| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 13th, 2009 | 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) | -5.27 | 7.23 | -232.56 | 2 | 13 | -3 | 209 | 444.417 | 15 | ↓ |
| Hi High (pH 8-9.5) | -5.27 | 5.04 | -193.77 | 2 | 13 | -3 | 213 | 444.417 | 15 | ↓ |
| Lo Low (pH 4.5-6) | -5.27 | 7 | -150.12 | 3 | 13 | -2 | 214 | 445.425 | 15 | ↓ |
| Lo Low (pH 4.5-6) | -5.27 | 8.84 | -191.76 | 2 | 13 | -3 | 213 | 444.417 | 15 | ↓ |
