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Name | CHEMBL541838 |
---|---|
Molecular formula | C16H17NO2 |
IUPAC name | (1R,3S)-1-(aminomethyl)-3-phenyl-3,4-dihydro-1H-isochromen-5-ol |
Molecular weight | 255.317 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 1.9 |
Synonyms | SCHEMBL9802747 1-Aminomethyl-3-phenyl-isochroman-5-ol; hydrochloride CHEMBL1190906 (1R)-1alpha-(Aminomethyl)-3,4-dihydro-3alpha-phenyl-1H-2-benzopyran-5-ol BDBM50008828 |
Inchi Key | UYGVYUSBNCJHOS-HOTGVXAUSA-N |
Inchi ID | InChI=1S/C16H17NO2/c17-10-16-12-7-4-8-14(18)13(12)9-15(19-16)11-5-2-1-3-6-11/h1-8,15-16,18H,9-10,17H2/t15-,16-/m0/s1 |
PubChem CID | 15711865 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50008828 |
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 |
---|---|---|---|---|---|
568191 | D(1) dopamine receptor | P35406 | Carassius auratus (Goldfish) | 363 | |
348658 | D(1A) dopamine receptor | P18901 | Drd1 | Rattus norvegicus (Rat) | 446 |
348657 | D(2) dopamine receptor | P61169 | Drd2 | Rattus norvegicus (Rat) | 444 |
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