| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 22nd, 2009 | 31 | 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) | 4.21 | 7.49 | -11.83 | 0 | 6 | 0 | 55 | 439.581 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.21 | 9.81 | -45.38 | 1 | 6 | 1 | 56 | 440.589 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.21 | 7.88 | -36.28 | 1 | 6 | 1 | 56 | 440.589 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.21 | 10.2 | -85.78 | 2 | 6 | 2 | 57 | 441.597 | 5 | ↓ |
