BindingDB logo
myBDB logout

null

SMILES: CCCCOc1ccc(OCCCC)c2NC3(Nc12)C(=O)N(C(C)=O)c1ccccc31

InChI Key: InChIKey=UGZHOKRYRPLXOZ-UHFFFAOYSA-N

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 = 83483   
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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83483
PNG
(1'-acetyl-4,7-dibutoxy-1,3-dihydrospiro[benzim...)
Show SMILES CCCCOc1ccc(OCCCC)c2NC3(Nc12)C(=O)N(C(C)=O)c1ccccc31
Show InChI InChI=1S/C24H29N3O4/c1-4-6-14-30-19-12-13-20(31-15-7-5-2)22-21(19)25-24(26-22)17-10-8-9-11-18(17)27(16(3)28)23(24)29/h8-13,25-26H,4-7,14-15H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83483
PNG
(1'-acetyl-4,7-dibutoxy-1,3-dihydrospiro[benzim...)
Show SMILES CCCCOc1ccc(OCCCC)c2NC3(Nc12)C(=O)N(C(C)=O)c1ccccc31
Show InChI InChI=1S/C24H29N3O4/c1-4-6-14-30-19-12-13-20(31-15-7-5-2)22-21(19)25-24(26-22)17-10-8-9-11-18(17)27(16(3)28)23(24)29/h8-13,25-26H,4-7,14-15H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2Z31X54
More data for this
Ligand-Target Pair