| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2005 | 25 | 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) | 3.88 | 3.29 | -11.29 | 3 | 6 | 0 | 95 | 356.403 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | 3.24 | -49.19 | 2 | 6 | -1 | 94 | 355.395 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.39 | 3.67 | -19.43 | 3 | 6 | 0 | 92 | 356.403 | 5 | ↓ |
