In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 21 | Yes |
Popular Name: (2S)-2-(1-methylpyrazol-4-yl)-2-[4-(1-piperidyl)-1-piperidyl]ethanamine (2S)-2-(1-methylpyrazol-4-yl)-2-…
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) | 0.43 | 4.69 | -97.99 | 4 | 5 | 2 | 53 | 293.459 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.43 | 4.66 | -33.52 | 3 | 5 | 1 | 52 | 292.451 | 4 | ↓ |