| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 22nd, 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) | 3.25 | 9.1 | -50.99 | 0 | 8 | -1 | 115 | 429.836 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 0.03 | -14.86 | 0 | 8 | 0 | 109 | 430.844 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.69 | 8.27 | -20.09 | 1 | 8 | 0 | 113 | 430.844 | 7 | ↓ |
