| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 33 | 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) | 2.64 | 10.72 | -66.15 | 1 | 6 | -1 | 87 | 480.635 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.92 | 12.2 | -43.23 | 2 | 6 | -1 | 82 | 480.635 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.57 | 12.24 | -16.52 | 2 | 6 | 0 | 76 | 481.643 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.55 | 10.57 | -64.32 | 0 | 6 | -1 | 86 | 480.635 | 7 | ↓ |
