| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 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) | 2.83 | 8.33 | -63.5 | 0 | 7 | -1 | 86 | 437.516 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | 9.18 | -57.32 | 2 | 7 | 1 | 84 | 439.532 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 10.59 | -56 | 1 | 7 | 1 | 81 | 439.532 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 10.67 | -77.01 | 1 | 7 | 0 | 87 | 438.524 | 7 | ↓ |
