| General Property |
| Molceule ID (DB) | EGIN0000316 |
| Inhibitor Class | Oxazepine |
| Molecule Name in Refrence Article | 2a compound |
| IUPAC Name | 13,14-dimethoxy-N-(3-methylphenyl)-2-oxa-4,6,9-triazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-7-amine |
| Formula | C20H20N4O3 |
| Mass | 364.3978 |
| Exact Mass | 364.1535405 |
| Composition | C (65.92%), H (5.53%), N (15.38%), O (13.17%) |
| Atom Count | 47 |
| PI | 7.96 |
| Smiles | c12c(ncnc1Nc1cc(ccc1)C)Oc1c(CN2)cc(c(c1)OC)OC |
| InChI | 1S/C20H20N4O3/c1-12-5-4-6-14(7-12)24-19-18-20(23-11-22-19)27-15-9-17(26-3)16(25-2)8-13(15)10-21-18/h
4-9,11,21H,10H2,1-3H3,(H,22,23,24) |
| InChIKey | KTEORODSZODNSV-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 | 16887347 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | KDR or VEGFR2 | |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 23275832 |
| ChEMBL Link | CHEMBL386365 |
