| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2007 | 30 | 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) | 2.50 | 7.51 | -60.5 | 0 | 7 | -1 | 92 | 410.446 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 7.7 | -14.3 | 0 | 7 | 0 | 86 | 411.454 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 6.69 | -16.32 | 1 | 7 | 0 | 89 | 411.454 | 7 | ↓ |
