BDBM152757 [(E)-[2-(pyridin-3-yl)ethylidene]amino]thiourea (3b)
SMILES: NC(=S)N\N=C\Cc1cccnc1
InChI Key: InChIKey=MBXUUEOPBQVIGU-VZUCSPMQSA-N
Data: 1 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Urease [D459Y,K653P] (Canavalia ensiformis (Jack bean)) | BDBM152757 ([(E)-[2-(pyridin-3-yl)ethylidene]amino]thiourea (3...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.41E+3 | n/a | n/a | n/a | n/a | 8.2 | n/a |
Quaid-I-Azam University | Assay Description Urease inhibition activity was determined by indophenol method. In brief, each 140 µL assay reaction contained 40 µL buffer (100 mM urea, 0.01 mM K2H... | Chem Biol Drug Des 85: 225-30 (2015) Article DOI: 10.1111/cbdd.12379 BindingDB Entry DOI: 10.7270/Q2P55M71 | |||||||||||
More data for this Ligand-Target Pair |