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Name | 75715-89-8 |
---|---|
Molecular formula | C23H37NO5S |
IUPAC name | 6-(2-amino-2-carboxyethyl)sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid |
Molecular weight | 439.611 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 4 |
XlogP | 2.1 |
Synonyms | 6-(2-amino-3-hydroxy-3-oxopropyl)sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid AC1L1GZE ((5(S),6(R),7E,9E,11Z,14Z)-5-Hydroxy-6-S-cysteinyleicosatetraenoic acid 6-[(2-amino-2-carboxyethyl)sulfanyl]-5-hydroxyicosa-7,9,11,14-tetraenoic acid CTK6D7032 |
Inchi Key | OTZRAYGBFWZKMX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H37NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21(30-18-19(24)23(28)29)20(25)15-14-17-22(26)27/h6-7,9-13,16,19-21,25H,2-5,8,14-15,17-18,24H2,1H3,(H,26,27)(H,28,29) |
PubChem CID | 3909 |
ChEMBL | N/A |
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 |
---|---|---|---|---|---|
250377 | Leukotriene B4 receptor 1 | Q15722 | LTB4R | Homo sapiens (Human) | 352 |
250376 | Leukotriene B4 receptor 2 | Q9NPC1 | LTB4R2 | Homo sapiens (Human) | 358 |
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