Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000598
Inhibitor ClassNaphtho-furo-quinone
Molecule Name in Refrence Article5 compound
IUPAC Namemethyl (2R,11R)-3,10-dioxo-20-propoxy-12-oxapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{14,19}]henicosa-1(13),4,6,8,14(19),15,17,20-octaene-21-carboxylate
FormulaC25H20O6
Mass416.4227
Exact Mass416.1259884
Composition C (72.11%), H (4.84%), O (23.05%)
Atom Count51
PI0.53
Smilesc12c(cccc1)C(=O)[C@H]1[C@H](C2=O)c2c(O1)c1c(c(c2C(=O)OC)OCCC)cccc1
InChI1S/C25H20O6/c1-3-12-30-22-15-10-6-7-11-16(15)23-17(19(22)25(28)29-2)18-20(26)13-8-4-5-9-14(13)21(27)
24(18)31-23/h4-11,18,24H,3,12H2,1-2H3/t18-,24+/m0/s1
InChIKeyJZODWTUUNXCKME-MHECFPHRSA-N
2D Structure
Structure Backbone
View Structure in JmolClick to view 3 d structure                            Download Mol File
Drug Like PropertyDruglikeliness
Symmetry & GeometrySymmetry And Geometrical Information
Activity & Binding Activity against isoform and covalant binding information
Topological PropertiesDescriptors
Reference16321529
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFGFR1 | PDGFR beta | VEGFR2 | FGFR1 | PDGFR beta | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link -
ChEMBL Link CHEMBL202216
 
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