General Property |
Molceule ID (DB) | EGIN0003499 |
Inhibitor Class | Biaryl |
Molecule Name in Refrence Article | 1 compound |
IUPAC Name | N-cyclopropyl-3-{4-[(cyclopropylmethyl)carbamoyl]phenyl}-4-methylbenzamide |
Formula | C22H24N2O2 |
Mass | 348.4382 |
Exact Mass | 348.183778 |
Composition | C (75.83%), H (6.94%), N (8.04%), O (9.18%) |
Atom Count | 50 |
PI | 7.37 |
Smiles | Cc1ccc(C(=O)NC2CC2)cc1c1ccc(cc1)C(=O)NCC1CC1 |
InChI | 1S/C22H24N2O2/c1-14-2-5-18(22(26)24-19-10-11-19)12-20(14)16-6-8-17(9-7-16)21(25)23-13-15-3-4-15/h2,5
-9,12,15,19H,3-4,10-11,13H2,1H3,(H,23,25)(H,24,26) |
InChIKey | BOPSUAHGQHFKGG-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0003499.png) | Structure Backbone | ![](./frame/f_EGIN0003499.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 | 18789685 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | JNK3 | LCK | CDK2 | VEGFR2 | cFMS | PLK1 | SGK1 | Raf/Mek/Erk | HWB | PBMC | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 22377263 |
ChEMBL Link | CHEMBL478649 |