BDBM50404036 CHEMBL48885

SMILES: NCCNC(NCCCOc1cccc(CN2CCCCC2)c1)=NC#N

InChI Key: InChIKey=HDNYARDFRMPQKD-UHFFFAOYSA-N

Data: 1 Kd

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 = 50404036   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Histamine H2 receptor (Cavia porcellus (domestic guinea pig))	BDBM50404036 (CHEMBL48885) Show SMILES NCCNC(NCCCOc1cccc(CN2CCCCC2)c1)=NC#N |w:23.25| Show InChI InChI=1S/C19H30N6O/c20-8-10-23-19(24-16-21)22-9-5-13-26-18-7-4-6-17(14-18)15-25-11-2-1-3-12-25/h4,6-7,14H,1-3,5,8-13,15,20H2,(H2,22,23,24)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Histamine H2 receptor antagonistic activity on the isolated spontaneously beating guinea pig right atrium				Bioorg Med Chem Lett 13: 1717-20 (2003) BindingDB Entry DOI: 10.7270/Q2XW4M0X
					More data for this Ligand-Target Pair