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Name | CHEMBL61211 |
---|---|
Molecular formula | C27H24O7 |
IUPAC name | (2R)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-6-propan-2-yloxy-2H-chromene-3-carboxylic acid |
Molecular weight | 460.482 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 4.9 |
Synonyms | BDBM50112678 2-Benzo[1,3]dioxol-5-yl-6-isopropoxy-4-(4-methoxy-phenyl)-2H-chromene-3-carboxylic acid (R)-2-Benzo[1,3]dioxol-5-yl-6-isopropoxy-4-(4-methoxy-phenyl)-2H-chromene-3-carboxylic acid |
Inchi Key | BATSJXIVNKJCKQ-AREMUKBSSA-N |
Inchi ID | InChI=1S/C27H24O7/c1-15(2)33-19-9-11-21-20(13-19)24(16-4-7-18(30-3)8-5-16)25(27(28)29)26(34-21)17-6-10-22-23(12-17)32-14-31-22/h4-13,15,26H,14H2,1-3H3,(H,28,29)/t26-/m1/s1 |
PubChem CID | 9825494 |
ChEMBL | CHEMBL61211 |
IUPHAR | N/A |
BindingDB | 50112678 |
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 |
---|---|---|---|---|---|
19172 | Endothelin receptor type B | P35463 | EDNRB | Sus scrofa (Pig) | 443 |
19174 | Endothelin receptor type B | P24530 | EDNRB | Homo sapiens (Human) | 442 |
19173 | Endothelin-1 receptor | P25101 | EDNRA | Homo sapiens (Human) | 427 |
19175 | Endothelin-1 receptor | P26684 | Ednra | Rattus norvegicus (Rat) | 426 |
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