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Name | CHEMBL597367 |
---|---|
Molecular formula | C31H34N2O6 |
IUPAC name | 3-[4-[(3-cyanophenoxy)methyl]-2-[[1-(3,4-dimethoxyphenyl)-3-methylbutyl]carbamoyl]phenyl]propanoic acid |
Molecular weight | 530.621 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 5.3 |
Synonyms | SCHEMBL2981262 3-[4-[(3-Cyanophenoxy)methyl]-2-({[1-(3,4-dimethoxyphenyl)-3-methylbutyl]amino}carbonyl)phenyl]propanoic acid BDBM50307448 |
Inchi Key | HKMMZKDOAJRAAE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H34N2O6/c1-20(2)14-27(24-10-12-28(37-3)29(17-24)38-4)33-31(36)26-16-22(8-9-23(26)11-13-30(34)35)19-39-25-7-5-6-21(15-25)18-32/h5-10,12,15-17,20,27H,11,13-14,19H2,1-4H3,(H,33,36)(H,34,35) |
PubChem CID | 23017423 |
ChEMBL | CHEMBL597367 |
IUPHAR | N/A |
BindingDB | 50307448 |
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 |
---|---|---|---|---|---|
117335 | Prostaglandin E2 receptor EP3 subtype | P30557 | Ptger3 | Mus musculus (Mouse) | 365 |
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