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Name | CHEMBL6913 |
---|---|
Molecular formula | C13H19NO3 |
IUPAC name | (5R,6R)-6-(propan-2-ylamino)-5,6,7,8-tetrahydronaphthalene-1,2,5-triol |
Molecular weight | 237.299 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 4 |
XlogP | 1.2 |
Synonyms | BDBM50000504 6-Isopropylamino-5,6,7,8-tetrahydro-naphthalene-1,2,5-triol (5R)-6alpha-Isopropylamino-5,6,7,8-tetrahydronaphthalene-1,2,5beta-triol |
Inchi Key | VYPNBBZHLGJXPR-ZYHUDNBSSA-N |
Inchi ID | InChI=1S/C13H19NO3/c1-7(2)14-10-5-3-9-8(12(10)16)4-6-11(15)13(9)17/h4,6-7,10,12,14-17H,3,5H2,1-2H3/t10-,12-/m1/s1 |
PubChem CID | 12353629 |
ChEMBL | CHEMBL6913 |
IUPHAR | N/A |
BindingDB | 50000504 |
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 |
---|---|---|---|---|---|
367431 | Beta-1 adrenergic receptor | P18090 | Adrb1 | Rattus norvegicus (Rat) | 466 |
367430 | Beta-2 adrenergic receptor | Q8K4Z4 | Adrb2 | Cavia porcellus (Guinea pig) | 418 |
367432 | Beta-2 adrenergic receptor | Q28044 | ADRB2 | Bos taurus (Bovine) | 418 |
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