General Property |
Molceule ID (DB) | EGIN0004617 |
Inhibitor Class | Indazole |
Molecule Name in Refrence Article | 14c |
IUPAC Name | 5-[4-(4-fluorophenyl)-1-[3-(morpholin-4-yl)propyl]-1H-imidazol-5-yl]-1H-indazole |
Formula | C23H24FN5O |
Mass | 405.468 |
Exact Mass | 405.1964886 |
Composition | C (68.13%), H (5.97%), F (4.69%), N (17.27%), O (3.95%) |
Atom Count | 54 |
PI | 10.6 |
Smiles | n1c(c(n(c1)CCCN1CCOCC1)c1cc2cn[nH]c2cc1)c1ccc(cc1)F |
InChI | 1S/C23H24FN5O/c24-20-5-2-17(3-6-20)22-23(18-4-7-21-19(14-18)15-26-27-21)29(16-25-22)9-1-8-28-10-12-3
0-13-11-28/h2-7,14-16H,1,8-13H2,(H,26,27) |
InChIKey | HLFSCVDUUVJVCD-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 | 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 | 26386086 |
ChEMBL Link | CHEMBL1682559 |