| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 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) | 5.40 | 12.06 | -59.18 | 0 | 5 | -1 | 73 | 445.545 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.82 | 12.27 | -11.04 | 0 | 5 | 0 | 67 | 446.553 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.40 | 11.83 | -14.55 | 1 | 5 | 0 | 71 | 446.553 | 4 | ↓ |
