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Property space:
scatter chart | bubble chart | boxplot | histogram
Structure space:
Venn diagram | Library similarity | Clustering | PMI plot | Dimensionality reduction | Similarity network | SAS map | Fragment analysis | Scaffold tree
Other tools:
Descriptor Calculator | Structure Standardiser | Sim/Sub-structure Search | Extract molecules from text | Name to Structure

IChemSpace

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Step 1. Upload files   

NOTES:
(1) supported format: smiles or tsv.     * download or load examples
the first line should be the header line, where 'SMILES' is used as the structure descriptor and tab is used as the separator;
SMILEStabMolecular weighttabpIC50
CCCCCCtab666.66tab6.66
(2) the number of compounds is limited to [2, 5000] (or no restriction by using the source code pychemspace);
(3) It is highly recommended to standardize all datasets here before submiting files.
    Standarderlise uploaded files;   set molcular weight range as     -
(4) Here are some common data sets that can be used directly for analysis.
optional libraries   details

(5) Pressing CTRL to select multiple files;