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Name | CHEMBL101138 |
---|---|
Molecular formula | C21H26N4O2S |
IUPAC name | 2-[5-(5-benzyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)-1H-indol-3-yl]-N,N-dimethylethanamine |
Molecular weight | 398.525 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 2.7 |
Synonyms | SCHEMBL8806725 2-[3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl]-5-benzyl-1,2,5-thiadiazolidine 1,1-dioxide BDBM50422022 |
Inchi Key | NFLDDZPDKNUJJZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H26N4O2S/c1-23(2)11-10-18-15-22-21-9-8-19(14-20(18)21)25-13-12-24(28(25,26)27)16-17-6-4-3-5-7-17/h3-9,14-15,22H,10-13,16H2,1-2H3 |
PubChem CID | 10340828 |
ChEMBL | CHEMBL101138 |
IUPHAR | N/A |
BindingDB | 50422022 |
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 |
---|---|---|---|---|---|
222014 | 5-hydroxytryptamine receptor 1D | P79400 | HTR1D | Sus scrofa (Pig) | 291 |
222015 | 5-hydroxytryptamine receptor 2A | P14842 | Htr2a | Rattus norvegicus (Rat) | 471 |
222016 | 5-hydroxytryptamine receptor 5A | P47898 | HTR5A | Homo sapiens (Human) | 357 |
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