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Name | 3-[(3-bromo-2-methylphenyl)sulfonyl]-4,6-dimethyl-2(1H)-pyridinone |
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Molecular formula | C14H14BrNO3S |
IUPAC name | 3-(3-bromo-2-methylphenyl)sulfonyl-4,6-dimethyl-1H-pyridin-2-one |
Molecular weight | 356.234 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 2.6 |
Synonyms | KS-000039FD AC1LRXZF MolPort-002-871-567 3-(3-bromo-2-methylbenzenesulfonyl)-4,6-dimethyl-1,2-dihydropyridin-2-one CHEMBL1445533 [ Show all ] |
Inchi Key | AEQPFJNQQIVALH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H14BrNO3S/c1-8-7-9(2)16-14(17)13(8)20(18,19)12-6-4-5-11(15)10(12)3/h4-7H,1-3H3,(H,16,17) |
PubChem CID | 1479283 |
ChEMBL | CHEMBL1445533 |
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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463341 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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