| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 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) | 2.60 | 9.23 | -67.71 | 0 | 8 | -1 | 109 | 418.429 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 8.97 | -21.83 | 1 | 8 | 0 | 106 | 419.437 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.05 | 9.25 | -59.17 | 2 | 8 | 1 | 107 | 420.445 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.02 | 9.79 | -49.83 | 1 | 8 | 1 | 104 | 420.445 | 7 | ↓ |
