| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 23rd, 2009 | 17 | Yes |
Popular Name: (2S)-2-[4-(2-hydroxyethyl)piperazin-1-yl]cycloheptan-1-one (2S)-2-[4-(2-hydroxyethyl)pipera…
| 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) | 0.68 | 2.58 | -32.44 | 2 | 4 | 1 | 45 | 241.355 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.68 | 0.41 | -7.82 | 1 | 4 | 0 | 44 | 240.347 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 2.57 | -34.75 | 2 | 4 | 1 | 45 | 241.355 | 3 | ↓ |
