| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2006 | 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) | 5.29 | 12.27 | -40.5 | 1 | 2 | 1 | 17 | 329.533 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 10.11 | -5.68 | 0 | 2 | 0 | 16 | 328.525 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.29 | 12.65 | -76.72 | 2 | 2 | 2 | 19 | 330.541 | 6 | ↓ |
