General Property |
Molceule ID (DB) | EGIN0003937 |
Inhibitor Class | Methanone |
Molecule Name in Refrence Article | 67 compound |
IUPAC Name | 2-[(1H-indol-2-yl)carbonyl]-1H-indol-5-yl 2-methoxyacetate |
Formula | C20H16N2O4 |
Mass | 348.352 |
Exact Mass | 348.111007 |
Composition | C (68.96%), H (4.63%), N (8.04%), O (18.37%) |
Atom Count | 42 |
PI | 3.93 |
Smiles | c1([nH]c2c(c1)cc(OC(=O)COC)cc2)C(=O)c1[nH]c2c(c1)cccc2 |
InChI | 1S/C20H16N2O4/c1-25-11-19(23)26-14-6-7-16-13(8-14)10-18(22-16)20(24)17-9-12-4-2-3-5-15(12)21-17/h2-1
0,21-22H,11H2,1H3 |
InChIKey | LAVORGSZCUQIGI-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 | 11855980 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | GRK2 | PDGF beta R | PKC | PKC | ALL |
Pub Chem Link |
644356
|
Drug Bank Link | - |
ChemSpider Link | 559360 |
ChEMBL Link | CHEMBL7600 |