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Name | CHEMBL434692 |
---|---|
Molecular formula | C18H14BrNOS |
IUPAC name | (2-amino-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl)-(4-bromonaphthalen-1-yl)methanone |
Molecular weight | 372.28 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 5.8 |
Synonyms | SCHEMBL5680012 |
Inchi Key | ADDRIEYGNGIDID-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H14BrNOS/c19-14-9-8-12(10-4-1-2-5-11(10)14)17(21)16-13-6-3-7-15(13)22-18(16)20/h1-2,4-5,8-9H,3,6-7,20H2 |
PubChem CID | 10292653 |
ChEMBL | CHEMBL434692 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
2147 | Adenosine receptor A1 | P30542 | ADORA1 | Homo sapiens (Human) | 326 |
441759 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
441760 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
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