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BDBM78589 3-(ethylthio)-1-(1-piperidinyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile::3-(ethylthio)-1-piperidino-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile::3-Ethylsulfanyl-1-piperidin-1-yl-5,6,7,8-tetrahydro-isoquinoline-4-carbonitrile::3-ethylsulfanyl-1-piperidin-1-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile::MLS000552172::SMR000145886::cid_708947

SMILES: CCSc1nc(N2CCCCC2)c2CCCCc2c1C#N

InChI Key: InChIKey=XTLMBDNMLCKCLZ-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 78589   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ubiquitin-conjugating enzyme E2 N


(Human)
BDBM78589
PNG
(MLS000552172 | 3-(ethylthio)-1-(1-piperidinyl)-5,6...)
GoogleScholar
UniChem
n/an/a>2.00E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair