| General Property |
| Molceule ID (DB) | EGIN0002252 |
| Inhibitor Class | Benzo-thiazole |
| Molecule Name in Refrence Article | 21 compound |
| IUPAC Name | N-[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]-7-chloroquinolin-4-amine |
| Formula | C23H16ClN3OS |
| Mass | 417.911 |
| Exact Mass | 417.0702605 |
| Composition | C (66.1%), H (3.86%), Cl (8.48%), N (10.05%), O (3.83%), S (7.67%) |
| Atom Count | 45 |
| PI | 12.23 |
| Smiles | c1c(ccc(c1OC)c1nc2c(s1)cccc2)Nc1ccnc2c1ccc(c2)Cl |
| InChI | 1S/C23H16ClN3OS/c1-28-21-13-15(26-18-10-11-25-20-12-14(24)6-8-16(18)20)7-9-17(21)23-27-19-4-2-3-5-22
(19)29-23/h2-13H,1H3,(H,25,26) |
| InChIKey | KLXVOIRVJURYJX-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 | 19211246 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Aurora A | Aurora B | EphB4 | IGF1R | InsR | Src | TIE2 | VEGFR2 | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 23335930 |
| ChEMBL Link | CHEMBL474544 |
