| 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) | 5.70 | 14.35 | -68.08 | 1 | 6 | 0 | 74 | 496.623 | 13 | ↓ |
| Hi High (pH 8-9.5) | 5.70 | 12.06 | -55.49 | 0 | 6 | -1 | 73 | 495.615 | 13 | ↓ |
| Mid Mid (pH 6-8) | 6.15 | 13.21 | -56.23 | 2 | 6 | 1 | 71 | 497.631 | 12 | ↓ |
| Mid Mid (pH 6-8) | 5.12 | 14.21 | -55.92 | 1 | 6 | 1 | 68 | 497.631 | 13 | ↓ |
