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Name | CHEMBL174573 |
---|---|
Molecular formula | C29H28O10 |
IUPAC name | (Z)-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-3-[(3,4,5-trimethoxyphenyl)methyl]but-2-enoic acid |
Molecular weight | 536.533 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 1 |
XlogP | 4.6 |
Synonyms | BDBM50146622 SCHEMBL8183680 (Z)-2-(7-Methoxy-benzo[1,3]dioxol-5-yl)-4-(4-methoxy-phenyl)-4-oxo-3-(3,4,5-trimethoxy-benzyl)-but-2-enoic acid |
Inchi Key | BTEOYYDFLYMVQF-QQTULTPQSA-N |
Inchi ID | InChI=1S/C29H28O10/c1-33-19-8-6-17(7-9-19)26(30)20(10-16-11-21(34-2)27(37-5)22(12-16)35-3)25(29(31)32)18-13-23(36-4)28-24(14-18)38-15-39-28/h6-9,11-14H,10,15H2,1-5H3,(H,31,32)/b25-20- |
PubChem CID | 10840068 |
ChEMBL | CHEMBL174573 |
IUPHAR | N/A |
BindingDB | 50146622 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
32262 | Endothelin-1 receptor | P26684 | Ednra | Rattus norvegicus (Rat) | 426 |
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