| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 16th, 2009 | 30 | No |
None
| 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) | 4.34 | 7.79 | -13.14 | 3 | 8 | 0 | 134 | 401.426 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.34 | 7.12 | -12.79 | 3 | 8 | 0 | 134 | 401.426 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.34 | 8.03 | -58.78 | 4 | 8 | 1 | 135 | 402.434 | 4 | ↓ |
