General Property |
Molceule ID (DB) | EGIN0002383 |
Inhibitor Class | Imidazo-thiazole |
Molecule Name in Refrence Article | 6 compound |
IUPAC Name | 2-chloro-N-(3-{5-[2-(phenylamino)pyrimidin-4-yl]imidazo[2,1-b][1,3]thiazol-6-yl}phenyl)benzamide |
Formula | C28H19ClN6OS |
Mass | 523.008 |
Exact Mass | 522.1029577 |
Composition | C (64.3%), H (3.66%), Cl (6.78%), N (16.07%), O (3.06%), S (6.13%) |
Atom Count | 56 |
PI | 6.8 |
Smiles | n1c(c(n2c1scc2)c1ccnc(n1)Nc1ccccc1)c1cc(ccc1)NC(=O)c1ccccc1Cl |
InChI | 1S/C28H19ClN6OS/c29-22-12-5-4-11-21(22)26(36)31-20-10-6-7-18(17-20)24-25(35-15-16-37-28(35)34-24)23-
13-14-30-27(33-23)32-19-8-2-1-3-9-19/h1-17H,(H,31,36)(H,30,32,33) |
InChIKey | BIHMIKVTIYXXKN-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 | 20346655 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | IGF1R | |
Pub Chem Link |
46886310
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Drug Bank Link | - |
ChemSpider Link | 24679826 |
ChEMBL Link | CHEMBL1093815 |