General Property |
Molceule ID (DB) | EGIN0004837 |
Inhibitor Class | Indole |
Molecule Name in Refrence Article | 6 |
IUPAC Name | 2-(1H-indol-3-ylmethylidene)propanedinitrile |
Formula | C12H7N3 |
Mass | 193.2041 |
Exact Mass | 193.0639972 |
Composition | C (74.6%), H (3.65%), N (21.75%) |
Atom Count | 22 |
PI | No isoelectric point. |
Smiles | c1cccc2c1c(c[nH]2)C=C(C#N)C#N |
InChI | 1S/C12H7N3/c13-6-9(7-14)5-10-8-15-12-4-2-1-3-11(10)12/h1-5,8,15H |
InChIKey | KCGMQWDGOQQAGN-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 | 8667360 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | PDGFR | |
Pub Chem Link |
269623
|
Drug Bank Link | - |
ChemSpider Link | 237084 |
ChEMBL Link | CHEMBL303903 |