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Name | SMR000198124 |
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Molecular formula | C21H20F3N3O4S |
IUPAC name | N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]naphthalene-2-sulfonamide |
Molecular weight | 467.463 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 5.8 |
Synonyms | ZINC8672246 MLS000577044 N-(4-{[2-nitro-4-(trifluoromethyl)phenyl]amino}butyl)-2-naphthalenesulfonamide AKOS000423746 HMS2464H10 [ Show all ] |
Inchi Key | ADDCDDPNHJPLRL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H20F3N3O4S/c22-21(23,24)17-8-10-19(20(14-17)27(28)29)25-11-3-4-12-26-32(30,31)18-9-7-15-5-1-2-6-16(15)13-18/h1-2,5-10,13-14,25-26H,3-4,11-12H2 |
PubChem CID | 2936924 |
ChEMBL | CHEMBL1556272 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
463198 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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