| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 22 | Yes |
Popular Name: 2-[(2S)-4-[(2-chloro-6-fluoro-phenyl)methyl]-1-isobutyl-piperazin-2-yl]ethanol 2-[(2S)-4-[(2-chloro-6-fluoro-ph…
| 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) | 3.13 | 6.12 | -32.2 | 2 | 3 | 1 | 28 | 329.867 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 4.17 | -5.77 | 1 | 3 | 0 | 27 | 328.859 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 6.53 | -32.8 | 2 | 3 | 1 | 28 | 329.867 | 6 | ↓ |
