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Name | CHEMBL2349187 |
---|---|
Molecular formula | C20H27N5OS2 |
IUPAC name | (3R)-3-[(2-amino-5-benzylsulfanyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl)amino]-2,5-dimethylhexan-2-ol |
Molecular weight | 417.59 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 5.0 |
Synonyms | BDBM50432458 |
Inchi Key | GGCGTVNPAQRGER-CQSZACIVSA-N |
Inchi ID | InChI=1S/C20H27N5OS2/c1-12(2)10-14(20(3,4)26)22-16-15-17(23-18(21)28-15)25-19(24-16)27-11-13-8-6-5-7-9-13/h5-9,12,14,26H,10-11H2,1-4H3,(H3,21,22,23,24,25)/t14-/m1/s1 |
PubChem CID | 71625145 |
ChEMBL | CHEMBL2349187 |
IUPHAR | N/A |
BindingDB | 50432458 |
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 |
---|---|---|---|---|---|
95583 | CX3C chemokine receptor 1 | P49238 | CX3CR1 | Homo sapiens (Human) | 355 |
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