| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 14th, 2010 | 22 | Yes |
Popular Name: 3-fluoro-4-[(2R,3S)-3-(2-fluoro-4-hydroxy-phenyl)piperazin-2-yl]phenol 3-fluoro-4-[(2R,3S)-3-(2-fluoro-…
| 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) | 2.13 | 1.43 | -130.54 | 6 | 4 | 2 | 74 | 308.328 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.13 | -1.16 | -8.4 | 4 | 4 | 0 | 65 | 306.312 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.13 | 0.16 | -46.33 | 5 | 4 | 1 | 69 | 307.32 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.13 | 2.2 | -137.17 | 5 | 4 | 1 | 76 | 307.32 | 2 | ↓ |
