| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 23 | 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) | 0.60 | 5.78 | -37.67 | 1 | 6 | 1 | 52 | 321.445 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.60 | 5.59 | -13.7 | 0 | 6 | 0 | 51 | 320.437 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.60 | 8 | -118.13 | 2 | 6 | 2 | 53 | 322.453 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.60 | 7.83 | -49.93 | 1 | 6 | 1 | 52 | 321.445 | 3 | ↓ |
