| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2005 | 32 | 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) | 7.11 | 16.64 | -25.76 | 2 | 5 | 1 | 57 | 436.62 | 9 | ↓ |
| Hi High (pH 8-9.5) | 7.11 | 16.27 | -15.81 | 1 | 5 | 0 | 56 | 435.612 | 9 | ↓ |
| Mid Mid (pH 6-8) | 7.11 | 16.74 | -86.68 | 3 | 5 | 2 | 61 | 437.628 | 9 | ↓ |
