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Name | CHEMBL143447 |
---|---|
Molecular formula | C21H26N6OS |
IUPAC name | 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]pyridine-4-carboxamide |
Molecular weight | 410.54 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 3.1 |
Synonyms | N-[4-[4-(1,2-Benzisothiazol-3-yl)piperazino]butyl]-3-aminopyridine-4-carboxamide 3-Amino-N-[4-(4-benzo[d]isothiazol-3-yl-piperazin-1-yl)-butyl]-isonicotinamide SCHEMBL9208667 BDBM50054717 |
Inchi Key | JQKRQKUNQKFRTP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H26N6OS/c22-18-15-23-9-7-16(18)21(28)24-8-3-4-10-26-11-13-27(14-12-26)20-17-5-1-2-6-19(17)29-25-20/h1-2,5-7,9,15H,3-4,8,10-14,22H2,(H,24,28) |
PubChem CID | 10597700 |
ChEMBL | CHEMBL143447 |
IUPHAR | N/A |
BindingDB | 50054717 |
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 |
---|---|---|---|---|---|
157369 | 5-hydroxytryptamine receptor 1A | Q64264 | Htr1a | Mus musculus (Mouse) | 421 |
157368 | D(2) dopamine receptor | P61168 | Drd2 | Mus musculus (Mouse) | 444 |
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