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Name | CHEMBL3798917 |
---|---|
Molecular formula | C24H31ClN2O7 |
IUPAC name | 2-[1-[2-[N-(1,3-benzodioxole-5-carbonyl)-4-methylanilino]ethyl]piperidin-4-yl]oxyacetic acid;hydrate;hydrochloride |
Molecular weight | 494.969 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | None |
Synonyms | BDBM50167257 |
Inchi Key | GHJOTLLQCTXWNP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H28N2O6.ClH.H2O/c1-17-2-5-19(6-3-17)26(24(29)18-4-7-21-22(14-18)32-16-31-21)13-12-25-10-8-20(9-11-25)30-15-23(27)28;;/h2-7,14,20H,8-13,15-16H2,1H3,(H,27,28);1H;1H2 |
PubChem CID | 127047381 |
ChEMBL | CHEMBL3798917 |
IUPHAR | N/A |
BindingDB | 50167257 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
524350 | Prostacyclin receptor | P43119 | PTGIR | Homo sapiens (Human) | 386 |
524351 | Prostaglandin E2 receptor EP2 subtype | P43116 | PTGER2 | Homo sapiens (Human) | 358 |
524355 | Prostaglandin E2 receptor EP3 subtype | P43115 | PTGER3 | Homo sapiens (Human) | 390 |
524354 | Prostaglandin E2 receptor EP4 subtype | P35408 | PTGER4 | Homo sapiens (Human) | 488 |
524352 | Prostaglandin F2-alpha receptor | P43088 | PTGFR | Homo sapiens (Human) | 359 |
524353 | Thromboxane A2 receptor | P21731 | TBXA2R | Homo sapiens (Human) | 343 |
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