Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001790
Inhibitor ClassThieno-pyrimidine
Molecule Name in Refrence Article12 compound
IUPAC Name1-N-methyl-4-N-{6-phenylthieno[3,2-d]pyrimidin-4-yl}benzene-1,4-diamine
FormulaC19H16N4S
Mass332.422
Exact Mass332.1095672
Composition C (68.65%), H (4.85%), N (16.85%), S (9.65%)
Atom Count40
PI10.96
Smilesc12sc(cc2ncnc1Nc1ccc(NC)cc1)c1ccccc1
InChI1S/C19H16N4S/c1-20-14-7-9-15(10-8-14)23-19-18-16(21-12-22-19)11-17(24-18)13-5-3-2-4-6-13/h2-12,20H,1
H3,(H,21,22,23)
InChIKeyCTZLRHLEDIPBSH-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 18382813
Drug Bank Link -
ChemSpider Link 13367415
ChEMBL Link CHEMBL312678
 
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