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Name | CHEMBL58387 |
---|---|
Molecular formula | C31H38N4O |
IUPAC name | (2,4-dimethylpyridin-3-yl)-[4-methyl-4-[4-(N-phenylanilino)piperidin-1-yl]piperidin-1-yl]methanone |
Molecular weight | 482.672 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 0 |
XlogP | 5.8 |
Synonyms | (2,4-dimethylpyridin-3-yl)-[4-methyl-4-[4-(N-phenylanilino)piperidin-1-yl]piperidin-1-yl]methanone BDBM50143757 (2,4-Dimethyl-pyridin-3-yl)-(4-diphenylamino-4''-methyl-[1,4'']bipiperidinyl-1''-yl)-methanone [1,4'-Bipiperidin]-4-amine, 1'-[(2,4-dimethyl-3-pyridinyl)carbonyl]-4'-methyl-N,N-diphenyl- (2,4-dimethylpyridin-3-yl)(4-(4-(diphenylamino)piperidin-1-yl)-4-methylpiperidin-1-yl)methanone [ Show all ] |
Inchi Key | KFQMAIZBNWWGPO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H38N4O/c1-24-14-19-32-25(2)29(24)30(36)33-22-17-31(3,18-23-33)34-20-15-28(16-21-34)35(26-10-6-4-7-11-26)27-12-8-5-9-13-27/h4-14,19,28H,15-18,20-23H2,1-3H3 |
PubChem CID | 3008927 |
ChEMBL | CHEMBL58387 |
IUPHAR | N/A |
BindingDB | 50143757 |
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 |
---|---|---|---|---|---|
168004 | C-C chemokine receptor type 5 | P51681 | CCR5 | Homo sapiens (Human) | 352 |
168005 | C-C chemokine receptor type 5 | P61814 | CCR5 | Macaca fascicularis (Crab-eating macaque) | 352 |
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