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Name | CHEMBL2349320 |
---|---|
Molecular formula | C18H23N5OS2 |
IUPAC name | (2R)-2-[(2-amino-5-benzylsulfanyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl)amino]-3,3-dimethylbutan-1-ol |
Molecular weight | 389.536 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 4.4 |
Synonyms | BDBM50432441 |
Inchi Key | ZKLITWMNDRXOLR-LBPRGKRZSA-N |
Inchi ID | InChI=1S/C18H23N5OS2/c1-18(2,3)12(9-24)20-14-13-15(21-16(19)26-13)23-17(22-14)25-10-11-7-5-4-6-8-11/h4-8,12,24H,9-10H2,1-3H3,(H3,19,20,21,22,23)/t12-/m0/s1 |
PubChem CID | 71625146 |
ChEMBL | CHEMBL2349320 |
IUPHAR | N/A |
BindingDB | 50432441 |
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 |
---|---|---|---|---|---|
430684 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
430685 | CX3C chemokine receptor 1 | P49238 | CX3CR1 | Homo sapiens (Human) | 355 |
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