You can:
Name | CHEMBL382733 |
---|---|
Molecular formula | C26H37NO2 |
IUPAC name | (3R,3aS,4S,4aR,8aS,9aR)-4-[(E)-2-(6-hexylpyridin-2-yl)ethenyl]-3-methyl-3a,4,4a,5,6,7,8,8a,9,9a-decahydro-3H-benzo[f][2]benzofuran-1-one |
Molecular weight | 395.587 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 7.3 |
Synonyms | BDBM50173435 (3R,3aS,4S,4aR,8aS,9aR)-4-[(E)-2-(6-Hexyl-pyridin-2-yl)-vinyl]-3-methyl-decahydro-naphtho[2,3-c]furan-1-one |
Inchi Key | BUSCNAOZCNJILN-UVQWQBNFSA-N |
Inchi ID | InChI=1S/C26H37NO2/c1-3-4-5-6-11-20-12-9-13-21(27-20)15-16-23-22-14-8-7-10-19(22)17-24-25(23)18(2)29-26(24)28/h9,12-13,15-16,18-19,22-25H,3-8,10-11,14,17H2,1-2H3/b16-15+/t18-,19+,22-,23+,24-,25+/m1/s1 |
PubChem CID | 11703925 |
ChEMBL | CHEMBL382733 |
IUPHAR | N/A |
BindingDB | 50173435 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
33319 | Proteinase-activated receptor 1 | P25116 | F2R | Homo sapiens (Human) | 425 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417