| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 12 | Yes |
| 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) | 0.09 | -2.04 | -42.06 | 3 | 7 | -1 | 113 | 166.12 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.09 | -1.06 | -112.26 | 2 | 7 | -2 | 116 | 165.112 | 0 | ↓ |
| Hi High (pH 8-9.5) | -0.37 | 0.8 | -69.57 | 4 | 7 | 0 | 114 | 167.128 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.37 | -0.68 | -15.52 | 4 | 7 | 0 | 110 | 167.128 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.37 | 0.37 | -57.39 | 3 | 7 | -1 | 113 | 166.12 | 0 | ↓ |
