| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 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) | 2.54 | 9.36 | -58.11 | 0 | 9 | -1 | 99 | 489.552 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 11.62 | -64.12 | 1 | 9 | 0 | 101 | 490.56 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.54 | 10.86 | -47.9 | 2 | 9 | 1 | 98 | 491.568 | 7 | ↓ |
