BDBM50260600 CHEMBL495235::N-(3,3,-DIPHENYLPROPYL)-N'-[1-R-(2 3,4-BIS-BUTOXYPHENYL)-ETHYL]-PROPYLENEDIAMINE::N-(3,3-diphenylpropyl)-N'-[1-R-(3,4-bis-butoxyphenyl)-ethyl]-propylenediamine

SMILES: CCCCOc1ccc(cc1OCCCC)[C@@H](C)NCCCNCCC(c1ccccc1)c1ccccc1

InChI Key: InChIKey=VSFIKHFVWBEFKU-MUUNZHRXSA-N

Data: 1 Kd

PDB links: 2 PDB IDs match this monomer.

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 = 50260600   

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
Calmodulin (Homo sapiens (Human))	BDBM50260600 (CHEMBL495235 | N-(3,3,-DIPHENYLPROPYL)-N'-[1-R-(2 ...) Show SMILES CCCCOc1ccc(cc1OCCCC)[C@@H](C)NCCCNCCC(c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C34H48N2O2/c1-4-6-25-37-33-20-19-31(27-34(33)38-26-7-5-2)28(3)36-23-14-22-35-24-21-32(29-15-10-8-11-16-29)30-17-12-9-13-18-30/h8-13,15-20,27-28,32,35-36H,4-7,14,21-26H2,1-3H3/t28-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem	MMDB PDB Article PubMed	n/a	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a
Semmelweis University Curated by ChEMBL					Assay Description Binding affinity to calmodulin (unknown origin)				J Med Chem 51: 3081-93 (2008) Article DOI: 10.1021/jm701406e BindingDB Entry DOI: 10.7270/Q2CN73PF
					More data for this Ligand-Target Pair				3D Structure (crystal)