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BDBM50202913 (S)-N-(2-chlorobenzyl)-4-methyl-2-((3S,4R)-2-oxo-3-((S)-2-oxo-4-phenyloxazolidin-3-yl)-4-((E)-styryl)azetidin-1-yl)pentanamide::CHEMBL389091

SMILES: CC(C)C[C@H](N1[C@H](\C=C\c2ccccc2)[C@H](N2[C@H](COC2=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1Cl

InChI Key: InChIKey=OGUKYLBJMOYQFU-KRILHBCDSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50202913   
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))
BDBM50202913
PNG
((S)-N-(2-chlorobenzyl)-4-methyl-2-((3S,4R)-2-oxo-3...)
Show SMILES CC(C)C[C@H](N1[C@H](\C=C\c2ccccc2)[C@H](N2[C@H](COC2=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1Cl
Show InChI InChI=1S/C33H34ClN3O4/c1-22(2)19-28(31(38)35-20-25-15-9-10-16-26(25)34)36-27(18-17-23-11-5-3-6-12-23)30(32(36)39)37-29(21-41-33(37)40)24-13-7-4-8-14-24/h3-18,22,27-30H,19-21H2,1-2H3,(H,35,38)/b18-17+/t27-,28+,29-,30+/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Lehigh University

Curated by ChEMBL


Assay Description
Binding affinity for human cloned vasopressin V1a receptor expressed in CHO cells


Bioorg Med Chem 15: 2054-80 (2007)


Article DOI: 10.1016/j.bmc.2006.12.031
BindingDB Entry DOI: 10.7270/Q2GX4B6M
More data for this
Ligand-Target Pair