| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 29 | 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) | 3.58 | 8.5 | -58.72 | 0 | 6 | -1 | 79 | 459.316 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 8.64 | -13.69 | 1 | 6 | 0 | 76 | 460.324 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | -1 | -12.68 | 0 | 6 | 0 | 72 | 460.324 | 8 | ↓ |
