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BDBM50212373 (1R,2S,9aR)-2-ethyl-1-phenyl-octahydro-1H-quinolizine hydrochloride hydrochloride::CHEMBL553714

SMILES: CC[C@H]1CCN2CCCC[C@@H]2[C@H]1c1ccccc1

InChI Key: InChIKey=DMPGKIZUXVPBRQ-USXIJHARSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50212373   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50212373
PNG
((1R,2S,9aR)-2-ethyl-1-phenyl-octahydro-1H-quinoliz...)
Show SMILES CC[C@H]1CCN2CCCC[C@@H]2[C@H]1c1ccccc1
Show InChI InChI=1S/C17H25N/c1-2-14-11-13-18-12-7-6-10-16(18)17(14)15-8-4-3-5-9-15/h3-5,8-9,14,16-17H,2,6-7,10-13H2,1H3/t14-,16+,17+/m0/s1
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UniProtKB/SwissProt

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CHEMBL
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PC sid
UniChem

Similars

Article
PubMed
5.5n/an/an/an/an/an/an/an/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Displacement of [3H]WIN-35428 from DAT in Sprague-Dawley rat striatum


J Med Chem 50: 2718-31 (2007)


Article DOI: 10.1021/jm061354p
BindingDB Entry DOI: 10.7270/Q2Q81DXB
More data for this
Ligand-Target Pair
Norepinephrine Monoamine transporters


(Rattus norvegicus)
BDBM50212373
PNG
((1R,2S,9aR)-2-ethyl-1-phenyl-octahydro-1H-quinoliz...)
Show SMILES CC[C@H]1CCN2CCCC[C@@H]2[C@H]1c1ccccc1
Show InChI InChI=1S/C17H25N/c1-2-14-11-13-18-12-7-6-10-16(18)17(14)15-8-4-3-5-9-15/h3-5,8-9,14,16-17H,2,6-7,10-13H2,1H3/t14-,16+,17+/m0/s1
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UniProtKB/TrEMBL

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PC sid
UniChem

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Article
PubMed
61n/an/an/an/an/an/an/an/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from NET in Sprague-Dawley rat cortical tissue


J Med Chem 50: 2718-31 (2007)


Article DOI: 10.1021/jm061354p
BindingDB Entry DOI: 10.7270/Q2Q81DXB
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50212373
PNG
((1R,2S,9aR)-2-ethyl-1-phenyl-octahydro-1H-quinoliz...)
Show SMILES CC[C@H]1CCN2CCCC[C@@H]2[C@H]1c1ccccc1
Show InChI InChI=1S/C17H25N/c1-2-14-11-13-18-12-7-6-10-16(18)17(14)15-8-4-3-5-9-15/h3-5,8-9,14,16-17H,2,6-7,10-13H2,1H3/t14-,16+,17+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.55E+3n/an/an/an/an/an/an/an/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from 5HTT in Sprague-Dawley rat cerebrum


J Med Chem 50: 2718-31 (2007)


Article DOI: 10.1021/jm061354p
BindingDB Entry DOI: 10.7270/Q2Q81DXB
More data for this
Ligand-Target Pair