Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002778
Inhibitor ClassDithiobis-indole
Molecule Name in Refrence Article10j compound
IUPAC Name(1S,3R)-3-methyl-N-phenyl-2-sulfanylidene-2,3-dihydro-1H-indene-1-carboxamide
FormulaC17H15NOS
Mass281.372
Exact Mass281.0874348
Composition C (72.57%), H (5.37%), N (4.98%), O (5.69%), S (11.4%)
Atom Count35
PINo isoelectric point.
Smilesc1cccc2c1[C@H](C(=S)[C@@H]2C)C(=O)Nc1ccccc1
InChI1S/C17H15NOS/c1-11-13-9-5-6-10-14(13)15(16(11)20)17(19)18-12-7-3-2-4-8-12/h2-11,15H,1H3,(H,18,19)/t1
1-,15-/m1/s1
InChIKeyJWYAKHUALDFQAY-IAQYHMDHSA-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
Reference7837241
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesSRC |
Pub Chem Link 14863850
Drug Bank Link -
ChemSpider Link -
ChEMBL Link -
 
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