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Name | CHEMBL1813118 |
---|---|
Molecular formula | C28H25FN2O5 |
IUPAC name | 2-[5-fluoro-2-methyl-1-[4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]indol-3-yl]acetic acid |
Molecular weight | 488.515 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 5.4 |
Synonyms | BDBM50350369 SCHEMBL5647327 |
Inchi Key | IIWBXJIMFARCEB-NRFANRHFSA-N |
Inchi ID | InChI=1S/C28H25FN2O5/c1-17-22(14-27(32)33)23-13-19(29)9-12-24(23)31(17)28(34)18-7-10-20(11-8-18)35-16-21-15-30(2)25-5-3-4-6-26(25)36-21/h3-13,21H,14-16H2,1-2H3,(H,32,33)/t21-/m0/s1 |
PubChem CID | 10228100 |
ChEMBL | CHEMBL1813118 |
IUPHAR | N/A |
BindingDB | 50350369 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
134269 | Prostacyclin receptor | P43119 | PTGIR | Homo sapiens (Human) | 386 |
134263 | Prostaglandin D2 receptor | P70263 | Ptgdr | Mus musculus (Mouse) | 357 |
134270 | Prostaglandin E2 receptor EP1 subtype | P35375 | Ptger1 | Mus musculus (Mouse) | 405 |
134267 | Prostaglandin E2 receptor EP2 subtype | Q62053 | Ptger2 | Mus musculus (Mouse) | 362 |
134264 | Prostaglandin E2 receptor EP3 subtype | P30557 | Ptger3 | Mus musculus (Mouse) | 365 |
134266 | Prostaglandin E2 receptor EP4 subtype | P32240 | Ptger4 | Mus musculus (Mouse) | 513 |
134265 | Prostaglandin F2-alpha receptor | P43117 | Ptgfr | Mus musculus (Mouse) | 366 |
134268 | Thromboxane A2 receptor | P21731 | TBXA2R | Homo sapiens (Human) | 343 |
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