| General Property |
| Molceule ID (DB) | EGIN0004615 |
| Inhibitor Class | Indazole |
| Molecule Name in Refrence Article | 14d |
| IUPAC Name | 5-{1-[(3S)-1-benzylpyrrolidin-3-yl]-4-(4-fluorophenyl)-1H-imidazol-5-yl}-1H-indazole |
| Formula | C27H24FN5 |
| Mass | 437.5114 |
| Exact Mass | 437.201574 |
| Composition | C (74.12%), H (5.53%), F (4.34%), N (16.01%) |
| Atom Count | 57 |
| PI | 11.41 |
| Smiles | n1c(c(n(c1)[C@@H]1CN(CC1)Cc1ccccc1)c1cc2cn[nH]c2cc1)c1ccc(cc1)F |
| InChI | 1S/C27H24FN5/c28-23-9-6-20(7-10-23)26-27(21-8-11-25-22(14-21)15-30-31-25)33(18-29-26)24-12-13-32(17-
24)16-19-4-2-1-3-5-19/h1-11,14-15,18,24H,12-13,16-17H2,(H,30,31)/t24-/m0/s1 |
| InChIKey | PJNPAVYZHHPABL-DEOSSOPVSA-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 | 21288717 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Kdr | Pim1 | Rock2 | Gsk3b | Aurora2 | Pak4 | Jak2 | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 26386121 |
| ChEMBL Link | - |
