| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2009 | 16 | Yes |
Popular Name: (2R)-1-[(2S,5R)-4-[(2R)-2-hydroxypropyl]-2,5-dimethyl-piperazin-1-yl]propan-2-ol (2R)-1-[(2S,5R)-4-[(2R)-2-hydrox…
| 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) | 0.36 | -2.18 | -4.2 | 2 | 4 | 0 | 47 | 230.352 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | -0.33 | -29.02 | 3 | 4 | 1 | 48 | 231.36 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | -0.02 | -31.06 | 3 | 4 | 1 | 48 | 231.36 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.36 | 2.21 | -102.15 | 4 | 4 | 2 | 49 | 232.368 | 4 | ↓ |
