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Name | CHEMBL58331 |
---|---|
Molecular formula | C27H35Cl2N3O2 |
IUPAC name | N-[4-[4-(2-acetamidoethyl)piperidin-1-yl]-2-(3,4-dichlorophenyl)butyl]-N-methylbenzamide |
Molecular weight | 504.496 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 5.2 |
Synonyms | N-[4-[4-(2-Acetylamino-ethyl)-piperidin-1-yl]-2-(3,4-dichloro-phenyl)-butyl]-N-methyl-benzamide BDBM50071116 |
Inchi Key | GBOCBIASBIMNAJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H35Cl2N3O2/c1-20(33)30-14-10-21-11-15-32(16-12-21)17-13-24(23-8-9-25(28)26(29)18-23)19-31(2)27(34)22-6-4-3-5-7-22/h3-9,18,21,24H,10-17,19H2,1-2H3,(H,30,33) |
PubChem CID | 22405753 |
ChEMBL | CHEMBL58331 |
IUPHAR | N/A |
BindingDB | 50071116 |
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 |
---|---|---|---|---|---|
92441 | Substance-K receptor | Q64077 | TACR2 | Cavia porcellus (Guinea pig) | 402 |
92442 | Substance-K receptor | P21452 | TACR2 | Homo sapiens (Human) | 398 |
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