| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 33 | 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) | 7.55 | 10.24 | -52.43 | 1 | 7 | -1 | 115 | 464.567 | 7 | ↓ |
| Mid Mid (pH 6-8) | 7.09 | 12.87 | -34.89 | 1 | 7 | -1 | 115 | 464.567 | 7 | ↓ |
| Mid Mid (pH 6-8) | 7.09 | 12.08 | -19.52 | 2 | 7 | 0 | 112 | 465.575 | 7 | ↓ |
