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BDBM85176 BW868C

SMILES: OC(Cn1c(CCCCCCC(O)=O)c(O)n(Cc2ccccc2)c1=O)C1CCCCC1

InChI Key: InChIKey=ZTWOBAGECLBGCD-UHFFFAOYSA-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 = 85176   
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
PTGDR


(MOUSE)
BDBM85176
PNG
(BW868C)
Show SMILES OC(Cn1c(CCCCCCC(O)=O)c(O)n(Cc2ccccc2)c1=O)C1CCCCC1
Show InChI InChI=1S/C25H36N2O5/c28-22(20-13-7-4-8-14-20)18-26-21(15-9-1-2-10-16-23(29)30)24(31)27(25(26)32)17-19-11-5-3-6-12-19/h3,5-6,11-12,20,22,28,31H,1-2,4,7-10,13-18H2,(H,29,30)
PDB
MMDB

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KEGG
PC cid
PC sid
UniChem
Article
PubMed
220n/an/an/an/an/an/an/an/a



Kyoto University

Curated by PDSP Ki Database




Br J Pharmacol 122: 217-24 (1997)


Article DOI: 10.1038/sj.bjp.0701367
BindingDB Entry DOI: 10.7270/Q26M35CT
More data for this
Ligand-Target Pair