Nc4ccc(OC)cc4)ncnc3cc12)C(C)C |
InChI | 1S/C23H27N5O2/c1-15(2)23-27-20-12-18-19(13-21(20)28(23)10-5-11-29-3)24-14-25-22(18)26-16-6-8-17(30-4
)9-7-16/h6-9,12-15H,5,10-11H2,1-4H3,(H,24,25,26) |
InChIKey | HRPLGWYBAIJFII-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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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 | 18313807 |
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 |
25198678
|
Drug Bank Link | - |
ChemSpider Link | 23336748 |
ChEMBL Link | CHEMBL474968 |