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Name | CHEMBL346626 |
---|---|
Molecular formula | C29H33ClN2 |
IUPAC name | (2R,3R)-2-benzhydryl-N-[3-(2-chlorophenyl)propyl]-1-azabicyclo[2.2.2]octan-3-amine |
Molecular weight | 445.047 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 1 |
XlogP | 6.8 |
Synonyms | BDBM50280467 [3-(2-Chloro-phenyl)-propyl]-[(2R,3R)-2-(2,2-diphenyl-ethyl)-1-aza-bicyclo[2.2.2]oct-3-yl]-amine |
Inchi Key | RGXKBMFDOAFNBV-FQLXRVMXSA-N |
Inchi ID | InChI=1S/C29H33ClN2/c30-26-16-8-7-10-22(26)15-9-19-31-28-25-17-20-32(21-18-25)29(28)27(23-11-3-1-4-12-23)24-13-5-2-6-14-24/h1-8,10-14,16,25,27-29,31H,9,15,17-21H2/t28-,29-/m1/s1 |
PubChem CID | 15037921 |
ChEMBL | CHEMBL346626 |
IUPHAR | N/A |
BindingDB | 50280467 |
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 |
---|---|---|---|---|---|
295900 | Neuromedin-K receptor | P16177 | Tacr3 | Rattus norvegicus (Rat) | 452 |
295898 | Substance-K receptor | P51144 | TACR2 | Mesocricetus auratus (Golden hamster) | 384 |
295897 | Substance-P receptor | P14600 | Tacr1 | Rattus norvegicus (Rat) | 407 |
295899 | Substance-P receptor | P30547 | TACR1 | Cavia porcellus (Guinea pig) | 407 |
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