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SMILES: Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)c1[nH]c2c4CCCCc4ccc2c1C[C@@]35O

InChI Key: InChIKey=LZWGQEGAJVXMHU-UJLGHMMASA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50261791   
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
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50261791
PNG
((5R,9R,13S,14S)-17-Cyclopropylmethyl-6,7-didehydro...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)c1[nH]c2c4CCCCc4ccc2c1C[C@@]35O |r|
Show InChI InChI=1S/C30H32N2O3/c33-22-10-8-18-13-23-30(34)14-21-20-9-7-17-3-1-2-4-19(17)25(20)31-26(21)28-29(30,24(18)27(22)35-28)11-12-32(23)15-16-5-6-16/h7-10,16,23,28,31,33-34H,1-6,11-15H2/t23-,28+,29+,30-/m1/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
52n/an/an/an/an/an/an/an/a



Toray Industries, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from kappa opioid receptor in Hartley guinea pig brain membrane


J Med Chem 51: 4404-11 (2008)


Article DOI: 10.1021/jm701440h
BindingDB Entry DOI: 10.7270/Q2PG1SN2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50261791
PNG
((5R,9R,13S,14S)-17-Cyclopropylmethyl-6,7-didehydro...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)c1[nH]c2c4CCCCc4ccc2c1C[C@@]35O |r|
Show InChI InChI=1S/C30H32N2O3/c33-22-10-8-18-13-23-30(34)14-21-20-9-7-17-3-1-2-4-19(17)25(20)31-26(21)28-29(30,24(18)27(22)35-28)11-12-32(23)15-16-5-6-16/h7-10,16,23,28,31,33-34H,1-6,11-15H2/t23-,28+,29+,30-/m1/s1
UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
200n/an/an/an/an/an/an/an/a



Toray Industries, Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Hartley guinea pig brain membrane


J Med Chem 51: 4404-11 (2008)


Article DOI: 10.1021/jm701440h
BindingDB Entry DOI: 10.7270/Q2PG1SN2
More data for this
Ligand-Target Pair