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BDBM82563 CAS_182596::NSC_182596::S 15931

SMILES: C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12

InChI Key: InChIKey=OARKPUCUFAIZCW-UHFFFAOYSA-N

Data: 6 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 82563   
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
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM82563
PNG
(CAS_182596 | NSC_182596 | S 15931)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12
Show InChI InChI=1S/C23H28N2O2/c1-2-5-20-18(4-1)8-9-19(20)10-11-24-12-14-25(15-13-24)21-6-3-7-22-23(21)27-17-16-26-22/h1-7,19H,8-17H2
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1.51n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 337-52 (1994)


Article DOI: 10.1016/j.bioorg.2015.06.004
BindingDB Entry DOI: 10.7270/Q2H130HG
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(RAT)
BDBM82563
PNG
(CAS_182596 | NSC_182596 | S 15931)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12
Show InChI InChI=1S/C23H28N2O2/c1-2-5-20-18(4-1)8-9-19(20)10-11-24-12-14-25(15-13-24)21-6-3-7-22-23(21)27-17-16-26-22/h1-7,19H,8-17H2
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53.7n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 337-52 (1994)


Article DOI: 10.1016/j.bioorg.2015.06.004
BindingDB Entry DOI: 10.7270/Q2H130HG
More data for this
Ligand-Target Pair
HTR2C


(PIG)
BDBM82563
PNG
(CAS_182596 | NSC_182596 | S 15931)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12
Show InChI InChI=1S/C23H28N2O2/c1-2-5-20-18(4-1)8-9-19(20)10-11-24-12-14-25(15-13-24)21-6-3-7-22-23(21)27-17-16-26-22/h1-7,19H,8-17H2
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115n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 337-52 (1994)


Article DOI: 10.1016/j.bioorg.2015.06.004
BindingDB Entry DOI: 10.7270/Q2H130HG
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM82563
PNG
(CAS_182596 | NSC_182596 | S 15931)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12
Show InChI InChI=1S/C23H28N2O2/c1-2-5-20-18(4-1)8-9-19(20)10-11-24-12-14-25(15-13-24)21-6-3-7-22-23(21)27-17-16-26-22/h1-7,19H,8-17H2
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PubMed
191n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 337-52 (1994)


Article DOI: 10.1016/j.bioorg.2015.06.004
BindingDB Entry DOI: 10.7270/Q2H130HG
More data for this
Ligand-Target Pair
Serotonin 1B/1D receptor


(Rattus norvegicus (Rat))
BDBM82563
PNG
(CAS_182596 | NSC_182596 | S 15931)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12
Show InChI InChI=1S/C23H28N2O2/c1-2-5-20-18(4-1)8-9-19(20)10-11-24-12-14-25(15-13-24)21-6-3-7-22-23(21)27-17-16-26-22/h1-7,19H,8-17H2
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PubMed
417n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 337-52 (1994)


Article DOI: 10.1016/j.bioorg.2015.06.004
BindingDB Entry DOI: 10.7270/Q2H130HG
More data for this
Ligand-Target Pair
Serotonin 1B/1D receptor


(Rattus norvegicus (Rat))
BDBM82563
PNG
(CAS_182596 | NSC_182596 | S 15931)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1CCc2ccccc12
Show InChI InChI=1S/C23H28N2O2/c1-2-5-20-18(4-1)8-9-19(20)10-11-24-12-14-25(15-13-24)21-6-3-7-22-23(21)27-17-16-26-22/h1-7,19H,8-17H2
PDB

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PC cid
PC sid
UniChem

Similars

PubMed
417n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Binding affinity at 5-hydroxytryptamine 1B receptor


J Med Chem 38: 4044-55 (1995)


BindingDB Entry DOI: 10.7270/Q2KP83C0
More data for this
Ligand-Target Pair