| General Property |
| Molceule ID (DB) | EGIN0002565 |
| Inhibitor Class | Sulfonyl-benzoyl-Nitrostyrene |
| Molecule Name in Refrence Article | 14 compound |
| IUPAC Name | 4-[(E)-2-nitroethenyl]phenyl 4-(methylcarbamoyl)benzene-1-sulfonate |
| Formula | C16H14N2O6S |
| Mass | 362.357 |
| Exact Mass | 362.0572569 |
| Composition | C (53.03%), H (3.89%), N (7.73%), O (26.49%), S (8.85%) |
| Atom Count | 39 |
| PI | 6.18 |
| Smiles | c1(ccc(cc1)S(=O)(=O)Oc1ccc(cc1)/C=C/[N+](=O)[O-])C(=O)NC |
| InChI | 1S/C16H14N2O6S/c1-17-16(19)13-4-8-15(9-5-13)25(22,23)24-14-6-2-12(3-7-14)10-11-18(20)21/h2-11H,1H3,(
H,17,19)/b11-10+ |
| InChIKey | IVVVNPXXLPLCJM-ZHACJKMWSA-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 | 1652014 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | PKC | v-ab1 | ALL |
| Pub Chem Link |
14862533
|
| Drug Bank Link | - |
| ChemSpider Link | 23167136 |
| ChEMBL Link | CHEMBL74432 |
