BDBM50094068 (2-Chloro-4-ethylamino-phenyl)-(7-chloro-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl)-methanone::CHEMBL343945

SMILES: CCNc1ccc(C(=O)N2CCCCc3cc(Cl)ccc23)c(Cl)c1

InChI Key: InChIKey=VMXIDNOKAXEMAW-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 = 50094068   

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
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50094068 ((2-Chloro-4-ethylamino-phenyl)-(7-chloro-2,3,4,5-t...) Show SMILES CCNc1ccc(C(=O)N2CCCCc3cc(Cl)ccc23)c(Cl)c1 Show InChI InChI=1S/C19H20Cl2N2O/c1-2-22-15-7-8-16(17(21)12-15)19(24)23-10-4-3-5-13-11-14(20)6-9-18(13)23/h6-9,11-12,22H,2-5,10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Otsuka Pharmaceutical Company Curated by ChEMBL					Assay Description Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells				J Med Chem 43: 4388-97 (2000) BindingDB Entry DOI: 10.7270/Q2PG1R04
					More data for this Ligand-Target Pair