| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 31 | 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) | 3.23 | 9.79 | -59.24 | 0 | 6 | -1 | 83 | 433.871 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.67 | -0.16 | -21.01 | 1 | 6 | 0 | 79 | 434.879 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 0.9 | -12.38 | 0 | 6 | 0 | 76 | 434.879 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.67 | 9.95 | -44.42 | 2 | 6 | 1 | 81 | 435.887 | 5 | ↓ |
