BDBM50345071 (S)-2-(4-methoxy-2,3,6-trimethylphenylsulfonamido)-N-(3-(4-methylpiperazin-1-yl)propyl)-3-phenylpropanamide::CHEMBL1779224

SMILES: COc1cc(C)c(c(C)c1C)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCN1CCN(C)CC1

InChI Key: InChIKey=OQXDJAIBJBOXEG-DEOSSOPVSA-N

Data: 1 KI

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 = 50345071   

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 V1b receptor (Homo sapiens (Human))	BDBM50345071 ((S)-2-(4-methoxy-2,3,6-trimethylphenylsulfonamido)...) Show SMILES COc1cc(C)c(c(C)c1C)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCN1CCN(C)CC1 |r| Show InChI InChI=1S/C27H40N4O4S/c1-20-18-25(35-5)21(2)22(3)26(20)36(33,34)29-24(19-23-10-7-6-8-11-23)27(32)28-12-9-13-31-16-14-30(4)15-17-31/h6-8,10-11,18,24,29H,9,12-17,19H2,1-5H3,(H,28,32)/t24-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
MSD Curated by ChEMBL					Assay Description Displacement of [3H]-AVP from human vasopressin V1B receptor expressed in CHO cells				Bioorg Med Chem Lett 21: 3603-7 (2011) Article DOI: 10.1016/j.bmcl.2011.04.104 BindingDB Entry DOI: 10.7270/Q2833SCQ
					More data for this Ligand-Target Pair