EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | HCl.C28H29N5O3 |
| Net Charge | 0 |
| Average Mass | 520.033 |
| Monoisotopic Mass | 519.20372 |
| SMILES | C[C@H](CN(C(=O)c1ccc(C#N)cc1)c1ccccn1)N1CCN(c2cccc3c2OCCO3)CC1.Cl |
| InChI | InChI=1S/C28H29N5O3.ClH/c1-21(31-13-15-32(16-14-31)24-5-4-6-25-27(24)36-18-17-35-25)20-33(26-7-2-3-12-30-26)28(34)23-10-8-22(19-29)9-11-23;/h2-12,21H,13-18,20H2,1H3;1H/t21-;/m1./s1 |
| InChIKey | GXYZREDEYDFJPT-ZMBIFBSDSA-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) |
| lecozotan hydrochloride (CHEBI:752581) is a N-arylpiperazine (CHEBI:46848) |
| Synonyms | Source |
|---|---|
| Lecozotan hcl | ChEMBL |
| Lecozotan hydrochloride | ChEMBL |
| SRA-333 | ChEMBL |