| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2009 | 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) | 2.54 | 9.33 | -102.72 | 3 | 9 | 2 | 104 | 441.598 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 4.96 | -10.54 | 1 | 9 | 0 | 102 | 439.582 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 6.92 | -54.3 | 2 | 9 | 1 | 103 | 440.59 | 7 | ↓ |
