In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 17 | Yes |
Popular Name: (2R)-2-[(2S)-2-ethyl-1-piperidyl]-2-(1-methylpyrazol-4-yl)ethanamine (2R)-2-[(2S)-2-ethyl-1-piperidyl…
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) | 0.88 | 3.07 | -49.6 | 3 | 4 | 1 | 49 | 237.371 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.88 | 5.05 | -119.79 | 4 | 4 | 2 | 50 | 238.379 | 4 | ↓ |