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SMILES: [H][C@]12C[C@@]1([H])c1cc(Cl)ccc1-n1c(nnc21)[C@H]1CC[C@@H](CC1)c1cc(C)on1

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50546418   
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))		BDBM50546418
PNG
(CHEMBL4745630)
Show SMILES [H][C@]12C[C@@]1([H])c1cc(Cl)ccc1-n1c(nnc21)[C@H]1CC[C@@H](CC1)c1cc(C)on1 |r,wU:17.20,wD:20.27,3.4,1.0,(66.07,-56.69,;65.31,-55.37,;64.29,-56.52,;63.81,-55.06,;62.71,-56.13,;63.33,-53.59,;61.84,-53.29,;61.34,-51.84,;59.83,-51.53,;62.36,-50.69,;63.87,-50.99,;64.35,-52.44,;65.85,-52.75,;67.1,-51.85,;68.35,-52.75,;67.88,-54.22,;66.34,-54.22,;67.1,-50.32,;65.77,-49.54,;65.78,-48,;67.12,-47.24,;68.45,-48.01,;68.44,-49.55,;67.12,-45.69,;65.88,-44.78,;66.37,-43.32,;65.46,-42.06,;67.91,-43.32,;68.37,-44.79,)|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 570n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]AVP from human V1a receptor expressed in 1132N1 cells assessed as dissociation constant by radioligand binding assay

Citation and Details

Article DOI: 10.1016/j.bmcl.2020.127417
BindingDB Entry DOI: 10.7270/Q2542S52
More data for this
Ligand-Target Pair