General Property |
Molceule ID (DB) | EGIN0004819 |
Inhibitor Class | Indole |
Molecule Name in Refrence Article | 8 |
IUPAC Name | (1Z,2R)-2-amino-1-(1H-indol-3-ylmethylidene)propane-1,3,3-tricarbonitrile |
Formula | C15H11N5 |
Mass | 261.2813 |
Exact Mass | 261.1014454 |
Composition | C (68.95%), H (4.24%), N (26.8%) |
Atom Count | 31 |
PI | 5.53 |
Smiles | c1cccc2c1c(c[nH]2)/C=C(/[C@H](N)C(C#N)C#N)C#N |
InChI | 1S/C15H11N5/c16-6-10(15(19)12(7-17)8-18)5-11-9-20-14-4-2-1-3-13(11)14/h1-5,9,12,15,20H,19H2/b10-5+/t
15-/m0/s1 |
InChIKey | NTSBESMGQOQOQD-RNOHYWCBSA-N |
2D Structure | ![](./image/EGIN0004819.png) | Structure Backbone | ![](./frame/f_EGIN0004819.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 | - |
ChEMBL Link | - |