General Property |
Molceule ID (DB) | EGIN0000623 |
Inhibitor Class | Benzamidine |
Molecule Name in Refrence Article | 2a compound |
IUPAC Name | 2-amino-N-(3-bromophenyl)-4,5-dimethoxybenzene-1-carboximidamide |
Formula | C15H16BrN3O2 |
Mass | 350.21 |
Exact Mass | 349.0425894 |
Composition | C (51.44%), H (4.6%), Br (22.82%), N (12%), O (9.14%) |
Atom Count | 37 |
PI | No isoelectric point. |
Smiles | c1(c(cc(c(c1)OC)OC)N)C(=N)Nc1cccc(c1)Br |
InChI | 1S/C15H16BrN3O2/c1-20-13-7-11(12(17)8-14(13)21-2)15(18)19-10-5-3-4-9(16)6-10/h3-8H,17H2,1-2H3,(H2,18
,19) |
InChIKey | BPIYSAPOXGHNEI-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000623.png) | Structure Backbone | ![](./frame/f_EGIN0000623.png) |
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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 | 15186837 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | PKA | PKA | PKA | PKC | PKC | PKC | v-Src | v-Src | v-Src | eEF2K | eEF2K | eEF2K | Flt-1 | Flt-1 | Flt-1 | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 23165592 |
ChEMBL Link | CHEMBL73079 |