| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2007 | 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) | 3.41 | 10.65 | -52.08 | 0 | 9 | -1 | 128 | 472.477 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 10.94 | -16.99 | 0 | 9 | 0 | 122 | 473.485 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.86 | 10.02 | -14.1 | 1 | 9 | 0 | 126 | 473.485 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.83 | 11.22 | -53.12 | 1 | 9 | 1 | 124 | 474.493 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.86 | 10.3 | -47.54 | 2 | 9 | 1 | 127 | 474.493 | 8 | ↓ |
