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Name | CHEMBL3797365 |
---|---|
Molecular formula | C26H34N4O6 |
IUPAC name | N-[(2S)-3-[2-ethyl-4-[5-[4-methoxy-6-(2-methylpropyl)pyridin-2-yl]-1,2,4-oxadiazol-3-yl]-6-methylphenoxy]-2-hydroxypropyl]-2-hydroxyacetamide |
Molecular weight | 498.58 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 3 |
XlogP | 3.2 |
Synonyms | BDBM50164813 SCHEMBL3403248 |
Inchi Key | AFNUABBHQNAIDY-FQEVSTJZSA-N |
Inchi ID | InChI=1S/C26H34N4O6/c1-6-17-9-18(8-16(4)24(17)35-14-20(32)12-27-23(33)13-31)25-29-26(36-30-25)22-11-21(34-5)10-19(28-22)7-15(2)3/h8-11,15,20,31-32H,6-7,12-14H2,1-5H3,(H,27,33)/t20-/m0/s1 |
PubChem CID | 44217997 |
ChEMBL | CHEMBL3797365 |
IUPHAR | N/A |
BindingDB | 50164813 |
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 |
---|---|---|---|---|---|
521569 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
521570 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
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