| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2009 | 32 | 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) | 0.54 | 8.6 | -47.03 | 3 | 8 | 0 | 124 | 438.48 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.54 | 6.4 | -55.78 | 2 | 8 | -1 | 119 | 437.472 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 7.62 | -56.86 | 2 | 8 | -1 | 119 | 437.472 | 7 | ↓ |
