| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2006 | 28 | No |
| 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) | 3.52 | 2.41 | -10.01 | 4 | 7 | 0 | 117 | 394.818 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 1.93 | -42.86 | 2 | 7 | -1 | 116 | 393.81 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.52 | 2.44 | -56.21 | 5 | 7 | 1 | 119 | 395.826 | 3 | ↓ |
