| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 31 | 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) | 4.11 | 9.82 | -56.15 | 0 | 6 | -1 | 79 | 442.919 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.52 | 0.15 | -11.53 | 0 | 6 | 0 | 72 | 443.927 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | 10.02 | -12.81 | 1 | 6 | 0 | 76 | 443.927 | 8 | ↓ |
