Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001801
Inhibitor ClassThieno-pyrimidine
Molecule Name in Refrence Article23 compound
IUPAC Name4-[(1H-indol-5-yl)amino]-N-propylthieno[3,2-d]pyrimidine-6-carboxamide
FormulaC18H17N5OS
Mass351.425
Exact Mass351.1153809
Composition C (61.52%), H (4.88%), N (19.93%), O (4.55%), S (9.12%)
Atom Count42
PI7.88
Smilesc12sc(cc2ncnc1Nc1cc2c([nH]cc2)cc1)C(=O)NCCC
InChI1S/C18H17N5OS/c1-2-6-20-18(24)15-9-14-16(25-15)17(22-10-21-14)23-12-3-4-13-11(8-12)5-7-19-13/h3-5,7-
10,19H,2,6H2,1H3,(H,20,24)(H,21,22,23)
InChIKeyZBMVTZKSSKNBMX-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 44317156
Drug Bank Link -
ChemSpider Link 23169283
ChEMBL Link CHEMBL421329
 
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