| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 36 | 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) | 3.81 | 13.18 | -83.35 | 1 | 8 | 0 | 96 | 498.62 | 14 | ↓ |
| Mid Mid (pH 6-8) | 4.26 | 12.92 | -67.12 | 2 | 8 | 1 | 94 | 499.628 | 13 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 12.93 | -63.99 | 1 | 8 | 1 | 90 | 499.628 | 14 | ↓ |
