BDBM694832 US20240294550, Example 34

SMILES C[C@@H]1CN(CCN1c1cc(nc2n(ncc12)-c1cc[nH]n1)N1CC2CCC(C1)O2)C(C)=O

InChI Key InChIKey=MAPPNNYXCDEPDG-UHFFFAOYSA-N

Data  1 IC50

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