| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 33 | 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) | 1.50 | 9.4 | -29.23 | 3 | 7 | 0 | 114 | 448.519 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 8.41 | -53.4 | 2 | 7 | -1 | 110 | 447.511 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | 8.26 | -49.6 | 2 | 7 | -1 | 110 | 447.511 | 8 | ↓ |
