| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 32 | 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) | 0.99 | 2.49 | -70.18 | 1 | 9 | -1 | 115 | 438.46 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 3.51 | -137.39 | 0 | 9 | -2 | 118 | 437.452 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 4.84 | -79.93 | 2 | 9 | 0 | 116 | 439.468 | 7 | ↓ |
