Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003009
Inhibitor ClassIndole
Molecule Name in Refrence Article25 compound
IUPAC Name4-(2-{[(2R)-2-amino-2,3,4,9-tetrahydro-1H-carbazol-6-yl]oxy}ethyl)phenol
FormulaC20H22N2O2
Mass322.4009
Exact Mass322.168128
Composition C (74.51%), H (6.88%), N (8.69%), O (9.93%)
Atom Count46
PI10.04
Smilesc1c(ccc2c1c1c([nH]2)C[C@@H](CC1)N)OCCc1ccc(cc1)O
InChI1S/C20H22N2O2/c21-14-3-7-17-18-12-16(6-8-19(18)22-20(17)11-14)24-10-9-13-1-4-15(23)5-2-13/h1-2,4-6,8
,12,14,22-23H,3,7,9-11,21H2/t14-/m1/s1
InChIKeyWGFVYIPSMLQLLJ-CQSZACIVSA-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
Reference20456957
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesIGF1R | VEGFR2 | VEGFR3 | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link -
ChEMBL Link CHEMBL1199127
 
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