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Name | CHEMBL143374 |
---|---|
Molecular formula | C27H30ClN2O+ |
IUPAC name | 5-[4-(4-chlorophenyl)-4-hydroxy-1-methylpiperidin-1-ium-1-yl]-2-naphthalen-2-ylpentanenitrile |
Molecular weight | 434.0 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 1 |
XlogP | 5.4 |
Synonyms | CHEMBL1180795 BDBM50082694 4-(4-Chloro-phenyl)-1-(4-cyano-4-naphthalen-2-yl-butyl)-4-hydroxy-1-methyl-piperidinium; iodide |
Inchi Key | BXUUDSFBTQCCKN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H30ClN2O/c1-30(17-14-27(31,15-18-30)25-10-12-26(28)13-11-25)16-4-7-24(20-29)23-9-8-21-5-2-3-6-22(21)19-23/h2-3,5-6,8-13,19,24,31H,4,7,14-18H2,1H3/q+1 |
PubChem CID | 10076510 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50082694 |
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 |
---|---|---|---|---|---|
35488 | C-C chemokine receptor type 1 | P32246 | CCR1 | Homo sapiens (Human) | 355 |
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