| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 35 | 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) | 1.09 | 13.19 | -72.89 | 2 | 9 | -1 | 143 | 479.509 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 12.62 | -138.68 | 1 | 9 | -2 | 139 | 478.501 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.09 | 11.22 | -33.29 | 3 | 9 | 0 | 141 | 480.517 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.10 | 10.48 | -35.94 | 3 | 9 | 0 | 141 | 480.517 | 8 | ↓ |
