| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 2nd, 2010 | 18 | 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) | 2.80 | 7.24 | -88.45 | 3 | 3 | 2 | 34 | 308.223 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 5.38 | -4.06 | 1 | 3 | 0 | 28 | 306.207 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 5.76 | -28.43 | 2 | 3 | 1 | 29 | 307.215 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 6.86 | -46.86 | 2 | 3 | 1 | 33 | 307.215 | 1 | ↓ |
