In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 21 | Yes |
Popular Name: (2S)-1-benzyloxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propan-2-ol (2S)-1-benzyloxy-3-[4-(2-hydroxy…
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) | 0.54 | -1.12 | -9.15 | 2 | 5 | 0 | 56 | 294.395 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 1.3 | -43.18 | 3 | 5 | 1 | 57 | 295.403 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 1.28 | -37.85 | 3 | 5 | 1 | 57 | 295.403 | 8 | ↓ |