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Name | CHEMBL141392 |
---|---|
Molecular formula | C21H26N6OS |
IUPAC name | 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]pyridine-3-carboxamide |
Molecular weight | 410.54 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 3.4 |
Synonyms | BDBM50054705 N-[4-[4-(1,2-Benzisothiazol-3-yl)piperazino]butyl]-2-aminopyridine-3-carboxamide 2-Amino-N-[4-(4-benzo[d]isothiazol-3-yl-piperazin-1-yl)-butyl]-nicotinamide SCHEMBL9270969 |
Inchi Key | VXSBWAZGDNTUOU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H26N6OS/c22-19-17(7-5-10-23-19)21(28)24-9-3-4-11-26-12-14-27(15-13-26)20-16-6-1-2-8-18(16)29-25-20/h1-2,5-8,10H,3-4,9,11-15H2,(H2,22,23)(H,24,28) |
PubChem CID | 10716504 |
ChEMBL | CHEMBL141392 |
IUPHAR | N/A |
BindingDB | 50054705 |
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 |
---|---|---|---|---|---|
366804 | 5-hydroxytryptamine receptor 1A | Q64264 | Htr1a | Mus musculus (Mouse) | 421 |
366803 | D(2) dopamine receptor | P61168 | Drd2 | Mus musculus (Mouse) | 444 |
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