BDBM50201020 CHEMBL3951425::US10138212, Example 2
SMILES: COc1cccc2c(nc(N)nc12)C(=O)NCc1nc(ccc1C)C(C)(C)O
InChI Key: InChIKey=XMPIJYCSTJDUJC-UHFFFAOYSA-N
Data: 2 KI