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Name | Ethanesulfonamide, N-[3-(1H-imidazol-4-ylmethyl)-2-methylphenyl]- |
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Molecular formula | C13H17N3O2S |
IUPAC name | N-[3-(1H-imidazol-5-ylmethyl)-2-methylphenyl]ethanesulfonamide |
Molecular weight | 279.358 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 1.7 |
Synonyms | DTXSID10432636 258526-72-6 CHEMBL111734 AKOS030595661 CTK0J3739 [ Show all ] |
Inchi Key | HZHOPJIZCQDHMZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H17N3O2S/c1-3-19(17,18)16-13-6-4-5-11(10(13)2)7-12-8-14-9-15-12/h4-6,8-9,16H,3,7H2,1-2H3,(H,14,15) |
PubChem CID | 9903797 |
ChEMBL | CHEMBL111734 |
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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127713 | Alpha-1A adrenergic receptor | O02824 | ADRA1A | Oryctolagus cuniculus (Rabbit) | 466 |
127717 | Alpha-1A adrenergic receptor | P43140 | Adra1a | Rattus norvegicus (Rat) | 466 |
127714 | Alpha-1B adrenergic receptor | P18841 | ADRA1B | Mesocricetus auratus (Golden hamster) | 515 |
127716 | Alpha-1B adrenergic receptor | P15823 | Adra1b | Rattus norvegicus (Rat) | 515 |
127715 | Alpha-1D adrenergic receptor | P23944 | Adra1d | Rattus norvegicus (Rat) | 561 |
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