| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2009 | 34 | 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) | 1.90 | 9.44 | -63.11 | 1 | 7 | -1 | 96 | 496.634 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.18 | 12.23 | -35.9 | 2 | 7 | -1 | 91 | 496.634 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.83 | 12.25 | -11.9 | 2 | 7 | 0 | 85 | 497.642 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.90 | 9.43 | -63.24 | 1 | 7 | -1 | 92 | 496.634 | 7 | ↓ |
