General Property |
Molceule ID (DB) | EGIN0001836 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | 4 compound |
IUPAC Name | 4,6,8,9-tetraazatricyclo[7.4.0.0^{2,7}]trideca-1,3,5,7,10,12-hexaen-3-amine |
Formula | C9H7N5 |
Mass | 185.1854 |
Exact Mass | 185.0701452 |
Composition | C (58.37%), H (3.81%), N (37.82%) |
Atom Count | 21 |
PI | 11.34 |
Smiles | n1cnc2c(c1N)c1n(n2)cccc1 |
InChI | 1S/C9H7N5/c10-8-7-6-3-1-2-4-14(6)13-9(7)12-5-11-8/h1-5H,(H2,10,11,12,13) |
InChIKey | QKLKMSSJIUYOIB-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 | 15993060 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | GSK-3 | VEGFR2 | ALL |
Pub Chem Link |
11542889
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Drug Bank Link | - |
ChemSpider Link | 9717668 |
ChEMBL Link | CHEMBL368891 |