| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 18 | 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) | 3.71 | 6.61 | -48.86 | 3 | 2 | 1 | 37 | 262.76 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 7.38 | -62.48 | 2 | 2 | 0 | 40 | 261.752 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 6.02 | -42.2 | 1 | 2 | -1 | 35 | 260.744 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 5.26 | -5.21 | 2 | 2 | 0 | 32 | 261.752 | 4 | ↓ |
