| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 33 | 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) | 4.78 | 10.87 | -58.12 | 0 | 6 | -1 | 83 | 459.478 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | -0.22 | -12.08 | 0 | 6 | 0 | 76 | 460.486 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.78 | 10.79 | -15.74 | 1 | 6 | 0 | 80 | 460.486 | 5 | ↓ |
