| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 32 | Yes |
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) | 3.31 | 7.31 | -13.81 | 2 | 7 | 0 | 91 | 426.476 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 8.08 | -54.05 | 1 | 7 | -1 | 94 | 425.468 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.31 | 7.75 | -40.32 | 3 | 7 | 1 | 93 | 427.484 | 6 | ↓ |
