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Name | CHEMBL33614 |
---|---|
Molecular formula | C31H43IN2O2 |
IUPAC name | N-[1-(cyclooctylmethyl)-1-propylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide;iodide |
Molecular weight | 602.601 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | None |
Synonyms | SCHEMBL8191611 |
Inchi Key | LBQZHOGHEGMWQM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H42N2O2.HI/c1-2-20-33(23-24-12-6-4-3-5-7-13-24)21-18-25(19-22-33)32-31(34)30-26-14-8-10-16-28(26)35-29-17-11-9-15-27(29)30;/h8-11,14-17,24-25,30H,2-7,12-13,18-23H2,1H3;1H |
PubChem CID | 10507822 |
ChEMBL | CHEMBL33614 |
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 |
---|---|---|---|---|---|
183486 | C-C chemokine receptor type 1 | P51675 | Ccr1 | Mus musculus (Mouse) | 355 |
183487 | C-C chemokine receptor type 1 | P32246 | CCR1 | Homo sapiens (Human) | 355 |
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