| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2008 | 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) | 3.43 | 11.98 | -70.63 | 1 | 7 | 0 | 87 | 465.594 | 11 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 9.76 | -55.95 | 0 | 7 | -1 | 86 | 464.586 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.87 | 10.9 | -59.54 | 2 | 7 | 1 | 84 | 466.602 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.87 | 11.18 | -120.36 | 3 | 7 | 2 | 85 | 467.61 | 10 | ↓ |
