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Name | CHEMBL2349184 |
---|---|
Molecular formula | C18H22N4O4S2 |
IUPAC name | 5-benzylsulfonyl-7-[[(2R)-1-hydroxy-4-methylpentan-2-yl]amino]-3H-[1,3]thiazolo[4,5-d]pyrimidin-2-one |
Molecular weight | 422.518 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 2.7 |
Synonyms | BDBM50432462 |
Inchi Key | SAJPPXKBUXNTKQ-CYBMUJFWSA-N |
Inchi ID | InChI=1S/C18H22N4O4S2/c1-11(2)8-13(9-23)19-15-14-16(22-18(24)27-14)21-17(20-15)28(25,26)10-12-6-4-3-5-7-12/h3-7,11,13,23H,8-10H2,1-2H3,(H2,19,20,21,22,24)/t13-/m1/s1 |
PubChem CID | 71624890 |
ChEMBL | CHEMBL2349184 |
IUPHAR | N/A |
BindingDB | 50432462 |
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 |
---|---|---|---|---|---|
309476 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
309477 | CX3C chemokine receptor 1 | P49238 | CX3CR1 | Homo sapiens (Human) | 355 |
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