| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2007 | 34 | 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) | 4.70 | 10.17 | -58.8 | 0 | 7 | -1 | 92 | 471.514 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.11 | 10.42 | -13.19 | 0 | 7 | 0 | 86 | 472.522 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.14 | 10.12 | -19.03 | 1 | 7 | 0 | 89 | 472.522 | 5 | ↓ |
