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Name | CHEMBL182652 |
---|---|
Molecular formula | C20H26IN3O2S |
IUPAC name | 5-iodo-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]thiophene-2-carboxamide |
Molecular weight | 499.411 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.2 |
Synonyms | BDBM50149711 5-Iodo-thiophene-2-carboxylic acid {4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-amide |
Inchi Key | HBYKTDPONPUZPO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H26IN3O2S/c1-26-17-7-3-2-6-16(17)24-14-12-23(13-15-24)11-5-4-10-22-20(25)18-8-9-19(21)27-18/h2-3,6-9H,4-5,10-15H2,1H3,(H,22,25) |
PubChem CID | 44393415 |
ChEMBL | CHEMBL182652 |
IUPHAR | N/A |
BindingDB | 50149711 |
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 |
---|---|---|---|---|---|
111032 | 5-hydroxytryptamine receptor 1A | P08908 | HTR1A | Homo sapiens (Human) | 422 |
111033 | D(1A) dopamine receptor | P50130 | DRD1 | Sus scrofa (Pig) | 446 |
111029 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
111031 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
111030 | D(4) dopamine receptor | P21917 | DRD4 | Homo sapiens (Human) | 467 |
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