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Name | CHEMBL2163572 |
---|---|
Molecular formula | C29H38N4O3 |
IUPAC name | N-(1-adamantyl)-2-ethyl-6-(4-methylpiperazin-1-yl)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13),11-tetraene-11-carboxamide |
Molecular weight | 490.648 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.2 |
Synonyms | CHEMBL2219876 BDBM50395149 |
Inchi Key | ADTNRWZCOMTXFC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H38N4O3/c1-3-21-17-36-27-24(32-8-6-31(2)7-9-32)5-4-22-25(27)33(21)16-23(26(22)34)28(35)30-29-13-18-10-19(14-29)12-20(11-18)15-29/h4-5,16,18-21H,3,6-15,17H2,1-2H3,(H,30,35) |
PubChem CID | 60194939 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50395149 |
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 |
---|---|---|---|---|---|
3073 | Cannabinoid receptor 1 | P20272 | Cnr1 | Rattus norvegicus (Rat) | 473 |
3074 | Cannabinoid receptor 1 | P21554 | CNR1 | Homo sapiens (Human) | 472 |
3072 | Cannabinoid receptor 2 | P34972 | CNR2 | Homo sapiens (Human) | 360 |
459250 | Cannabinoid receptor 2 | Q9QZN9 | Cnr2 | Rattus norvegicus (Rat) | 360 |
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