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Name | CHEMBL274038 |
---|---|
Molecular formula | C31H32ClN2NaO2S |
IUPAC name | sodium;(6S)-6-[3-[2-(7-chloroquinolin-2-yl)ethyl]phenyl]-3,3-dimethyl-6-(pyridin-2-ylmethylsulfanyl)hexanoate |
Molecular weight | 555.109 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | None |
Synonyms | N/A |
Inchi Key | ATQKBMWPOHXARU-JMAPEOGHSA-M |
Inchi ID | InChI=1S/C31H33ClN2O2S.Na/c1-31(2,20-30(35)36)16-15-29(37-21-27-8-3-4-17-33-27)24-7-5-6-22(18-24)9-13-26-14-11-23-10-12-25(32)19-28(23)34-26;/h3-8,10-12,14,17-19,29H,9,13,15-16,20-21H2,1-2H3,(H,35,36);/q;+1/p-1/t29-;/m0./s1 |
PubChem CID | 44269382 |
ChEMBL | CHEMBL274038 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
14223 | Cysteinyl leukotriene receptor 1 | Q2NNR5 | CYSLTR1 | Cavia porcellus (Guinea pig) | 340 |
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