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BDBM50027069 (2,6-Dimethyl-phenyl)-[1,3]thiazinan-2-ylidene-amine::(5,6-Dihydro-4H-[1,3]thiazin-2-yl)-(2,6-dimethyl-phenyl)-amine::CHEMBL297362::Xylazine

SMILES: Cc1cccc(C)c1N=C1NCCCS1

InChI Key: InChIKey=BPICBUSOMSTKRF-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50027069   
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
ADRA2A


(MOUSE)
BDBM50027069
PNG
((2,6-Dimethyl-phenyl)-[1,3]thiazinan-2-ylidene-ami...)
Show SMILES Cc1cccc(C)c1N=C1NCCCS1 |w:8.8|
Show InChI InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)
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2.40E+3n/an/an/an/an/an/an/an/a



Roche Bioscience

Curated by PDSP Ki Database




Biochem Pharmacol 55: 1035-43 (1998)


Article DOI: 10.1016/s0006-2952(97)00631-x
BindingDB Entry DOI: 10.7270/Q2T72G01
More data for this
Ligand-Target Pair
adrenergic Alpha2


(PIG)
BDBM50027069
PNG
((2,6-Dimethyl-phenyl)-[1,3]thiazinan-2-ylidene-ami...)
Show SMILES Cc1cccc(C)c1N=C1NCCCS1 |w:8.8|
Show InChI InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)
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3.16E+3n/an/an/an/an/an/an/an/a



University of Michigan

Curated by PDSP Ki Database




J Pharmacol Exp Ther 294: 539-47 (2000)


BindingDB Entry DOI: 10.7270/Q2TM78NR
More data for this
Ligand-Target Pair
Alpha-2B adrenergic receptor


(Homo sapiens (Human))
BDBM50027069
PNG
((2,6-Dimethyl-phenyl)-[1,3]thiazinan-2-ylidene-ami...)
Show SMILES Cc1cccc(C)c1N=C1NCCCS1 |w:8.8|
Show InChI InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)
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3.47E+3n/an/an/an/an/an/an/an/a



Roche Bioscience

Curated by PDSP Ki Database




Biochem Pharmacol 55: 1035-43 (1998)


Article DOI: 10.1016/s0006-2952(97)00631-x
BindingDB Entry DOI: 10.7270/Q2T72G01
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM50027069
PNG
((2,6-Dimethyl-phenyl)-[1,3]thiazinan-2-ylidene-ami...)
Show SMILES Cc1cccc(C)c1N=C1NCCCS1 |w:8.8|
Show InChI InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)
UniProtKB/SwissProt

antibodypedia
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PubMed
5.75E+3n/an/an/an/an/an/an/an/a



Roche Bioscience

Curated by PDSP Ki Database




Biochem Pharmacol 55: 1035-43 (1998)


Article DOI: 10.1016/s0006-2952(97)00631-x
BindingDB Entry DOI: 10.7270/Q2T72G01
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM50027069
PNG
((2,6-Dimethyl-phenyl)-[1,3]thiazinan-2-ylidene-ami...)
Show SMILES Cc1cccc(C)c1N=C1NCCCS1 |w:8.8|
Show InChI InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)
PDB

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>1.00E+4n/an/an/an/an/an/an/an/a



Roche Bioscience

Curated by PDSP Ki Database




Biochem Pharmacol 55: 1035-43 (1998)


Article DOI: 10.1016/s0006-2952(97)00631-x
BindingDB Entry DOI: 10.7270/Q2T72G01
More data for this
Ligand-Target Pair