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Name | CHEMBL2180519 |
---|---|
Molecular formula | C23H29ClN2O3S |
IUPAC name | N-[1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-1-phenylmethanesulfonamide |
Molecular weight | 449.006 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 4.6 |
Synonyms | BIPXLWDKRNNXHX-UHFFFAOYSA-N N-(1-(4-(4-Chlorophenyl)piperidin-1-yl)-3-methyl-1-oxobutan-2-yl)(phenyl)methanesulfonamide SCHEMBL2160438 BDBM50399249 |
Inchi Key | BIPXLWDKRNNXHX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H29ClN2O3S/c1-17(2)22(25-30(28,29)16-18-6-4-3-5-7-18)23(27)26-14-12-20(13-15-26)19-8-10-21(24)11-9-19/h3-11,17,20,22,25H,12-16H2,1-2H3 |
PubChem CID | 57888688 |
ChEMBL | CHEMBL2180519 |
IUPHAR | N/A |
BindingDB | 50399249 |
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 |
---|---|---|---|---|---|
24650 | C-C chemokine receptor type 1 | P32246 | CCR1 | Homo sapiens (Human) | 355 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218