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Name | CHEMBL32713 |
---|---|
Molecular formula | C32H45IN2O2 |
IUPAC name | N-[1-butyl-1-(cyclooctylmethyl)piperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide;iodide |
Molecular weight | 616.628 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | None |
Synonyms | SCHEMBL8185733 |
Inchi Key | MTPDGAANFBNMET-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H44N2O2.HI/c1-2-3-21-34(24-25-13-7-5-4-6-8-14-25)22-19-26(20-23-34)33-32(35)31-27-15-9-11-17-29(27)36-30-18-12-10-16-28(30)31;/h9-12,15-18,25-26,31H,2-8,13-14,19-24H2,1H3;1H |
PubChem CID | 10579692 |
ChEMBL | CHEMBL32713 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
213882 | C-C chemokine receptor type 1 | P32246 | CCR1 | Homo sapiens (Human) | 355 |
213883 | C-C chemokine receptor type 1 | P51675 | Ccr1 | Mus musculus (Mouse) | 355 |
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