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Name | CHEMBL364398 |
---|---|
Molecular formula | C23H37N3O3S |
IUPAC name | 2-[2,2-dioxo-1-[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]-4H-2lambda6,1,3-benzothiadiazin-3-yl]ethanol |
Molecular weight | 435.627 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.3 |
Synonyms | BDBM50153132 SCHEMBL3868218 2-{1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-2,2-dioxo-1,4-dihydro-2H-2lambda*6*-benzo[1,2,6]thiadiazin-3-yl}-ethanol |
Inchi Key | AEXLHDOOHWXDNZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H37N3O3S/c1-18(2)19-7-9-21(10-8-19)24-13-11-22(12-14-24)26-23-6-4-3-5-20(23)17-25(15-16-27)30(26,28)29/h3-6,18-19,21-22,27H,7-17H2,1-2H3 |
PubChem CID | 10137876 |
ChEMBL | CHEMBL364398 |
IUPHAR | N/A |
BindingDB | 50153132 |
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 |
---|---|---|---|---|---|
3937 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
3940 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
3938 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
3939 | Nociceptin receptor | P41146 | OPRL1 | Homo sapiens (Human) | 370 |
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