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SMILES: Cc1nc(SCc2cccc(c2)C(O)=O)nc2CCCCc12

InChI Key: InChIKey=HORIHSOVHACGHN-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 94008   
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
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))		BDBM94008
PNG
(3-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)sul...)
Show SMILES Cc1nc(SCc2cccc(c2)C(O)=O)nc2CCCCc12
Show InChI InChI=1S/C17H18N2O2S/c1-11-14-7-2-3-8-15(14)19-17(18-11)22-10-12-5-4-6-13(9-12)16(20)21/h4-6,9H,2-3,7-8,10H2,1H3,(H,20,21)
PDB
MMDB

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Similars
PCBioAssay
n/an/a 1.05E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2WS8RVZ
More data for this
Ligand-Target Pair