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Name | CHEMBL33340 |
---|---|
Molecular formula | C30H39Br2IN2O2 |
IUPAC name | 2,7-dibromo-N-[1-(cyclooctylmethyl)-1-ethylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide;iodide |
Molecular weight | 746.366 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | None |
Synonyms | SCHEMBL8186642 SCHEMBL8186644 SCHEMBL8191116 |
Inchi Key | RSQHLJMDYDIXNK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H38Br2N2O2.HI/c1-2-34(20-21-8-6-4-3-5-7-9-21)16-14-24(15-17-34)33-30(35)29-25-18-22(31)10-12-27(25)36-28-13-11-23(32)19-26(28)29;/h10-13,18-19,21,24,29H,2-9,14-17,20H2,1H3;1H |
PubChem CID | 10676519 |
ChEMBL | CHEMBL33340 |
IUPHAR | N/A |
BindingDB | 50098648 |
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 |
---|---|---|---|---|---|
304072 | C-C chemokine receptor type 1 | P32246 | CCR1 | Homo sapiens (Human) | 355 |
304073 | C-C chemokine receptor type 1 | P51675 | Ccr1 | Mus musculus (Mouse) | 355 |
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