| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 23 | No |
Popular Name: 1-methyl-4-[1-[(4-nitrophenyl)methyl]-4-piperidyl]piperazine 1-methyl-4-[1-[(4-nitrophenyl)me…
| 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) | 2.01 | 9.48 | -103.08 | 2 | 6 | 2 | 58 | 320.437 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.01 | -55.06 | 1 | 6 | 1 | 57 | 319.429 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 9.27 | -125.73 | 2 | 6 | 2 | 58 | 320.437 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.70 | 8.06 | -49.07 | 2 | 6 | 1 | 69 | 348.467 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.70 | 5.73 | -17.55 | 1 | 6 | 0 | 68 | 347.459 | 4 | ↓ |
