| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 28th, 2006 | 22 | 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) | 2.42 | 3.61 | -11.95 | 1 | 6 | 0 | 78 | 322.386 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 3.69 | -46.29 | 0 | 6 | -1 | 80 | 321.378 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 3.9 | -39.62 | 2 | 6 | 1 | 79 | 323.394 | 7 | ↓ |
