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Name | CHEMBL129406 |
---|---|
Molecular formula | C16H14N2 |
IUPAC name | 1-ethyl-3-pyridin-2-ylisoquinoline |
Molecular weight | 234.302 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 0 |
XlogP | 3.6 |
Synonyms | 1-Ethyl-3-(2-pyridinyl)isoquinoline BDBM50067093 SCHEMBL11366714 1-Ethyl-3-pyridin-2-yl-isoquinoline |
Inchi Key | AUMCXSHLGHUARA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H14N2/c1-2-14-13-8-4-3-7-12(13)11-16(18-14)15-9-5-6-10-17-15/h3-11H,2H2,1H3 |
PubChem CID | 13384165 |
ChEMBL | CHEMBL129406 |
IUPHAR | N/A |
BindingDB | 50067093 |
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 |
---|---|---|---|---|---|
14762 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
14760 | Adenosine receptor A2a | P30543 | Adora2a | Rattus norvegicus (Rat) | 410 |
14761 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
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