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Name | CHEMBL401929 |
---|---|
Molecular formula | C33H36N4O |
IUPAC name | [4-methyl-4-[4-(N-pyridin-3-ylanilino)piperidin-1-yl]piperidin-1-yl]-naphthalen-1-ylmethanone |
Molecular weight | 504.678 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 0 |
XlogP | 6.3 |
Synonyms | BDBM50234730 (4-methyl-4-(4-(phenyl(pyridin-3-yl)amino)piperidin-1-yl)piperidin-1-yl)(naphthalen-1-yl)methanone |
Inchi Key | OYJCCUUCPLNDIZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C33H36N4O/c1-33(18-23-35(24-19-33)32(38)31-15-7-10-26-9-5-6-14-30(26)31)36-21-16-28(17-22-36)37(27-11-3-2-4-12-27)29-13-8-20-34-25-29/h2-15,20,25,28H,16-19,21-24H2,1H3 |
PubChem CID | 44447732 |
ChEMBL | CHEMBL401929 |
IUPHAR | N/A |
BindingDB | 50234730 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
253291 | C-C chemokine receptor type 5 | P61814 | CCR5 | Macaca fascicularis (Crab-eating macaque) | 352 |
253292 | C-C chemokine receptor type 5 | P51681 | CCR5 | Homo sapiens (Human) | 352 |
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