| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 16th, 2009 | 34 | 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) | 3.59 | 8.34 | -21.29 | 1 | 7 | 0 | 92 | 491.594 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.04 | 6.33 | -67.12 | 0 | 7 | -1 | 95 | 490.586 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.59 | 8.93 | -55.94 | 2 | 7 | 1 | 94 | 492.602 | 3 | ↓ |
