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Name | MLS002642651 |
---|---|
Molecular formula | C17H18BrNO3S |
IUPAC name | 7-bromo-11-(2-methylpropyl)-12H-benzo[d][6,1,2]benzoxathiazocine 10,10-dioxide |
Molecular weight | 396.299 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 0 |
XlogP | 4.2 |
Synonyms | 2-[2-[(Isobutylamino)methyl]phenoxy]-4-bromobenzenesulfonic acid sultam HMS3099K21 SMR001551109 KUC103622N CHEMBL1393915 |
Inchi Key | AGIMVAVIQFNDSU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H18BrNO3S/c1-12(2)10-19-11-13-5-3-4-6-15(13)22-16-9-14(18)7-8-17(16)23(19,20)21/h3-9,12H,10-11H2,1-2H3 |
PubChem CID | 44602060 |
ChEMBL | CHEMBL1393915 |
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 |
---|---|---|---|---|---|
463482 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218