In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 17 | Yes |
Popular Name: (1S)-N-[(1-ethyl-4-piperidyl)methyl]-1-(1H-pyrazol-3-yl)ethanamine (1S)-N-[(1-ethyl-4-piperidyl)met…
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) | 1.86 | 6.02 | -91.27 | 4 | 4 | 2 | 50 | 238.379 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 4.97 | -33.49 | 3 | 4 | 1 | 45 | 237.371 | 5 | ↓ |