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SMILES: CSC(NCCCc1cnc[nH]1)=[NH+]CCSCc1[nH]cnc1C

InChI Key: InChIKey=JOLSTMXDJHETPP-UHFFFAOYSA-O

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50405162   
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
Histamine H2 receptor


(Cavia porcellus (domestic guinea pig))		BDBM50405162
PNG
(CHEMBL1626961)
Show SMILES CSC(NCCCc1cnc[nH]1)=[NH+]CCSCc1[nH]cnc1C |w:12.13|
Show InChI InChI=1S/C15H24N6S2/c1-12-14(21-11-19-12)9-23-7-6-18-15(22-2)17-5-3-4-13-8-16-10-20-13/h8,10-11H,3-7,9H2,1-2H3,(H,16,20)(H,17,18)(H,19,21)/p+1
UniProtKB/SwissProt

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PC cid
PC sid
UniChem
PubMed
n/an/an/a 1.78E+4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonistic activity against H2 receptor in guinea pig was evaluated

J Med Chem 28: 1414-22 (1985)


BindingDB Entry DOI: 10.7270/Q2P27096
More data for this
Ligand-Target Pair