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Name | SMR000135825 |
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Molecular formula | C20H25ClN2O3S |
IUPAC name | 1-(5-chloro-2-ethoxyphenyl)sulfonyl-4-(3,4-dimethylphenyl)piperazine |
Molecular weight | 408.941 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 4.4 |
Synonyms | CHEMBL1572975 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-4-(3,4-dimethylphenyl)piperazine MLS000530847 AKOS016028120 Z57704858 [ Show all ] |
Inchi Key | AGVNPZWPUAUQOI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H25ClN2O3S/c1-4-26-19-8-6-17(21)14-20(19)27(24,25)23-11-9-22(10-12-23)18-7-5-15(2)16(3)13-18/h5-8,13-14H,4,9-12H2,1-3H3 |
PubChem CID | 1290133 |
ChEMBL | CHEMBL1572975 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
5257 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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