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Name | Leukotriene C3 |
---|---|
Molecular formula | C30H49N3O9S |
IUPAC name | 6-[2-[(4-amino-4-carboxybutanoyl)amino]-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-5-hydroxyicosa-7,9,11-trienoic acid |
Molecular weight | 627.794 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 7 |
XlogP | 1.3 |
Synonyms | CTK8G0550 6-[2-[(4-amino-5-hydroxy-5-oxopentanoyl)amino]-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-5-hydroxyicosa-7,9,11-trienoic acid AC1NQ3XN 77209-77-9 |
Inchi Key | AIJDQMYBRDJHHT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H49N3O9S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25(24(34)15-14-17-27(36)37)43-21-23(29(40)32-20-28(38)39)33-26(35)19-18-22(31)30(41)42/h9-13,16,22-25,34H,2-8,14-15,17-21,31H2,1H3,(H,32,40)(H,33,35)(H,36,37)(H,38,39)(H,41,42) |
PubChem CID | 5214901 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 85686 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
555507 | Leukotriene B4 receptor 1 | Q15722 | LTB4R | Homo sapiens (Human) | 352 |
459278 | Leukotriene B4 receptor 2 | Q9NPC1 | LTB4R2 | Homo sapiens (Human) | 358 |
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