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Name | CHEMBL332667 |
---|---|
Molecular formula | C18H30Br2NO4P |
IUPAC name | 3-[(3,5-dibromo-4-octoxyphenyl)methylamino]propylphosphonic acid |
Molecular weight | 515.223 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 2.3 |
Synonyms | SCHEMBL14195622 [3-(3,5-Dibromo-4-octyloxy-benzylamino)-propyl]-phosphonic acid BDBM50148414 |
Inchi Key | GCTZIVJBMHYJOP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H30Br2NO4P/c1-2-3-4-5-6-7-10-25-18-16(19)12-15(13-17(18)20)14-21-9-8-11-26(22,23)24/h12-13,21H,2-11,14H2,1H3,(H2,22,23,24) |
PubChem CID | 10289318 |
ChEMBL | CHEMBL332667 |
IUPHAR | N/A |
BindingDB | 50148414 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
93260 | Lysophosphatidic acid receptor 2 | Q9HBW0 | LPAR2 | Homo sapiens (Human) | 351 |
93262 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
93261 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
93259 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
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