| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 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) | 8.20 | 22.9 | -220.24 | 4 | 5 | 3 | 32 | 687.053 | 15 | ↓ |
| Hi High (pH 8-9.5) | 8.20 | 19.32 | -42.35 | 2 | 5 | 1 | 26 | 685.037 | 15 | ↓ |
| Mid Mid (pH 6-8) | 8.20 | 20.67 | -111.62 | 3 | 5 | 2 | 31 | 686.045 | 15 | ↓ |
