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BDBM200232 AB01003479-01::cid_45913338

SMILES: O=S(=O)(Nc1ccc(cc1)-c1cn2cccnc2n1)c1ccc2OCCOc2c1

InChI Key: InChIKey=KRAFVCMRNKUUIE-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 200232   
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
Cystic fibrosis transmembrane conductance regulator


(Homo sapiens)
BDBM200232
PNG
(AB01003479-01 | cid_45913338)
Show SMILES O=S(=O)(Nc1ccc(cc1)-c1cn2cccnc2n1)c1ccc2OCCOc2c1
Show InChI InChI=1S/C20H16N4O4S/c25-29(26,16-6-7-18-19(12-16)28-11-10-27-18)23-15-4-2-14(3-5-15)17-13-24-9-1-8-21-20(24)22-17/h1-9,12-13,23H,10-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
n/an/an/an/a>4.90E+4n/an/an/an/a



Southern Research Institute

Curated by PubChem BioAssay




PubChem Bioassay (2016)


BindingDB Entry DOI: 10.7270/Q2CZ35ZF
More data for this
Ligand-Target Pair
Cystic fibrosis transmembrane conductance regulator


(Homo sapiens)
BDBM200232
PNG
(AB01003479-01 | cid_45913338)
Show SMILES O=S(=O)(Nc1ccc(cc1)-c1cn2cccnc2n1)c1ccc2OCCOc2c1
Show InChI InChI=1S/C20H16N4O4S/c25-29(26,16-6-7-18-19(12-16)28-11-10-27-18)23-15-4-2-14(3-5-15)17-13-24-9-1-8-21-20(24)22-17/h1-9,12-13,23H,10-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
n/an/a>4.90E+4n/an/an/an/an/an/a



Southern Research Institute

Curated by PubChem BioAssay




PubChem Bioassay (2016)


BindingDB Entry DOI: 10.7270/Q2CZ35ZF
More data for this
Ligand-Target Pair