General Property |
Molceule ID (DB) | EGIN0000108 |
Inhibitor Class | Carboline |
Molecule Name in Refrence Article | 21 compound |
IUPAC Name | N-[(3-chlorophenyl)methyl]-9H-pyrido[2,3-b]indol-4-amine |
Formula | C18H14ClN3 |
Mass | 307.777 |
Exact Mass | 307.0876252 |
Composition | C (70.24%), H (4.58%), Cl (11.52%), N (13.65%) |
Atom Count | 36 |
PI | 10.58 |
Smiles | c1(CNc2c3c4c(cccc4)[nH]c3ncc2)cc(ccc1)Cl |
InChI | 1S/C18H14ClN3/c19-13-5-3-4-12(10-13)11-21-16-8-9-20-18-17(16)14-6-1-2-7-15(14)22-18/h1-10H,11H2,(H2,
20,21,22) |
InChIKey | QSGWAXUPGAQFSQ-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000108.png) | Structure Backbone | ![](./frame/f_EGIN0000108.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 | - |