| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 30 | Yes |
| 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) | 3.03 | 3.42 | -18.58 | 3 | 8 | 0 | 108 | 474.311 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.84 | 2.51 | -48.97 | 1 | 8 | -1 | 107 | 473.303 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 4.18 | -57.62 | 2 | 8 | -1 | 111 | 473.303 | 6 | ↓ |
