| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2006 | 28 | 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) | 2.40 | 7.4 | -62.9 | 0 | 6 | -1 | 83 | 384.383 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 0.11 | -24.91 | 0 | 6 | 0 | 76 | 385.391 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.40 | 6.64 | -16.45 | 1 | 6 | 0 | 80 | 385.391 | 5 | ↓ |
