General Property |
Molceule ID (DB) | EGIN0002023 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 7a compound |
IUPAC Name | 3-(3-ethoxypropyl)-N-(4-methoxyphenyl)-2-(propan-2-yl)-3H-imidazo[4,5-g]quinazolin-8-amine |
Formula | C24H29N5O2 |
Mass | 419.5194 |
Exact Mass | 419.2321252 |
Composition | C (68.71%), H (6.97%), N (16.69%), O (7.63%) |
Atom Count | 60 |
PI | 10.99 |
Smiles | CCOCCCn1c(nc2cc3c(Nc4ccc(OC)cc4)ncnc3cc12)C(C)C |
InChI | 1S/C24H29N5O2/c1-5-31-12-6-11-29-22-14-20-19(13-21(22)28-24(29)16(2)3)23(26-15-25-20)27-17-7-9-18(30
-4)10-8-17/h7-10,13-16H,5-6,11-12H2,1-4H3,(H,25,26,27) |
InChIKey | QPXINYCZKGHJFY-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 |
25028882
|
Drug Bank Link | - |
ChemSpider Link | 23336604 |
ChEMBL Link | CHEMBL515709 |