Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003834
Inhibitor ClassPyrimido-indole
Molecule Name in Refrence Article39 compound
IUPAC NameN-[(1R)-1-phenylethyl]-5H-pyrimido[5,4-b]indol-4-amine
FormulaC18H16N4
Mass288.3464
Exact Mass288.1374965
Composition C (74.98%), H (5.59%), N (19.43%)
Atom Count38
PI8.17
Smilesc12ccccc1c1c([nH]2)c(ncn1)N[C@@H](c1ccccc1)C
InChI1S/C18H16N4/c1-12(13-7-3-2-4-8-13)21-18-17-16(19-11-20-18)14-9-5-6-10-15(14)22-17/h2-12,22H,1H3,(H,1
9,20,21)/t12-/m1/s1
InChIKeyLITMWRKODNTXFW-GFCCVEGCSA-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
Reference10639288
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 5328387
Drug Bank Link -
ChemSpider Link 4485552
ChEMBL Link CHEMBL1192657
 
TOP