| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 39 | 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) | 6.63 | 16.16 | -70.19 | 1 | 7 | 0 | 83 | 536.713 | 17 | ↓ |
| Hi High (pH 8-9.5) | 6.63 | 13.95 | -58.42 | 0 | 7 | -1 | 82 | 535.705 | 17 | ↓ |
| Lo Low (pH 4.5-6) | 6.63 | 14.87 | -56.17 | 2 | 7 | 1 | 81 | 537.721 | 17 | ↓ |
