| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 24 | No |
| 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) | 3.34 | 8.23 | -12.81 | 0 | 4 | 0 | 13 | 406.712 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 10.61 | -48.23 | 1 | 4 | 1 | 14 | 407.72 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.34 | 12.76 | -91.54 | 2 | 4 | 2 | 15 | 408.728 | 7 | ↓ |
