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Name | CHEMBL2349339 |
---|---|
Molecular formula | C17H21N5OS2 |
IUPAC name | (2R)-2-[(2-amino-5-benzylsulfanyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl)amino]pentan-1-ol |
Molecular weight | 375.509 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 3.9 |
Synonyms | LYZBESBXJHUNLT-GFCCVEGCSA-N (2R)-2-{[2-Amino-5-(benzylthio)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]amino}pentan-1-ol SCHEMBL212013 BDBM50432442 |
Inchi Key | LYZBESBXJHUNLT-GFCCVEGCSA-N |
Inchi ID | InChI=1S/C17H21N5OS2/c1-2-6-12(9-23)19-14-13-15(20-16(18)25-13)22-17(21-14)24-10-11-7-4-3-5-8-11/h3-5,7-8,12,23H,2,6,9-10H2,1H3,(H3,18,19,20,21,22)/t12-/m1/s1 |
PubChem CID | 59799570 |
ChEMBL | CHEMBL2349339 |
IUPHAR | N/A |
BindingDB | 50432442 |
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 |
---|---|---|---|---|---|
199811 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
199812 | CX3C chemokine receptor 1 | P49238 | CX3CR1 | Homo sapiens (Human) | 355 |
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