General Property |
Molceule ID (DB) | EGIN0003616 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | 48 compound |
IUPAC Name | N-(3-chlorophenyl)-5,6,7-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
Formula | C15H15ClN4 |
Mass | 286.759 |
Exact Mass | 286.0985242 |
Composition | C (62.83%), H (5.27%), Cl (12.36%), N (19.54%) |
Atom Count | 35 |
PI | 10.83 |
Smiles | c12c(n(c(c1C)C)C)ncnc2Nc1cc(Cl)ccc1 |
InChI | 1S/C15H15ClN4/c1-9-10(2)20(3)15-13(9)14(17-8-18-15)19-12-6-4-5-11(16)7-12/h4-8H,1-3H3,(H,17,18,19) |
InChIKey | PDAWAZKMZGJEIJ-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 | 9357527 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 23202538 |
ChEMBL Link | CHEMBL120667 |