| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2006 | 24 | 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) | 4.46 | 7.01 | -10.82 | 2 | 5 | 0 | 70 | 381.233 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.46 | 7.51 | -83.27 | 4 | 5 | 2 | 73 | 383.249 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 5.65 | 5.47 | -29.03 | 3 | 5 | 1 | 75 | 382.241 | 2 | ↓ |
