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BDBM50077529 CHEMBL61107::Isopropyl-carbamic acid (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenyl ester

SMILES: CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCOC(=O)NC(C)C

InChI Key: InChIKey=HPJPIGIXISXAAT-GKFVBPDJSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50077529   
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
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50077529
PNG
(CHEMBL61107 | Isopropyl-carbamic acid (5Z,8Z,11Z,1...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCOC(=O)NC(C)C
Show InChI InChI=1S/C24H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-24(26)25-23(2)3/h8-9,11-12,14-15,17-18,23H,4-7,10,13,16,19-22H2,1-3H3,(H,25,26)/b9-8-,12-11-,15-14-,18-17-
PDB

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Similars

Article
PubMed
995n/an/an/an/an/an/an/an/a



Organix, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for Ki value against rat whole brain P2 membrane preparation in presence of enzyme inhibitor PMSF.


J Med Chem 42: 1975-81 (1999)


Article DOI: 10.1021/jm980711w
BindingDB Entry DOI: 10.7270/Q2DZ07HM
More data for this
Ligand-Target Pair