| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 27 | No |
None
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) | 3.44 | 9.16 | -42.05 | 2 | 5 | 1 | 58 | 365.453 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 9.94 | -29.92 | 1 | 5 | 0 | 61 | 364.445 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 9.93 | -106.59 | 3 | 5 | 0 | 59 | 366.461 | 4 | ↓ |
