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Name | CP-195543 |
---|---|
Molecular formula | C24H19F3O4 |
IUPAC name | 2-[(3S,4R)-3-benzyl-4-hydroxy-3,4-dihydro-2H-chromen-7-yl]-4-(trifluoromethyl)benzoic acid |
Molecular weight | 428.407 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 5.1 |
Synonyms | D0MM2K SCHEMBL896066 LB4 antagonist (inflammation), Pfizer (3S, 4R)-2-(3-benzyl-4-hydroxy-chroman-7-yl)-4-trifluoromethyl-benzoicacid CHEMBL301829 [ Show all ] |
Inchi Key | NZQDWKCNBOELAI-KSFYIVLOSA-N |
Inchi ID | InChI=1S/C24H19F3O4/c25-24(26,27)17-7-9-18(23(29)30)20(12-17)15-6-8-19-21(11-15)31-13-16(22(19)28)10-14-4-2-1-3-5-14/h1-9,11-12,16,22,28H,10,13H2,(H,29,30)/t16-,22+/m0/s1 |
PubChem CID | 9823886 |
ChEMBL | N/A |
IUPHAR | 6155 |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
554450 | Leukotriene B4 receptor 1 | Q15722 | LTB4R | Homo sapiens (Human) | 352 |
554449 | Leukotriene B4 receptor 2 | Q9NPC1 | LTB4R2 | Homo sapiens (Human) | 358 |
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