General Property |
Molceule ID (DB) | EGIN0003214 |
Inhibitor Class | Anilino-quinoline |
Molecule Name in Refrence Article | 17 compound |
IUPAC Name | 2-(morpholin-4-ylmethyl)-8-[(3,4,5-trimethoxyphenyl)amino]-3H-imidazo[4,5-g]quinoline-7-carbonitrile |
Formula | C25H26N6O4 |
Mass | 474.5117 |
Exact Mass | 474.2015534 |
Composition | C (63.28%), H (5.52%), N (17.71%), O (13.49%) |
Atom Count | 61 |
PI | 8.16 |
Smiles | n1c([nH]c2c1cc1c(c(C#N)cnc1c2)Nc1cc(c(c(c1)OC)OC)OC)CN1CCOCC1 |
InChI | 1S/C25H26N6O4/c1-32-21-8-16(9-22(33-2)25(21)34-3)28-24-15(12-26)13-27-18-11-20-19(10-17(18)24)29-23(
30-20)14-31-4-6-35-7-5-31/h8-11,13H,4-7,14H2,1-3H3,(H,27,28)(H,29,30) |
InChIKey | XSYYWJFYCMWCAC-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 | 12217371 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | Src | |
Pub Chem Link |
5330119
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Drug Bank Link | - |
ChemSpider Link | 4487270 |
ChEMBL Link | CHEMBL330657 |