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Name | SCHEMBL1830755 |
---|---|
Molecular formula | C14H16F2N2O |
IUPAC name | (4S)-4-[2-[1-(2,4-difluorophenyl)cyclopropyl]ethyl]-4,5-dihydro-1,3-oxazol-2-amine |
Molecular weight | 266.292 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 2.8 |
Synonyms | US8729113, 89 CHEMBL3652743 BDBM122355 |
Inchi Key | AJQUDOGDCBCJQP-JTQLQIEISA-N |
Inchi ID | InChI=1S/C14H16F2N2O/c15-9-1-2-11(12(16)7-9)14(5-6-14)4-3-10-8-19-13(17)18-10/h1-2,7,10H,3-6,8H2,(H2,17,18)/t10-/m0/s1 |
PubChem CID | 45101190 |
ChEMBL | CHEMBL3652743 |
IUPHAR | N/A |
BindingDB | 122355 |
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 |
---|---|---|---|---|---|
7148 | Trace amine-associated receptor 1 | Q923Y8 | Taar1 | Mus musculus (Mouse) | 332 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417