Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002342
Inhibitor ClassPyrimidine
Molecule Name in Refrence Article12 compound
IUPAC Name5-[(2S)-2-(2-methoxyphenyl)-4-methylpentyl]furo[2,3-d]pyrimidine-2,4-diamine
FormulaC19H24N4O2
Mass340.4195
Exact Mass340.189926
Composition C (67.04%), H (7.11%), N (16.46%), O (9.4%)
Atom Count49
PI10.22
Smilesn1c(nc2c(c1N)c(co2)C[C@H](CC(C)C)c1ccccc1OC)N
InChI1S/C19H24N4O2/c1-11(2)8-12(14-6-4-5-7-15(14)24-3)9-13-10-25-18-16(13)17(20)22-19(21)23-18/h4-7,10-12
H,8-9H2,1-3H3,(H4,20,21,22,23)/t12-/m0/s1
InChIKeyFZTBMWCWXXNRIA-LBPRGKRZSA-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
Reference19748785
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesVEGFR2 | PDGFR beta | DHFR human | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 24653877
ChEMBL Link CHEMBL606362
 
TOP