General Property |
Molceule ID (DB) | EGIN0004145 |
Inhibitor Class | Homo-isoflavonoids |
Molecule Name in Refrence Article | SAPPANCHALCONE |
IUPAC Name | (2E)-3-(3,4-dihydroxyphenyl)-1-(4-hydroxy-2-methoxyphenyl)prop-2-en-1-one |
Formula | C16H14O5 |
Mass | 286.2794 |
Exact Mass | 286.0841236 |
Composition | C (67.13%), H (4.93%), O (27.94%) |
Atom Count | 35 |
PI | 1.49 |
Smiles | c1(cc(ccc1C(=O)/C=C/c1ccc(c(c1)O)O)O)OC |
InChI | 1S/C16H14O5/c1-21-16-9-11(17)4-5-12(16)13(18)6-2-10-3-7-14(19)15(20)8-10/h2-9,17,19-20H,1H3/b6-2+ |
InChIKey | JVGNTXGHBHMJDO-QHHAFSJGSA-N |
2D Structure | ![](./image/EGIN0004145.png) | Structure Backbone | ![](./frame/f_EGIN0004145.png) |
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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 | 18610999 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | c-Src | c-kit | FGFR2 | c-Met | KDR | FGFR1 | ALL |
Pub Chem Link |
5319493
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Drug Bank Link | - |
ChemSpider Link | 4477783 |
ChEMBL Link | CHEMBL476986 |