| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2009 | 27 | 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) | 3.30 | 8.64 | -28.57 | 2 | 6 | 0 | 88 | 416.553 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 6.34 | -64.24 | 1 | 6 | -1 | 91 | 415.545 | 5 | ↓ |
