Submission Details
Molecule(s):
O=C1C[C@]2(CCCN(C(=O)Nc3cccc4ccccc34)C2)CN1
Design Rationale:
another ROCS hit with a favorable binding energy estimate for query Design implications of P1090 crystal structure (MAT-POS-4223bc15-23)
Other Notes:
maybe toxic according to http://biosig.unimelb.edu.au/pkcsm/prediction