| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 24th, 2010 | 29 | 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) | 1.95 | 1.89 | -59.92 | 2 | 8 | -1 | 117 | 461.244 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 2.81 | -116.1 | 1 | 8 | -2 | 120 | 460.236 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.95 | 1.13 | -20.07 | 3 | 8 | 0 | 114 | 462.252 | 4 | ↓ |
