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Name | CHEMBL2401802 |
---|---|
Molecular formula | C27H28N4O2S |
IUPAC name | 2-[[2-(2-tert-butylphenoxy)pyridin-3-yl]amino]-N,N-dimethyl-5-phenyl-1,3-thiazole-4-carboxamide |
Molecular weight | 472.607 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 6.7 |
Synonyms | BDBM50436914 SCHEMBL12681181 |
Inchi Key | ANYGTWZUDLCXOU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H28N4O2S/c1-27(2,3)19-14-9-10-16-21(19)33-24-20(15-11-17-28-24)29-26-30-22(25(32)31(4)5)23(34-26)18-12-7-6-8-13-18/h6-17H,1-5H3,(H,29,30) |
PubChem CID | 59129109 |
ChEMBL | CHEMBL2401802 |
IUPHAR | N/A |
BindingDB | 50436914 |
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 |
---|---|---|---|---|---|
10007 | P2Y purinoceptor 1 | P47900 | P2RY1 | Homo sapiens (Human) | 373 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417