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Name | CHEMBL1081654 |
---|---|
Molecular formula | C18H22N4O2 |
IUPAC name | 6-(cyclohexylamino)-N-(4-hydroxy-2-methylphenyl)pyrimidine-4-carboxamide |
Molecular weight | 326.4 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 3.5 |
Synonyms | BGHQPXFERWTACA-UHFFFAOYSA-N SCHEMBL3025777 6-(Cyclohexylamino)-N-(4-hydroxy-2-methylphenyl)pyrimidine-4-carboxamide BDBM50313325 |
Inchi Key | BGHQPXFERWTACA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H22N4O2/c1-12-9-14(23)7-8-15(12)22-18(24)16-10-17(20-11-19-16)21-13-5-3-2-4-6-13/h7-11,13,23H,2-6H2,1H3,(H,22,24)(H,19,20,21) |
PubChem CID | 25182621 |
ChEMBL | CHEMBL1081654 |
IUPHAR | N/A |
BindingDB | 50313325 |
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 |
---|---|---|---|---|---|
23017 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
23015 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
23016 | Sphingosine 1-phosphate receptor 5 | Q9H228 | S1PR5 | Homo sapiens (Human) | 398 |
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