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BDBM50061194 (R)-8,8-Dimethyl-11-methylene-5-pentyl-3,4,8a,9,10,11,12,12a-octahydro-2H,8H-1,7-dioxa-benzo[c]phenanthrene::CHEMBL114078

SMILES: CCCCCc1cc2OC(C)(C)[C@@H]3CCC(=C)CC3c2c2OCCCc12

InChI Key: InChIKey=HTVMMXJRLZDFOW-GFOWMXPYSA-N

Data: 2 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 2 hits for monomerid = 50061194   
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 2


(Rattus norvegicus (Rat))
BDBM50061194
PNG
((R)-8,8-Dimethyl-11-methylene-5-pentyl-3,4,8a,9,10...)
Show SMILES CCCCCc1cc2OC(C)(C)[C@@H]3CCC(=C)CC3c2c2OCCCc12
Show InChI InChI=1S/C24H34O2/c1-5-6-7-9-17-15-21-22(23-18(17)10-8-13-25-23)19-14-16(2)11-12-20(19)24(3,4)26-21/h15,19-20H,2,5-14H2,1,3-4H3/t19?,20-/m1/s1
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Kennesaw State University

Curated by ChEMBL


Assay Description
Binding affinity of the compound for Cannabinoid receptor 2


J Med Chem 40: 3312-8 (1997)


Article DOI: 10.1021/jm970136g
BindingDB Entry DOI: 10.7270/Q2V123WC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50061194
PNG
((R)-8,8-Dimethyl-11-methylene-5-pentyl-3,4,8a,9,10...)
Show SMILES CCCCCc1cc2OC(C)(C)[C@@H]3CCC(=C)CC3c2c2OCCCc12
Show InChI InChI=1S/C24H34O2/c1-5-6-7-9-17-15-21-22(23-18(17)10-8-13-25-23)19-14-16(2)11-12-20(19)24(3,4)26-21/h15,19-20H,2,5-14H2,1,3-4H3/t19?,20-/m1/s1
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
884n/an/an/an/an/an/an/an/a



Kennesaw State University

Curated by ChEMBL


Assay Description
Binding affinity of the compound for cannabinoid receptor 1.


J Med Chem 40: 3312-8 (1997)


Article DOI: 10.1021/jm970136g
BindingDB Entry DOI: 10.7270/Q2V123WC
More data for this
Ligand-Target Pair