General Property |
Molceule ID (DB) | EGIN0002417 |
Inhibitor Class | Pyrrolo-pyrimidine |
Molecule Name in Refrence Article | 25 compound |
IUPAC Name | N-[6-(2-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-indol-5-amine |
Formula | C22H19N5 |
Mass | 353.4198 |
Exact Mass | 353.1640456 |
Composition | C (74.77%), H (5.42%), N (19.82%) |
Atom Count | 46 |
PI | 10 |
Smiles | n1cnc2c(c1Nc1cc3c(cc1)[nH]cc3)cc([nH]2)CCc1ccccc1 |
InChI | 1S/C22H19N5/c1-2-4-15(5-3-1)6-7-18-13-19-21(24-14-25-22(19)27-18)26-17-8-9-20-16(12-17)10-11-23-20/h
1-5,8-14,23H,6-7H2,(H2,24,25,26,27) |
InChIKey | PWLPHODRHOUKAZ-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 20403693 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | PDGFR beta | VEGFR1 | VEGFR2 | ALL |
Pub Chem Link |
46887397
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Drug Bank Link | - |
ChemSpider Link | 24678852 |
ChEMBL Link | CHEMBL1097368 |