General Property |
Molceule ID (DB) | EGIN0004144 |
Inhibitor Class | Chalcone |
Molecule Name in Refrence Article | BUTEIN |
IUPAC Name | (2E)-1-(2,4-dihydroxyphenyl)-3-(3,4-dihydroxyphenyl)prop-2-en-1-one |
Formula | C15H12O5 |
Mass | 272.2528 |
Exact Mass | 272.0684735 |
Composition | C (66.17%), H (4.44%), O (29.38%) |
Atom Count | 32 |
PI | No isoelectric point. |
Smiles | c1(cc(ccc1C(=O)/C=C/c1ccc(c(c1)O)O)O)O |
InChI | 1S/C15H12O5/c16-10-3-4-11(14(19)8-10)12(17)5-1-9-2-6-13(18)15(20)7-9/h1-8,16,18-20H/b5-1+ |
InChIKey | AYMYWHCQALZEGT-ORCRQEGFSA-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 | 16441060 | 18610999 | 18680271 | |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | FGFR2 | c-Src | c-kit | KDR | FGFR1 | c-Met | ALL |
Pub Chem Link |
5281222
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Drug Bank Link | - |
ChemSpider Link | 4444634 |
ChEMBL Link | CHEMBL128000 |