In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-N-[(1S)-1-(benzofuran-2-yl)ethyl]-N-methyl-piperidine-2-carboxamide (2S)-N-[(1S)-1-(benzofuran-2-yl)…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.87 | 7.62 | -40.09 | 2 | 4 | 1 | 50 | 287.383 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 6.46 | -9.19 | 1 | 4 | 0 | 45 | 286.375 | 3 | ↓ |