BDBM36380 1,5-Anhydro-1-deoxy-1-[(3-hydroxypropyl)amino]-1-imino-D-mannitol, 2d::CID11436244

SMILES OCCCNC1=N[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O

InChI Key InChIKey=SIPRBMMTBVEGEB-NGJRWZKOSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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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 = 36380   

TargetBeta-mannosidase(Bacteroides thetaiotaomicron)
The Medical School, Newcastle University

LigandPNGBDBM36380(1,5-Anhydro-1-deoxy-1-[(3-hydroxypropyl)amino]-1-i...)
Affinity DataKi:  2.20E+3nM ΔG°:  -8.02kcal/molepH: 5.6 T: 2°CAssay Description:Putative mannosidase assay using wild-type protein Btman2A. Enzyme inhibition assay.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed