| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2008 | 20 | No |
Popular Name: 2-[[methyl-(1-methyl-4-piperidyl)amino]methyl]-4-nitro-phenol 2-[[methyl-(1-methyl-4-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) | 2.04 | 4.92 | -42.24 | 2 | 6 | 1 | 74 | 280.348 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 5.79 | -26.42 | 1 | 6 | 0 | 77 | 279.34 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 5.68 | -46.98 | 1 | 6 | 0 | 77 | 279.34 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.04 | 7.41 | -116.47 | 3 | 6 | 2 | 75 | 281.356 | 4 | ↓ |
