You can:
Name | CHEMBL1915856 |
---|---|
Molecular formula | C27H27ClN2O5 |
IUPAC name | 2-[4-chloro-3-[[2,6-dimethyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]amino]phenyl]acetic acid |
Molecular weight | 494.972 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 5.2 |
Synonyms | BDBM50357626 SCHEMBL732480 |
Inchi Key | PHKSNMJTGYQRRJ-FQEVSTJZSA-N |
Inchi ID | InChI=1S/C27H27ClN2O5/c1-16-10-19(34-15-20-14-30(3)23-6-4-5-7-24(23)35-20)11-17(2)26(16)27(33)29-22-12-18(13-25(31)32)8-9-21(22)28/h4-12,20H,13-15H2,1-3H3,(H,29,33)(H,31,32)/t20-/m0/s1 |
PubChem CID | 11409320 |
ChEMBL | CHEMBL1915856 |
IUPHAR | N/A |
BindingDB | 50357626 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
259829 | Prostacyclin receptor | P43119 | PTGIR | Homo sapiens (Human) | 386 |
259828 | Prostaglandin D2 receptor | P70263 | Ptgdr | Mus musculus (Mouse) | 357 |
259830 | Prostaglandin D2 receptor | Q13258 | PTGDR | Homo sapiens (Human) | 359 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417