Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003836
Inhibitor ClassPyrimido-indole
Molecule Name in Refrence Article41 compound
IUPAC Namedimethyl[2-({3H-pyrimido[5,4-b]indol-4-yl}amino)ethyl]amine
FormulaC14H17N5
Mass255.3183
Exact Mass255.1483956
Composition C (65.86%), H (6.71%), N (27.43%)
Atom Count36
PI8.34
Smilesc12nc3c(c1nc[nH]c2NCCN(C)C)cccc3
InChI1S/C14H17N5/c1-19(2)8-7-15-14-13-12(16-9-17-14)10-5-3-4-6-11(10)18-13/h3-6,9,15H,7-8H2,1-2H3,(H,16,1
7)
InChIKeyKRIIYMOSCHRCIM-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
Reference10639288
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 25040176
ChEMBL Link CHEMBL1192249
 
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