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Name | CHEMBL225492 |
---|---|
Molecular formula | C21H22ClN3 |
IUPAC name | N-[1-[(4-chlorophenyl)methyl]piperidin-3-yl]isoquinolin-5-amine |
Molecular weight | 351.878 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 4.8 |
Synonyms | BDBM50197902 CTK1J3393 675133-20-7 N-[1-(4-chlorobenzyl)-3-piperidyl]-N-(5-isoquinolyl)amine 5-Isoquinolinamine, N-[1-[(4-chlorophenyl)methyl]-3-piperidinyl]- [ Show all ] |
Inchi Key | AHBYTGBWKOEDEE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H22ClN3/c22-18-8-6-16(7-9-18)14-25-12-2-4-19(15-25)24-21-5-1-3-17-13-23-11-10-20(17)21/h1,3,5-11,13,19,24H,2,4,12,14-15H2 |
PubChem CID | 10360623 |
ChEMBL | CHEMBL225492 |
IUPHAR | N/A |
BindingDB | 50197902 |
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 |
---|---|---|---|---|---|
5419 | C-C chemokine receptor type 2 | P41597 | CCR2 | Homo sapiens (Human) | 374 |
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