BDBM287768 US10085986, Example 14

SMILES CC(Sc1ncc(O)c(=O)[nH]1)c1ccccc1

InChI Key InChIKey=WSESDAQWBWEVGB-UHFFFAOYSA-N

Data  1 IC50

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