General Property |
Molceule ID (DB) | EGIN0004465 |
Inhibitor Class | Benzimidazole |
Molecule Name in Refrence Article | 5e |
IUPAC Name | N-[2-(1-methyl-1H-pyrrol-2-yl)-1H-1,3-benzodiazol-5-yl]propanamide |
Formula | C15H16N4O |
Mass | 268.3137 |
Exact Mass | 268.1324112 |
Composition | C (67.15%), H (6.01%), N (20.88%), O (5.96%) |
Atom Count | 36 |
PI | 8.02 |
Smiles | c1c(ccc2c1nc([nH]2)c1cccn1C)NC(=O)CC |
InChI | 1S/C15H16N4O/c1-3-14(20)16-10-6-7-11-12(9-10)18-15(17-11)13-5-4-8-19(13)2/h4-9H,3H2,1-2H3,(H,16,20)(
H,17,18) |
InChIKey | MZDNLSISLPWRTK-UHFFFAOYSA-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 | 21724404 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | PDGFR-alpha | PDGFR-beta | VEGFR-2(KDR) | PI3K-a | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | - |