| General Property |
| Molceule ID (DB) | EGIN0000360 |
| Inhibitor Class | Diazepine |
| Molecule Name in Refrence Article | 4ecompound |
| IUPAC Name | 13,14-dimethoxy-N-[(1S)-1-phenylethyl]-2,4,6,9-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-7-amine |
| Formula | C21H23N5O2 |
| Mass | 377.4396 |
| Exact Mass | 377.185175 |
| Composition | C (66.83%), H (6.14%), N (18.55%), O (8.48%) |
| Atom Count | 51 |
| PI | 10.3 |
| Smiles | c12c(ncnc1N[C@H](c1ccccc1)C)Nc1c(CN2)cc(c(c1)OC)OC |
| InChI | 1S/C21H23N5O2/c1-13(14-7-5-4-6-8-14)25-20-19-21(24-12-23-20)26-16-10-18(28-3)17(27-2)9-15(16)11-22-1
9/h4-10,12-13,22H,11H2,1-3H3,(H2,23,24,25,26)/t13-/m0/s1 |
| InChIKey | LPWLEMJTQPNOMS-ZDUSSCGKSA-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 | 23275979 |
| ChEMBL Link | CHEMBL379001 |
