General Property |
Molceule ID (DB) | EGIN0000804 |
Inhibitor Class | Unknown |
Molecule Name in Refrence Article | 41 compound |
IUPAC Name | N-[3-(4-methylphenyl)-1H-pyrazol-5-yl]thiophene-2-carboxamide |
Formula | C15H13N3OS |
Mass | 283.348 |
Exact Mass | 283.0779327 |
Composition | C (63.58%), H (4.62%), N (14.83%), O (5.65%), S (11.32%) |
Atom Count | 33 |
PI | 6.16 |
Smiles | c1c(n[nH]c1NC(=O)c1cccs1)c1ccc(cc1)C |
InChI | 1S/C15H13N3OS/c1-10-4-6-11(7-5-10)12-9-14(18-17-12)16-15(19)13-3-2-8-20-13/h2-9H,1H3,(H2,16,17,18,19
) |
InChIKey | LGSZQORNPIBXAS-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 | 16413185 |
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 |
1206783
|
Drug Bank Link | - |
ChemSpider Link | 1017077 |
ChEMBL Link | CHEMBL383026 |