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BDBM50077461 CHEMBL3416862

SMILES: OC1(Cc2ccccc2)CCN(CC1)C(=O)c1cccc2ccccc12

InChI Key: InChIKey=ATXCUHQQKQDIBW-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50077461   
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
Vasopressin V1a receptor


(Homo sapiens (Human))		BDBM50077461
PNG
(CHEMBL3416862)
Show SMILES OC1(Cc2ccccc2)CCN(CC1)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C23H23NO2/c25-22(21-12-6-10-19-9-4-5-11-20(19)21)24-15-13-23(26,14-16-24)17-18-7-2-1-3-8-18/h1-12,26H,13-17H2
PDB

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UniProtKB/TrEMBL

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Similars
Article
PubMed
 6.62E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-vasopressin from human vasopressin 1a receptor expressed in HEK293 cell membranes after 1 hr by scintillation proximity assay

J Med Chem 58: 2275-89 (2015)


Article DOI: 10.1021/jm501745f
BindingDB Entry DOI: 10.7270/Q2JW8GK0
More data for this
Ligand-Target Pair