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Name | CHEMBL43509 |
---|---|
Molecular formula | C33H34FNO3S2 |
IUPAC name | 2-[1-[[(1R)-1-[3-[(E)-2-(5-fluoro-1,3-benzothiazol-2-yl)ethenyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetic acid |
Molecular weight | 575.757 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 7.4 |
Synonyms | BDBM50284901 L-708734 (1-{(R)-1-{3-[(E)-2-(5-Fluoro-benzothiazol-2-yl)-vinyl]-phenyl}-3-[2-(1-hydroxy-1-methyl-ethyl)-phenyl]-propylsulfanylmethyl}-cyclopropyl)-acetic acid |
Inchi Key | DIGAXEWBQSDRKZ-MGUPHCMFSA-N |
Inchi ID | InChI=1S/C33H34FNO3S2/c1-32(2,38)26-9-4-3-7-23(26)11-13-28(39-21-33(16-17-33)20-31(36)37)24-8-5-6-22(18-24)10-15-30-35-27-19-25(34)12-14-29(27)40-30/h3-10,12,14-15,18-19,28,38H,11,13,16-17,20-21H2,1-2H3,(H,36,37)/b15-10+/t28-/m1/s1 |
PubChem CID | 9959856 |
ChEMBL | CHEMBL43509 |
IUPHAR | N/A |
BindingDB | 50284901 |
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 |
---|---|---|---|---|---|
60718 | Cysteinyl leukotriene receptor 1 | Q2NNR5 | CYSLTR1 | Cavia porcellus (Guinea pig) | 340 |
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