| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2009 | 26 | 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) | 3.11 | 10.33 | -15.55 | 1 | 4 | 0 | 47 | 341.414 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 9.15 | -38.34 | 2 | 4 | 1 | 52 | 342.422 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.11 | 10.8 | -49.57 | 2 | 4 | 1 | 48 | 342.422 | 5 | ↓ |
