| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 29 | 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) | -1.86 | 5.78 | -51.15 | 3 | 8 | 0 | 127 | 395.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.86 | 3.38 | -54.52 | 2 | 8 | -1 | 123 | 394.407 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.86 | 4.45 | -66.07 | 2 | 8 | -1 | 123 | 394.407 | 5 | ↓ |
