General Property |
Molceule ID (DB) | EGIN0001919 |
Inhibitor Class | Quinoline |
Molecule Name in Refrence Article | 22 compound |
IUPAC Name | 6-methoxy-4-{[(1R,2S)-2-phenylcyclopropyl]amino}quinoline-3-carbonitrile |
Formula | C20H17N3O |
Mass | 315.3685 |
Exact Mass | 315.1371622 |
Composition | C (76.17%), H (5.43%), N (13.32%), O (5.07%) |
Atom Count | 41 |
PI | No isoelectric point. |
Smiles | c1(ccc2c(c1)c(c(cn2)C#N)N[C@@H]1C[C@H]1c1ccccc1)OC |
InChI | 1S/C20H17N3O/c1-24-15-7-8-18-17(9-15)20(14(11-21)12-22-18)23-19-10-16(19)13-5-3-2-4-6-13/h2-9,12,16,
19H,10H2,1H3,(H,22,23)/t16-,19+/m0/s1 |
InChIKey | DIVLZGMOXGKIOU-QFBILLFUSA-N |
2D Structure | ![](./image/EGIN0001919.png) | Structure Backbone | ![](./frame/f_EGIN0001919.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 | 17827009 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | ABL | SYK | Flt-1 | KDR | SRC | ALL |
Pub Chem Link |
44442731
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Drug Bank Link | - |
ChemSpider Link | 23307328 |
ChEMBL Link | CHEMBL401644 |