| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2008 | 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) | 2.76 | 9.19 | -40.32 | 0 | 8 | -1 | 108 | 449.512 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 7.8 | -27.04 | 1 | 8 | 0 | 106 | 450.52 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 8.76 | -20.12 | 0 | 8 | 0 | 102 | 450.52 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.21 | 8.09 | -55.99 | 2 | 8 | 1 | 107 | 451.528 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 9.05 | -46.54 | 1 | 8 | 1 | 104 | 451.528 | 7 | ↓ |
