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BDBM95872 1-Nonyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid::1-nonyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid::1-nonyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid::MLS001210998::SMR000504772::cid_3089152

SMILES: CCCCCCCCCC1NC(Cc2c1[nH]c1ccccc21)C(O)=O

InChI Key: InChIKey=CXNATEZOVVRARQ-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 95872   
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
methionyl-tRNA synthetase


(Trypanosoma brucei brucei strain 927/4 GUTat10.1)
BDBM95872
PNG
(1-Nonyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-car...)
Show SMILES CCCCCCCCCC1NC(Cc2c1[nH]c1ccccc21)C(O)=O
Show InChI InChI=1S/C21H30N2O2/c1-2-3-4-5-6-7-8-13-18-20-16(14-19(22-18)21(24)25)15-11-9-10-12-17(15)23-20/h9-12,18-19,22-23H,2-8,13-14H2,1H3,(H,24,25)
PDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.96E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2XP73JZ
More data for this
Ligand-Target Pair