| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2010 | 32 | 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) | -0.40 | 3.6 | -66.86 | 4 | 9 | -1 | 161 | 459.862 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.40 | 4.59 | -129.63 | 3 | 9 | -2 | 164 | 458.854 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.40 | 6.04 | -127.55 | 4 | 9 | -1 | 165 | 459.862 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.40 | 5.16 | -102.38 | 4 | 9 | -1 | 165 | 459.862 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.40 | 6.36 | -146.77 | 3 | 9 | -2 | 168 | 458.854 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.40 | 5.23 | -60.15 | 5 | 9 | 0 | 162 | 460.87 | 2 | ↓ |
