In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 16 | Yes |
Popular Name: (2S)-2-[(4-ethyl-4-methyl-1-piperidyl)methyl]morpholine (2S)-2-[(4-ethyl-4-methyl-1-pipe…
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) | 1.51 | 4.14 | -31.48 | 2 | 3 | 1 | 26 | 227.372 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 1.88 | -2.66 | 1 | 3 | 0 | 24 | 226.364 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 3.25 | -39.88 | 2 | 3 | 1 | 29 | 227.372 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.51 | 5.51 | -99.64 | 3 | 3 | 2 | 30 | 228.38 | 3 | ↓ |