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Name | CHEMBL33074 |
---|---|
Molecular formula | C28H36N2O2 |
IUPAC name | N-[1-(cyclooctylmethyl)piperidin-4-yl]-9H-xanthene-9-carboxamide |
Molecular weight | 432.608 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 6.5 |
Synonyms | OCSQKSSLYYSHOM-UHFFFAOYSA-N 9H-Xanthene-9-carboxylic acid (1-cyclooctylmethyl-piperidin-4-yl)-amide SCHEMBL8186702 BDBM50098650 N-[1-(cyclooctylmethyl)piperidin-4-yl]xanthene-9-carboxamide |
Inchi Key | OCSQKSSLYYSHOM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H36N2O2/c31-28(27-23-12-6-8-14-25(23)32-26-15-9-7-13-24(26)27)29-22-16-18-30(19-17-22)20-21-10-4-2-1-3-5-11-21/h6-9,12-15,21-22,27H,1-5,10-11,16-20H2,(H,29,31) |
PubChem CID | 10765199 |
ChEMBL | CHEMBL33074 |
IUPHAR | N/A |
BindingDB | 50098650 |
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 |
---|---|---|---|---|---|
238000 | C-C chemokine receptor type 1 | P32246 | CCR1 | Homo sapiens (Human) | 355 |
238001 | C-C chemokine receptor type 1 | P51675 | Ccr1 | Mus musculus (Mouse) | 355 |
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