| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | No |
Popular Name: (2S)-2-chloro-1-[4-(2-pyridylmethyl)piperazin-1-yl]propan-1-one (2S)-2-chloro-1-[4-(2-pyridylmet…
| 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) | 0.75 | 4.28 | -9.43 | 0 | 4 | 0 | 36 | 267.76 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.75 | 5.01 | -37.41 | 1 | 4 | 1 | 38 | 268.768 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.75 | 6.49 | -43.93 | 1 | 4 | 1 | 38 | 268.768 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.75 | 7.26 | -115.55 | 2 | 4 | 2 | 39 | 269.776 | 3 | ↓ |
