General Property |
Molceule ID (DB) | EGIN0004804 |
Inhibitor Class | Indole |
Molecule Name in Refrence Article | 10 |
IUPAC Name | (2E)-2-cyano-3-(1H-indol-3-yl)prop-2-enamide |
Formula | C12H9N3O |
Mass | 211.2194 |
Exact Mass | 211.0745619 |
Composition | C (68.24%), H (4.29%), N (19.89%), O (7.57%) |
Atom Count | 25 |
PI | 4.68 |
Smiles | c1cccc2c1c(c[nH]2)/C=C(/C(=O)N)C#N |
InChI | 1S/C12H9N3O/c13-6-8(12(14)16)5-9-7-15-11-4-2-1-3-10(9)11/h1-5,7,15H,(H2,14,16)/b8-5+ |
InChIKey | NLJUQIIPXVMEAA-VMPITWQZSA-N |
2D Structure | ![](./image/EGIN0004804.png) | Structure Backbone | ![](./frame/f_EGIN0004804.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 | 8667360 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | PDGFR | |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 1267526 |
ChEMBL Link | CHEMBL66390 |