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Name | CHEMBL427396 |
---|---|
Molecular formula | C23H26ClF3N4O2 |
IUPAC name | 2-amino-N-[2-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methylamino]-2-oxoethyl]-5-(trifluoromethyl)benzamide |
Molecular weight | 482.932 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 4.2 |
Synonyms | SCHEMBL4848457 AKNWXVJEVORFRQ-UHFFFAOYSA-N 1-(4-chlorobenzyl)-4-[{(N-(2-amino-5-trifluoromethylbenzoyl)glycyl)amino}methyl]piperidine BDBM50187055 N-(2-((1-(4-chlorobenzyl)piperidin-4-yl)methylamino)-2-oxoethyl)-2-amino-5-(trifluoromethyl)benzamide |
Inchi Key | AKNWXVJEVORFRQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H26ClF3N4O2/c24-18-4-1-16(2-5-18)14-31-9-7-15(8-10-31)12-29-21(32)13-30-22(33)19-11-17(23(25,26)27)3-6-20(19)28/h1-6,11,15H,7-10,12-14,28H2,(H,29,32)(H,30,33) |
PubChem CID | 9934977 |
ChEMBL | CHEMBL427396 |
IUPHAR | N/A |
BindingDB | 50187055 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
7726 | C-C chemokine receptor type 2 | P41597 | CCR2 | Homo sapiens (Human) | 374 |
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