| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 32 | 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) | 2.86 | 10.24 | -75.32 | 1 | 7 | 0 | 83 | 442.487 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 8.89 | -57.85 | 2 | 7 | 1 | 81 | 443.495 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 10.08 | -59 | 1 | 7 | 1 | 77 | 443.495 | 9 | ↓ |
