| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 32 | 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) | 2.78 | 13.81 | -98.1 | 2 | 7 | 2 | 58 | 450.509 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 11.28 | -10.88 | 0 | 7 | 0 | 56 | 448.493 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 11.46 | -34.27 | 1 | 7 | 1 | 57 | 449.501 | 4 | ↓ |
