| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2010 | 51 | 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) | 7.21 | 20.97 | -230.07 | 4 | 6 | 3 | 41 | 689.025 | 15 | ↓ |
| Hi High (pH 8-9.5) | 7.21 | 17.44 | -47.11 | 2 | 6 | 1 | 35 | 687.009 | 15 | ↓ |
| Mid Mid (pH 6-8) | 7.21 | 18.81 | -118.13 | 3 | 6 | 2 | 40 | 688.017 | 15 | ↓ |
