| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2009 | 27 | No |
| 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) | 0.81 | 7.83 | -63.5 | 1 | 5 | -1 | 78 | 394.501 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.09 | 10.59 | -34.65 | 2 | 5 | -1 | 73 | 394.501 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 10.62 | -9.1 | 2 | 5 | 0 | 67 | 395.509 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.81 | 7.79 | -62.17 | 1 | 5 | -1 | 73 | 394.501 | 2 | ↓ |
