| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 34 | 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) | 3.18 | 9.28 | -63.39 | 0 | 7 | -1 | 76 | 462.57 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 11.53 | -74.81 | 1 | 7 | 0 | 77 | 463.578 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.18 | 10.69 | -50.02 | 2 | 7 | 1 | 75 | 464.586 | 7 | ↓ |
