General Property |
Molceule ID (DB) | EGIN0002371 |
Inhibitor Class | Indolizine |
Molecule Name in Refrence Article | 5j compound |
IUPAC Name | 8-bromo-3-cyclopropanecarbonyl-5-methylindolizine-1-carbonitrile |
Formula | C14H11BrN2O |
Mass | 303.154 |
Exact Mass | 302.0054756 |
Composition | C (55.47%), H (3.66%), Br (26.36%), N (9.24%), O (5.28%) |
Atom Count | 29 |
PI | No isoelectric point. |
Smiles | c1cc(n2c(c1Br)c(cc2C(=O)C1CC1)C#N)C |
InChI | 1S/C14H11BrN2O/c1-8-2-5-11(15)13-10(7-16)6-12(17(8)13)14(18)9-3-4-9/h2,5-6,9H,3-4H2,1H3 |
InChIKey | NFZYOSOZVKIONF-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
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 | 20304535 |
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 |
49798025
|
Drug Bank Link | - |
ChemSpider Link | 25032632 |
ChEMBL Link | CHEMBL1171792 |