| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 23 | 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) | 1.48 | 6.58 | -44.86 | 4 | 5 | 1 | 61 | 313.425 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 4.26 | -12.63 | 3 | 5 | 0 | 60 | 312.417 | 3 | ↓ |
