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Name | CHEMBL282285 |
---|---|
Molecular formula | C21H22ClN3OS2 |
IUPAC name | 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]acetamide |
Molecular weight | 431.997 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | Z117583130 2-(Benzothiazol-2-ylsulfanyl)-N-[1-(4-chloro-benzyl)-piperidin-4-yl]-acetamide N-[1-(4-Chlorobenzyl)-4-piperidinyl](2-benzothiazolylthio)acetamide AKOS006598078 ZINC28230897 [ Show all ] |
Inchi Key | CDBSOQNHMUTLEM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H22ClN3OS2/c22-16-7-5-15(6-8-16)13-25-11-9-17(10-12-25)23-20(26)14-27-21-24-18-3-1-2-4-19(18)28-21/h1-8,17H,9-14H2,(H,23,26) |
PubChem CID | 10873705 |
ChEMBL | CHEMBL282285 |
IUPHAR | N/A |
BindingDB | 50099476 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
39144 | C-C chemokine receptor type 1 | P32246 | CCR1 | Homo sapiens (Human) | 355 |
39143 | C-C chemokine receptor type 3 | P51677 | CCR3 | Homo sapiens (Human) | 355 |
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