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Name | CHEMBL65779 |
---|---|
Molecular formula | C24H23ClFNO5S |
IUPAC name | 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-5-[(4-fluorophenyl)-hydroxymethyl]phenyl]propanoic acid |
Molecular weight | 491.958 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 4.1 |
Synonyms | BDBM50403666 GDUHKNXVKCKPIA-UHFFFAOYSA-N SCHEMBL8594726 3-[2-[(4-Chlorophenyl)sulphonylamino]ethyl]-5-[(4-fluorophenyl)hydroxymethyl]benzenepropanoic acid |
Inchi Key | GDUHKNXVKCKPIA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H23ClFNO5S/c25-20-4-8-22(9-5-20)33(31,32)27-12-11-17-13-16(1-10-23(28)29)14-19(15-17)24(30)18-2-6-21(26)7-3-18/h2-9,13-15,24,27,30H,1,10-12H2,(H,28,29) |
PubChem CID | 19962351 |
ChEMBL | CHEMBL65779 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
93990 | Thromboxane A2 receptor | P34978 | Tbxa2r | Rattus norvegicus (Rat) | 341 |
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