BDBM50192447 CHEMBL3975989::US10239870, Example 53

SMILES: Cc1ncoc1-c1nnc(SCCCN2CC[C@@]3(C[C@@H]3c3ccccc3C(F)(F)F)C2)n1C

InChI Key: InChIKey=RRSUWPYFZSEELD-UHFFFAOYSA-N

Data: 4 KI  1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match