General Property |
Molceule ID (DB) | EGIN0000113 |
Inhibitor Class | Carboline |
Molecule Name in Refrence Article | 27 compound |
IUPAC Name | N-benzyl-6-bromo-9H-pyrido[2,3-b]indol-4-amine |
Formula | C18H14BrN3 |
Mass | 352.228 |
Exact Mass | 351.0371101 |
Composition | C (61.38%), H (4.01%), Br (22.69%), N (11.93%) |
Atom Count | 36 |
PI | 10.54 |
Smiles | c12c(cc(cc1)Br)c1c([nH]2)nccc1NCc1ccccc1 |
InChI | 1S/C18H14BrN3/c19-13-6-7-15-14(10-13)17-16(8-9-20-18(17)22-15)21-11-12-4-2-1-3-5-12/h1-10H,11H2,(H2,
20,21,22) |
InChIKey | FTYUDCKCRAZQFX-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000113.png) | Structure Backbone | ![](./frame/f_EGIN0000113.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 | 21140395 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | GSK-3beta | EGFR | IGF-1R | VEGFR2 | VEGFR3 | IGF-1R | VEGFR2 | VEGFR3 | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | - |