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Name | MLS000554446 |
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Molecular formula | C19H14N4O3S2 |
IUPAC name | (NZ)-4-methyl-N-[4-oxo-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-ylidene]benzenesulfonamide |
Molecular weight | 410.466 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.9 |
Synonyms | SR-01000115551 4-methyl-N-[(1Z)-4-oxo-3-(1H-1,2,4-triazol-3-ylsulfanyl)naphthalen-1(4H)-ylidene]benzenesulfonamide AC1NTNOM SCHEMBL2780946 CHEMBL1968732 [ Show all ] |
Inchi Key | HDOKKAMQZREOLG-KQWNVCNZSA-N |
Inchi ID | InChI=1S/C19H14N4O3S2/c1-12-6-8-13(9-7-12)28(25,26)23-16-10-17(27-19-20-11-21-22-19)18(24)15-5-3-2-4-14(15)16/h2-11H,1H3,(H,20,21,22)/b23-16- |
PubChem CID | 5433262 |
ChEMBL | CHEMBL1968732 |
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 |
---|---|---|---|---|---|
112136 | C-C chemokine receptor type 6 | P51684 | CCR6 | Homo sapiens (Human) | 374 |
112135 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
112137 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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