General Property |
Molceule ID (DB) | EGIN0003733 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 51 compound |
IUPAC Name | (3Z)-5-nitro-3-(1H-pyrrol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one |
Formula | C13H9N3O3 |
Mass | 255.2289 |
Exact Mass | 255.0643912 |
Composition | C (61.18%), H (3.55%), N (16.46%), O (18.81%) |
Atom Count | 28 |
PI | 4.35 |
Smiles | C1(=C/c2[nH]ccc2)/C(=O)Nc2c1cc([N+](=O)[O-])cc2 |
InChI | 1S/C13H9N3O3/c17-13-11(6-8-2-1-5-14-8)10-7-9(16(18)19)3-4-12(10)15-13/h1-7,14H,(H,15,17)/b11-6- |
InChIKey | UUKMQWDTHJLSMU-WDZFZDKYSA-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 | FLK-1 | IGF1R | PDGFR | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 8834006 |
ChEMBL Link | CHEMBL87325 |