General Property |
Molceule ID (DB) | EGIN0002028 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 7f compound |
IUPAC Name | 3-(3-ethoxypropyl)-2-hexyl-N-(4-methoxyphenyl)-3H-imidazo[4,5-g]quinazolin-8-amine |
Formula | C27H35N5O2 |
Mass | 461.5991 |
Exact Mass | 461.2790754 |
Composition | C (70.25%), H (7.64%), N (15.17%), O (6.93%) |
Atom Count | 69 |
PI | 11.03 |
Smiles | CCCCCCc1nc2cc3c(Nc4ccc(OC)cc4)ncnc3cc2n1CCCOCC |
InChI | 1S/C27H35N5O2/c1-4-6-7-8-10-26-31-24-17-22-23(18-25(24)32(26)15-9-16-34-5-2)28-19-29-27(22)30-20-11-
13-21(33-3)14-12-20/h11-14,17-19H,4-10,15-16H2,1-3H3,(H,28,29,30) |
InChIKey | CJEGRDJOHZPXTL-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 |
25029344
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Drug Bank Link | - |
ChemSpider Link | 23336701 |
ChEMBL Link | CHEMBL473196 |