| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 33 | Yes |
| 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) | 1.69 | 4.18 | -51.19 | 2 | 9 | 1 | 87 | 458.583 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 1.92 | -11.46 | 1 | 9 | 0 | 86 | 457.575 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.69 | 4.17 | -47.33 | 2 | 9 | 1 | 87 | 458.583 | 8 | ↓ |
