| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 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) | 2.14 | 6.29 | -34.16 | 1 | 3 | 1 | 21 | 248.394 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 4.44 | -3.1 | 0 | 3 | 0 | 19 | 247.386 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 6.82 | -39.13 | 1 | 3 | 1 | 21 | 248.394 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.14 | 6.73 | -80.9 | 2 | 3 | 2 | 22 | 249.402 | 5 | ↓ |
