| 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) | 5.47 | 14.61 | -75.26 | 1 | 7 | 0 | 87 | 496.648 | 15 | ↓ |
| Mid Mid (pH 6-8) | 5.91 | 14.5 | -59.11 | 2 | 7 | 1 | 84 | 497.656 | 14 | ↓ |
| Mid Mid (pH 6-8) | 4.88 | 14.5 | -56.44 | 1 | 7 | 1 | 81 | 497.656 | 15 | ↓ |
