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Name | AC1NJE6B |
---|---|
Molecular formula | C20H23N3O5S |
IUPAC name | 2-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione |
Molecular weight | 417.48 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 0.5 |
Synonyms | CHEMBL1898098 2-{2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl}-2,3,3a,4,7,7a-hexahydro-1H-isoindole-1,3-dione MLS002248789 AKOS033863707 Z23144489 [ Show all ] |
Inchi Key | ACVHQFKURRSPHB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H23N3O5S/c24-18(14-23-19(25)16-8-4-5-9-17(16)20(23)26)21-10-12-22(13-11-21)29(27,28)15-6-2-1-3-7-15/h1-7,16-17H,8-14H2 |
PubChem CID | 4845766 |
ChEMBL | CHEMBL1898098 |
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 |
---|---|---|---|---|---|
463179 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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