| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 13th, 2006 | 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) | 7.66 | 14.14 | -11.56 | 1 | 5 | 0 | 67 | 453.567 | 3 | ↓ |
| Ref Reference (pH 7) | 7.66 | 12.44 | -11.19 | 1 | 5 | 0 | 67 | 453.567 | 3 | ↓ |
| Mid Mid (pH 6-8) | 8.11 | 10.47 | -51.55 | 0 | 5 | -1 | 70 | 452.559 | 3 | ↓ |
| Mid Mid (pH 6-8) | 8.11 | 12.17 | -51.41 | 0 | 5 | -1 | 70 | 452.559 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 7.66 | 12.53 | -24.77 | 2 | 5 | 1 | 69 | 454.575 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 7.66 | 14.43 | -23 | 2 | 5 | 1 | 69 | 454.575 | 3 | ↓ |
