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Name | MLS000035729 |
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Molecular formula | C20H22FNO3 |
IUPAC name | 1-(3-fluoro-4-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-one |
Molecular weight | 343.398 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 3.0 |
Synonyms | BDBM36844 SMR000008712 1-(3-fluoro-4-methoxyphenyl)-3-(4-morpholinyl)-2-phenyl-1-propanone;hydrochloride MCULE-9993616780 1-(3-fluoro-4-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-one;hydrochloride [ Show all ] |
Inchi Key | AINAOBMDRLIACD-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H22FNO3/c1-24-19-8-7-16(13-18(19)21)20(23)17(15-5-3-2-4-6-15)14-22-9-11-25-12-10-22/h2-8,13,17H,9-12,14H2,1H3 |
PubChem CID | 648630 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 36844 |
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 |
---|---|---|---|---|---|
6371 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
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