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Name | CHEMBL1813279 |
---|---|
Molecular formula | C29H27FN2O6 |
IUPAC name | 2-[5-fluoro-1-[3-methoxy-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]-2-methylindol-3-yl]acetic acid |
Molecular weight | 518.541 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 5.1 |
Synonyms | BDBM50350356 SCHEMBL5644012 |
Inchi Key | OEQZRFMZVOYSAY-FQEVSTJZSA-N |
Inchi ID | InChI=1S/C29H27FN2O6/c1-17-21(14-28(33)34)22-13-19(30)9-10-23(22)32(17)29(35)18-8-11-26(27(12-18)36-3)37-16-20-15-31(2)24-6-4-5-7-25(24)38-20/h4-13,20H,14-16H2,1-3H3,(H,33,34)/t20-/m0/s1 |
PubChem CID | 56678560 |
ChEMBL | CHEMBL1813279 |
IUPHAR | N/A |
BindingDB | 50350356 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
239377 | Prostacyclin receptor | P43119 | PTGIR | Homo sapiens (Human) | 386 |
239378 | Prostaglandin D2 receptor | P70263 | Ptgdr | Mus musculus (Mouse) | 357 |
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