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Name | CHEMBL599213 |
---|---|
Molecular formula | C30H33F2NO4 |
IUPAC name | 3-[4-[(2,3-difluorophenoxy)methyl]-2-[[1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]phenyl]propanoic acid |
Molecular weight | 509.594 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 6.6 |
Synonyms | BDBM50307449 SCHEMBL2987387 3-[4-[(2,3-Difluorophenoxy)methyl]-2-({[1-(3,5-dimethylphenyl)-3-methylbutyl]amino}carbonyl)phenyl]propanoic acid |
Inchi Key | DAPQMHVIKFLWDP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H33F2NO4/c1-18(2)12-26(23-14-19(3)13-20(4)15-23)33-30(36)24-16-21(8-9-22(24)10-11-28(34)35)17-37-27-7-5-6-25(31)29(27)32/h5-9,13-16,18,26H,10-12,17H2,1-4H3,(H,33,36)(H,34,35) |
PubChem CID | 23016978 |
ChEMBL | CHEMBL599213 |
IUPHAR | N/A |
BindingDB | 50307449 |
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 |
---|---|---|---|---|---|
55227 | Prostaglandin E2 receptor EP3 subtype | P30557 | Ptger3 | Mus musculus (Mouse) | 365 |
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