| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2006 | 30 | 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) | 1.83 | 5.86 | -62.41 | 1 | 8 | -1 | 112 | 414.434 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 5.56 | -25.24 | 1 | 8 | 0 | 106 | 415.442 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 5.61 | -34.4 | 2 | 8 | 0 | 109 | 415.442 | 8 | ↓ |
