| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | 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) | 0.04 | 2.29 | -47.65 | 3 | 4 | 1 | 49 | 275.372 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.04 | 1.99 | -4.46 | 2 | 4 | 0 | 48 | 274.364 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.04 | 4.45 | -131.35 | 4 | 4 | 2 | 51 | 276.38 | 1 | ↓ |
