| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2008 | 25 | Yes |
Popular Name: 2-[(2S)-1-isobutyl-4-[[4-(trifluoromethoxy)phenyl]methyl]piperazin-2-yl]ethanol 2-[(2S)-1-isobutyl-4-[[4-(triflu…
| 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) | 3.35 | 4.71 | -37.52 | 2 | 4 | 1 | 37 | 361.428 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 2.44 | -5.36 | 1 | 4 | 0 | 36 | 360.42 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 4.83 | -46.37 | 2 | 4 | 1 | 37 | 361.428 | 8 | ↓ |
