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Name | MLS000034919 |
---|---|
Molecular formula | C21H18N4O3 |
IUPAC name | ethyl 7-benzyl-6-imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate |
Molecular weight | 374.4 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 1.9 |
Synonyms | 1-Benzyl-2-imino-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid ethyl ester BAS 04995196 HMS2345I03 SR-01000322369-1 497242-28-1 [ Show all ] |
Inchi Key | FCFRRERPZXNRCF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H18N4O3/c1-2-28-21(27)15-12-16-19(23-17-10-6-7-11-24(17)20(16)26)25(18(15)22)13-14-8-4-3-5-9-14/h3-12,22H,2,13H2,1H3 |
PubChem CID | 651615 |
ChEMBL | CHEMBL1420151 |
IUPHAR | N/A |
BindingDB | 61397 |
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 |
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74877 | Cannabinoid receptor 1 | P21554 | CNR1 | Homo sapiens (Human) | 472 |
74875 | Cannabinoid receptor 2 | P34972 | CNR2 | Homo sapiens (Human) | 360 |
74878 | G-protein coupled receptor 35 | Q9HC97 | GPR35 | Homo sapiens (Human) | 309 |
74876 | G-protein coupled receptor 55 | Q9Y2T6 | GPR55 | Homo sapiens (Human) | 319 |
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