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Name | CHEMBL2349309 |
---|---|
Molecular formula | C17H22N6OS2 |
IUPAC name | (2R)-2-[[2-amino-5-(pyridin-4-ylmethylsulfanyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]amino]-4-methylpentan-1-ol |
Molecular weight | 390.524 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 3 |
XlogP | 3.3 |
Synonyms | BDBM50432424 |
Inchi Key | CTLHMCWJWNUSJJ-GFCCVEGCSA-N |
Inchi ID | InChI=1S/C17H22N6OS2/c1-10(2)7-12(8-24)20-14-13-15(21-16(18)26-13)23-17(22-14)25-9-11-3-5-19-6-4-11/h3-6,10,12,24H,7-9H2,1-2H3,(H3,18,20,21,22,23)/t12-/m1/s1 |
PubChem CID | 71625502 |
ChEMBL | CHEMBL2349309 |
IUPHAR | N/A |
BindingDB | 50432424 |
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 |
---|---|---|---|---|---|
50219 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
50220 | CX3C chemokine receptor 1 | P49238 | CX3CR1 | Homo sapiens (Human) | 355 |
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