| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2009 | 32 | 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) | 4.26 | 5.47 | -45.24 | 1 | 7 | -1 | 104 | 492.305 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.26 | 6.24 | -93.81 | 0 | 7 | -2 | 107 | 491.297 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.80 | 8.12 | -11.76 | 2 | 7 | 0 | 101 | 493.313 | 5 | ↓ |
