| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 28 | No |
None
| 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 | 8.33 | -127.01 | 1 | 7 | -1 | 101 | 445.293 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.90 | 5.79 | -123.05 | 0 | 7 | -2 | 100 | 444.285 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.90 | 7.31 | -78.89 | 2 | 7 | 0 | 98 | 446.301 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.90 | 5.86 | -46.77 | 3 | 7 | 1 | 95 | 447.309 | 6 | ↓ |
