| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2008 | 30 | 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) | 4.56 | 9.03 | -23.43 | 2 | 7 | 0 | 101 | 457.606 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.56 | 9.28 | -21.35 | 2 | 7 | 0 | 101 | 457.606 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.02 | 7.78 | -53.58 | 1 | 7 | -1 | 104 | 456.598 | 6 | ↓ |
