| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 33 | Yes |
| 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) | 4.20 | 9.39 | -34.36 | 1 | 7 | 1 | 61 | 445.543 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 11.71 | -98.99 | 2 | 7 | 2 | 62 | 446.551 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 9.09 | -14.5 | 0 | 7 | 0 | 60 | 444.535 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 12.37 | -53.84 | 1 | 7 | 1 | 61 | 445.543 | 5 | ↓ |
