| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 9th, 2006 | 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) | 1.35 | 5.24 | -66.24 | 0 | 8 | -1 | 101 | 398.391 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | -1.03 | -12.71 | 0 | 8 | 0 | 95 | 399.399 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.35 | 4.42 | -20.71 | 1 | 8 | 0 | 98 | 399.399 | 6 | ↓ |
