BDBM84467 Benzylation of mannostatin A, 1g

SMILES CS[C@H]1[C@H](O)[C@H](O)[C@H](O)[C@@H]1NCc1ccc(cc1)C(=O)OCC=C

InChI Key InChIKey=HSKROQPVNRBUPW-UYJHQMFVSA-N

Data  2 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 2 hits for monomerid = 84467   

TargetAlpha-mannosidase 2(Homo sapiens (Human))
University Of Georgia

LigandPNGBDBM84467(Benzylation of mannostatin A, 1g)
Affinity DataKi:  140nM ΔG°:  -9.72kcal/molepH: 5.6 T: 2°CMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAlpha-mannosidase 2(Homo sapiens (Human))
University Of Georgia

LigandPNGBDBM84467(Benzylation of mannostatin A, 1g)
Affinity DataKi:  3.22E+3nM ΔG°:  -7.79kcal/molepH: 5.6 T: 2°CMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed