General Property |
Molceule ID (DB) | EGIN0004814 |
Inhibitor Class | Unknown |
Molecule Name in Refrence Article | 9 |
IUPAC Name | N-(3-bromophenyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide |
Formula | C16H11BrN2O3 |
Mass | 359.174 |
Exact Mass | 357.9953049 |
Composition | C (53.5%), H (3.09%), Br (22.25%), N (7.8%), O (13.36%) |
Atom Count | 33 |
PI | 1.12 |
Smiles | c1cc(cc(c1)NC(=O)c1c(c2c([nH]c1=O)cccc2)O)Br |
InChI | 1S/C16H11BrN2O3/c17-9-4-3-5-10(8-9)18-15(21)13-14(20)11-6-1-2-7-12(11)19-16(13)22/h1-8H,(H,18,21)(H2
,19,20,22) |
InChIKey | UCCUKBQMSKZUOG-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 | 22227214 |
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 |
54678831
|
Drug Bank Link | - |
ChemSpider Link | 848391 |
ChEMBL Link | CHEMBL1944926 |