| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | 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) | 2.20 | 4.11 | -29.35 | 2 | 3 | 1 | 28 | 243.415 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 4.22 | -33.4 | 2 | 3 | 1 | 28 | 243.415 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 1.98 | -2.82 | 1 | 3 | 0 | 27 | 242.407 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.20 | 6.39 | -107.04 | 3 | 3 | 2 | 29 | 244.423 | 6 | ↓ |
