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Name | CHEMBL2398758 |
---|---|
Molecular formula | C23H34ClN3O2 |
IUPAC name | N-[(2R)-1-[4-(4-chlorophenyl)-3,3-dimethylpiperazin-1-yl]-3-methyl-1-oxobutan-2-yl]cyclopentanecarboxamide |
Molecular weight | 419.994 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 4.8 |
Synonyms | BDBM50436268 SCHEMBL4492381 |
Inchi Key | AHKAIGXAFJEQRP-HXUWFJFHSA-N |
Inchi ID | InChI=1S/C23H34ClN3O2/c1-16(2)20(25-21(28)17-7-5-6-8-17)22(29)26-13-14-27(23(3,4)15-26)19-11-9-18(24)10-12-19/h9-12,16-17,20H,5-8,13-15H2,1-4H3,(H,25,28)/t20-/m1/s1 |
PubChem CID | 24738063 |
ChEMBL | CHEMBL2398758 |
IUPHAR | N/A |
BindingDB | 50436268 |
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 |
---|---|---|---|---|---|
5642 | 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