| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 28 | 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) | 2.08 | 2.06 | -49.58 | 1 | 8 | -1 | 114 | 381.364 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 3.1 | -107.2 | 0 | 8 | -2 | 117 | 380.356 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.63 | 4.76 | -14.54 | 2 | 8 | 0 | 111 | 382.372 | 4 | ↓ |
