BDBM50192023 CHEMBL3950254::US10239870, Example 184

SMILES: Cn1c(SCCCN2CC[C@]3(C[C@@H]3c3ccc(cc3)C(F)(F)F)C2)nnc1-c1ccc(nc1)C(N)=O

InChI Key: InChIKey=PQHIRTDXFUZNBI-DVECYGJZSA-N

Data: 8 KI  6 IC50

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