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SMILES: CC(C)NC(=O)Cn1c(nc2ccc(cc2c1=O)C1CC1CN1CCCCC1)-c1cccc(Cl)c1

InChI Key: InChIKey=KCAILXZSCSSEHK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 316325   
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))		BDBM316325
PNG
(2-[2-(3-Chlorophenyl)-4-oxo-6-[2-(1-piperidylmethy...)
Show SMILES CC(C)NC(=O)Cn1c(nc2ccc(cc2c1=O)C1CC1CN1CCCCC1)-c1cccc(Cl)c1
Show InChI InChI=1S/C28H33ClN4O2/c1-18(2)30-26(34)17-33-27(20-7-6-8-22(29)13-20)31-25-10-9-19(14-24(25)28(33)35)23-15-21(23)16-32-11-4-3-5-12-32/h6-10,13-14,18,21,23H,3-5,11-12,15-17H2,1-2H3,(H,30,34)
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
US Patent
 55n/an/an/an/an/an/an/an/a



AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
The binding assay was carried out by the method based on that of Tahara et al. (Tahara A et al., Brit. J. Pharmacol. 125, 1463-1470 (1998)).The incub...

US Patent US9617226 (2017)


BindingDB Entry DOI: 10.7270/Q2639RTS
More data for this
Ligand-Target Pair