EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C19H19BrFN5O3 |
| Net Charge | 0 |
| Average Mass | 464.295 |
| Monoisotopic Mass | 463.06553 |
| SMILES | Nc1nonc1C(=O)NCCNCc1cc(Br)ccc1OCc1ccccc1F |
| InChI | InChI=1S/C19H19BrFN5O3/c20-14-5-6-16(28-11-12-3-1-2-4-15(12)21)13(9-14)10-23-7-8-24-19(27)17-18(22)26-29-25-17/h1-6,9,23H,7-8,10-11H2,(H2,22,26)(H,24,27) |
| InChIKey | VJTIFSGFGLTUDR-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-amino-N-[2-[[5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide (CHEBI:104105) is a aromatic amine (CHEBI:33860) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15463 | LINCS |