| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2007 | 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) | 1.76 | 5.22 | -56.88 | 1 | 9 | -1 | 136 | 397.363 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | -1.95 | -19.1 | 1 | 9 | 0 | 129 | 398.371 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 4.4 | -18.82 | 2 | 9 | 0 | 133 | 398.371 | 7 | ↓ |
