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Name | 4-chloro-2-{[(2-phenylethyl)imino]methyl}phenol |
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Molecular formula | C15H14ClNO |
IUPAC name | 4-chloro-2-(2-phenylethyliminomethyl)phenol |
Molecular weight | 259.733 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 1 |
XlogP | 3.7 |
Synonyms | 4-chloro-6-[(phenethylamino)methylidene]cyclohexa-2,4-dien-1-one CHEMBL3190696 ZINC18042715 (6E)-4-chloro-6-[(2-phenylethylamino)methylidene]cyclohexa-2,4-dien-1-one AC1O6UIE [ Show all ] |
Inchi Key | BVBFOUQMCJEBKN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C15H14ClNO/c16-14-6-7-15(18)13(10-14)11-17-9-8-12-4-2-1-3-5-12/h1-7,10-11,18H,8-9H2 |
PubChem CID | 2304556 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 96655 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
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558302 | Trace amine-associated receptor 1 | Q96RJ0 | TAAR1 | Homo sapiens (Human) | 339 |
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