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BDBM50081962 (S)-3-Fluoromethyl-1,2,3,4-tetrahydro-isoquinoline::CHEMBL137607

SMILES: FC[C@@H]1Cc2ccccc2CN1

InChI Key: InChIKey=SLBKHMRNZGCZIO-JTQLQIEISA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50081962   
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
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50081962
PNG
((S)-3-Fluoromethyl-1,2,3,4-tetrahydro-isoquinoline...)
Show SMILES FC[C@@H]1Cc2ccccc2CN1
Show InChI InChI=1S/C10H12FN/c11-6-10-5-8-3-1-2-4-9(8)7-12-10/h1-4,10,12H,5-7H2/t10-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
9.90E+3n/an/an/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
In vitro inhibition of PNMT (Phenylethanolamine N-Methyltransferase).


J Med Chem 42: 4351-61 (1999)


BindingDB Entry DOI: 10.7270/Q2X0667W
More data for this
Ligand-Target Pair