General Property |
Molceule ID (DB) | EGIN0003836 |
Inhibitor Class | Pyrimido-indole |
Molecule Name in Refrence Article | 41 compound |
IUPAC Name | dimethyl[2-({3H-pyrimido[5,4-b]indol-4-yl}amino)ethyl]amine |
Formula | C14H17N5 |
Mass | 255.3183 |
Exact Mass | 255.1483956 |
Composition | C (65.86%), H (6.71%), N (27.43%) |
Atom Count | 36 |
PI | 8.34 |
Smiles | c12nc3c(c1nc[nH]c2NCCN(C)C)cccc3 |
InChI | 1S/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) |
InChIKey | KRIIYMOSCHRCIM-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0003836.png) | Structure Backbone | ![](./frame/f_EGIN0003836.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 | 10639288 |
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 | 25040176 |
ChEMBL Link | CHEMBL1192249 |