| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 18 | Yes |
| 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) | 2.39 | 3.75 | -44.62 | 3 | 3 | 1 | 40 | 251.394 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 4.54 | -64.72 | 2 | 3 | 0 | 43 | 250.386 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 4.4 | -34.93 | 3 | 3 | 1 | 37 | 251.394 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.39 | 5.81 | -116.88 | 4 | 3 | 2 | 41 | 252.402 | 7 | ↓ |
