| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 26th, 2007 | 31 | 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) | 3.05 | 7.23 | -56.13 | 1 | 7 | -1 | 103 | 438.843 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 6.18 | -28.61 | 2 | 7 | 0 | 100 | 439.851 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 7.17 | -21.14 | 1 | 7 | 0 | 97 | 439.851 | 6 | ↓ |
