| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 17 | 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) | 2.22 | 4.72 | -45.34 | 3 | 3 | 1 | 50 | 294.172 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 4.31 | -5.69 | 2 | 3 | 0 | 48 | 293.164 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.22 | 5.17 | -97.33 | 4 | 3 | 2 | 51 | 295.18 | 4 | ↓ |
