General Property |
Molceule ID (DB) | EGIN0003585 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | 2 compound |
IUPAC Name | 3-N-(3-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidine-3,4,6-triamine |
Formula | C11H10ClN7 |
Mass | 275.697 |
Exact Mass | 275.0686211 |
Composition | C (47.92%), H (3.66%), Cl (12.86%), N (35.56%) |
Atom Count | 29 |
PI | 8.58 |
Smiles | c1(c2c(nc(nc2N)N)n[nH]1)Nc1cc(Cl)ccc1 |
InChI | 1S/C11H10ClN7/c12-5-2-1-3-6(4-5)15-9-7-8(13)16-11(14)17-10(7)19-18-9/h1-4H,(H6,13,14,15,16,17,18,19) |
InChIKey | YASYSLUSCVNMAJ-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0003585.png) | Structure Backbone | ![](./frame/f_EGIN0003585.png) |
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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 | c-Src | PKC alpha | v-Abl | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 4484991 |
ChEMBL Link | CHEMBL122068 |