| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2008 | 21 | 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) | 2.43 | 6.88 | -35.59 | 1 | 3 | 1 | 11 | 288.459 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 6.96 | -34.2 | 1 | 3 | 1 | 11 | 288.459 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.43 | 9.23 | -100.47 | 2 | 3 | 2 | 12 | 289.467 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.43 | 9.41 | -83.08 | 2 | 3 | 2 | 12 | 289.467 | 4 | ↓ |
