| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 2011 | 21 | 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) | 3.24 | 6.36 | -50.12 | 3 | 4 | 1 | 47 | 311.519 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 8.58 | -203.52 | 5 | 4 | 3 | 49 | 313.535 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 6.8 | -87.3 | 4 | 4 | 2 | 48 | 312.527 | 9 | ↓ |
