Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001802
Inhibitor ClassThieno-pyrimidine
Molecule Name in Refrence Article24 compound
IUPAC NameN-[6-(thiophen-2-yl)thieno[3,2-d]pyrimidin-4-yl]-1H-indol-5-amine
FormulaC18H12N4S2
Mass348.445
Exact Mass348.0503378
Composition C (62.04%), H (3.47%), N (16.08%), S (18.4%)
Atom Count36
PI8.45
Smilesc12sc(cc2ncnc1Nc1cc2c([nH]cc2)cc1)c1sccc1
InChI1S/C18H12N4S2/c1-2-15(23-7-1)16-9-14-17(24-16)18(21-10-20-14)22-12-3-4-13-11(8-12)5-6-19-13/h1-10,19
H,(H,20,21,22)
InChIKeyYXIIIHIHDBMOTL-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
Reference14684289
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesVEGFR |
Pub Chem Link 18382853
Drug Bank Link -
ChemSpider Link 13367456
ChEMBL Link CHEMBL76751
 
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