| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 32 | 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) | 3.00 | 9.08 | -55.04 | 0 | 9 | -1 | 125 | 439.444 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 0.78 | -23.17 | 0 | 9 | 0 | 118 | 440.452 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.45 | 8.02 | -29.04 | 1 | 9 | 0 | 122 | 440.452 | 8 | ↓ |
