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Name | N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
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Molecular formula | C17H15NO5 |
IUPAC name | N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide |
Molecular weight | 313.309 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 2.3 |
Synonyms | AF-399/41704034 EU-0055439 N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide BAS 07589401 MLS000529000 [ Show all ] |
Inchi Key | AHFYTKJFWHIEBG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H15NO5/c19-17(16-9-20-12-3-1-2-4-14(12)23-16)18-8-11-5-6-13-15(7-11)22-10-21-13/h1-7,16H,8-10H2,(H,18,19) |
PubChem CID | 2811292 |
ChEMBL | CHEMBL1330686 |
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 |
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463549 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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