| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2010 | 27 | 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) | 1.13 | 7.21 | -42.23 | 2 | 6 | 1 | 57 | 391.561 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 5.05 | -11.95 | 1 | 6 | 0 | 56 | 390.553 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.13 | 9.43 | -102.65 | 3 | 6 | 2 | 58 | 392.569 | 6 | ↓ |
