| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 36 | 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) | 5.06 | 13.47 | -51.15 | 1 | 7 | 0 | 83 | 494.632 | 14 | ↓ |
| Hi High (pH 8-9.5) | 5.06 | 11.18 | -43.1 | 0 | 7 | -1 | 82 | 493.624 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 5.06 | 12.35 | -49.93 | 2 | 7 | 1 | 81 | 495.64 | 14 | ↓ |
