Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004998
Inhibitor Class-
Molecule Name in Refrence Article16
IUPAC Name1,3‐bis[(E)‐[(2,3‐dihydroxyphenyl)methylidene]amino]thiourea
FormulaC15H14N4O4S
Mass346.361
Exact Mass346.073575646
Composition C (52.02%), H (4.07%), N (16.18%), O (18.48%), S (9.26%)
Atom Count38
PI4.95
Smiles[H]OC1=C([H])C([H])=C([H])C(C([H])=NN([H])C(=S)N([H])N=C(/[H])C2=C([H])C([H])=C([H])C(O[H])=C2O[H])=C1O[H]
InChI1S/C15H14N4O4S/c20-11-5-1-3-9(13(11)22)7-16-18-15(24)19-17-8-10-4-2-6-12(21)14(10)23/h1-8,16-17,20-2
1H,(H2,18,19,24)
InChIKeyVBDFMDSKCPBXRV-UHFFFAOYSA-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
Reference22607878
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 6794909
Drug Bank Link -
ChemSpider Link 10841917
ChEMBL Link CHEMBL408232
 
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