| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 30 | No |
None
| 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) | 3.12 | 4.88 | -18.15 | 3 | 8 | 0 | 113 | 424.482 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.30 | 3.01 | -47.48 | 2 | 8 | -1 | 120 | 423.474 | 7 | ↓ |
