| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2010 | 20 | Yes |
Popular Name: 2-[(2R)-1-isobutyl-4-[(5-methyl-2-furyl)methyl]piperazin-2-yl]ethanol 2-[(2R)-1-isobutyl-4-[(5-methyl-…
| 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) | 1.86 | 5.05 | -37.76 | 2 | 4 | 1 | 41 | 281.42 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 2.77 | -5.36 | 1 | 4 | 0 | 40 | 280.412 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.86 | 4.66 | -34.71 | 2 | 4 | 1 | 41 | 281.42 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.86 | 6.93 | -115.14 | 3 | 4 | 2 | 42 | 282.428 | 6 | ↓ |
