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Name | CHEMBL64832 |
---|---|
Molecular formula | C24H26O6 |
IUPAC name | 2-(1,3-benzodioxol-5-yl)-4-butyl-6-propan-2-yloxy-2H-chromene-3-carboxylic acid |
Molecular weight | 410.466 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 5.2 |
Synonyms | 2-(1,3-Benzodioxole-5-yl)-4-butyl-6-isopropoxy-2H-1-benzopyran-3-carboxylic acid BDBM50112691 2-Benzo[1,3]dioxol-5-yl-4-butyl-6-isopropoxy-2H-chromene-3-carboxylic acid |
Inchi Key | GOMOLLUWOMVWFU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H26O6/c1-4-5-6-17-18-12-16(29-14(2)3)8-10-19(18)30-23(22(17)24(25)26)15-7-9-20-21(11-15)28-13-27-20/h7-12,14,23H,4-6,13H2,1-3H3,(H,25,26) |
PubChem CID | 10916597 |
ChEMBL | CHEMBL64832 |
IUPHAR | N/A |
BindingDB | 50112691 |
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 |
---|---|---|---|---|---|
101364 | Endothelin receptor type B | P35463 | EDNRB | Sus scrofa (Pig) | 443 |
101363 | Endothelin-1 receptor | P26684 | Ednra | Rattus norvegicus (Rat) | 426 |
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