| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 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) | 3.10 | 9.35 | -51.81 | 0 | 7 | -1 | 95 | 438.46 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 0.86 | -12 | 0 | 7 | 0 | 89 | 439.468 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.10 | 8.54 | -15.84 | 1 | 7 | 0 | 93 | 439.468 | 6 | ↓ |
