General Property |
Molceule ID (DB) | EGIN0000111 |
Inhibitor Class | Carboline |
Molecule Name in Refrence Article | 24 compound |
IUPAC Name | N-[(1S)-1-(pyridin-3-yl)ethyl]-9H-pyrido[2,3-b]indol-4-amine |
Formula | C18H16N4 |
Mass | 288.3464 |
Exact Mass | 288.1374965 |
Composition | C (74.98%), H (5.59%), N (19.43%) |
Atom Count | 38 |
PI | 10.57 |
Smiles | c1([C@@H](Nc2c3c4c(cccc4)[nH]c3ncc2)C)cnccc1 |
InChI | 1S/C18H16N4/c1-12(13-5-4-9-19-11-13)21-16-8-10-20-18-17(16)14-6-2-3-7-15(14)22-18/h2-12H,1H3,(H2,20,
21,22)/t12-/m0/s1 |
InChIKey | PAZZDWJGVSYABJ-LBPRGKRZSA-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 | 21140395 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | GSK-3beta | EGFR | IGF-1R | VEGFR2 | VEGFR3 | GSK-3ß | IGF-1R | VEGFR2 | VEGFR3 | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | - |