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Name | CHEMBL109288 |
---|---|
Molecular formula | C19H26ClN3O3S |
IUPAC name | (1R)-1-(3-chlorophenyl)-2-[2-[4-[dimethylsulfamoyl(methyl)amino]phenyl]ethylamino]ethanol |
Molecular weight | 411.945 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 2.3 |
Synonyms | N''methyl-[4-(2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}ethyl)phenyl]-N,N-dimethylsulfamide SCHEMBL6335077 BDBM50147437 |
Inchi Key | AULBTWGSEOLSAY-IBGZPJMESA-N |
Inchi ID | InChI=1S/C19H26ClN3O3S/c1-22(2)27(25,26)23(3)18-9-7-15(8-10-18)11-12-21-14-19(24)16-5-4-6-17(20)13-16/h4-10,13,19,21,24H,11-12,14H2,1-3H3/t19-/m0/s1 |
PubChem CID | 10295131 |
ChEMBL | CHEMBL109288 |
IUPHAR | N/A |
BindingDB | 50147437 |
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 |
---|---|---|---|---|---|
14730 | Beta-1 adrenergic receptor | P08588 | ADRB1 | Homo sapiens (Human) | 477 |
14732 | Beta-2 adrenergic receptor | P07550 | ADRB2 | Homo sapiens (Human) | 413 |
14731 | Beta-3 adrenergic receptor | P13945 | ADRB3 | Homo sapiens (Human) | 408 |
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