General Property |
Molceule ID (DB) | EGIN0002947 |
Inhibitor Class | Quercetin |
Molecule Name in Refrence Article | QUERCETIN |
IUPAC Name | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one |
Formula | C15H10O7 |
Mass | 302.2357 |
Exact Mass | 302.0426527 |
Composition | C (59.61%), H (3.33%), O (37.06%) |
Atom Count | 32 |
PI | 1.58 |
Smiles | c1c(c2c(cc1O)oc(c(c2=O)O)c1ccc(c(c1)O)O)O |
InChI | 1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H |
InChIKey | REFJWTPEDVJJIY-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 | 8201603 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
5280343
|
Drug Bank Link | DB01698--DB02375--DB04216 |
ChemSpider Link | 4444051 |
ChEMBL Link | CHEMBL50 |