| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2010 | 17 | No |
Popular Name: 1-[2-(chloromethyl)-4-pyridyl]-4-isopropyl-piperazine 1-[2-(chloromethyl)-4-pyridyl]-4…
| 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) | 2.35 | 7.75 | -84.8 | 2 | 3 | 2 | 22 | 255.793 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 4.94 | -4.79 | 0 | 3 | 0 | 19 | 253.777 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 5.38 | -30 | 1 | 3 | 1 | 21 | 254.785 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 7.31 | -39.58 | 1 | 3 | 1 | 21 | 254.785 | 3 | ↓ |
