| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2004 | 35 | 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) | 1.52 | 6.57 | -53.12 | 2 | 10 | 1 | 103 | 484.625 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 4.23 | -16.56 | 1 | 10 | 0 | 101 | 483.617 | 11 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 7.43 | -48.62 | 2 | 10 | 1 | 103 | 484.625 | 11 | ↓ |
