| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 35 | 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 | 7.89 | -57.21 | 1 | 8 | -1 | 115 | 533.051 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.26 | 7.93 | -111.96 | 0 | 8 | -2 | 117 | 532.043 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.26 | 7.88 | -54.69 | 1 | 8 | -1 | 115 | 533.051 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.26 | 7.78 | -19.82 | 2 | 8 | 0 | 113 | 534.059 | 7 | ↓ |
