General Property |
Molceule ID (DB) | EGIN0003744 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 62 compound |
IUPAC Name | (3Z)-3-[(4-chloro-1H-pyrazol-3-yl)methylidene]-2,3-dihydro-1H-indol-2-one |
Formula | C12H8ClN3O |
Mass | 245.664 |
Exact Mass | 245.0355896 |
Composition | C (58.67%), H (3.28%), Cl (14.43%), N (17.1%), O (6.51%) |
Atom Count | 25 |
PI | 6.3 |
Smiles | C1(=C/c2c(c[nH]n2)Cl)/C(=O)Nc2c1cccc2 |
InChI | 1S/C12H8ClN3O/c13-9-6-14-16-11(9)5-8-7-3-1-2-4-10(7)15-12(8)17/h1-6H,(H,14,16)(H,15,17)/b8-5- |
InChIKey | GWLUGYITWVGWFU-YVMONPNESA-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 | 9651163 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | IGF1R | PDGFR | FLK-1 | ALL |
Pub Chem Link |
53861007
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Drug Bank Link | - |
ChemSpider Link | 10334577 |
ChEMBL Link | CHEMBL87402 |