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Name | CHEMBL1650353 |
---|---|
Molecular formula | C21H15F6N3O |
IUPAC name | N-[2,6-bis[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]propanamide |
Molecular weight | 439.361 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | N/A |
Inchi Key | AKBISJVDIOWOKZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H15F6N3O/c1-2-18(31)29-17-11-16(12-3-7-14(8-4-12)20(22,23)24)28-19(30-17)13-5-9-15(10-6-13)21(25,26)27/h3-11H,2H2,1H3,(H,28,29,30,31) |
PubChem CID | 50940968 |
ChEMBL | CHEMBL1650353 |
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 |
---|---|---|---|---|---|
7400 | Adenosine receptor A1 | P30542 | ADORA1 | Homo sapiens (Human) | 326 |
7401 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
7399 | Adenosine receptor A2b | P29275 | ADORA2B | Homo sapiens (Human) | 332 |
442002 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
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