| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2007 | 36 | 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) | 5.99 | 14.75 | -75.5 | 1 | 6 | 0 | 74 | 492.66 | 11 | ↓ |
| Hi High (pH 8-9.5) | 5.99 | 12.22 | -58.36 | 0 | 6 | -1 | 73 | 491.652 | 11 | ↓ |
| Mid Mid (pH 6-8) | 6.43 | 14.56 | -44.07 | 2 | 6 | 1 | 71 | 493.668 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.40 | 2.47 | -46.35 | 1 | 6 | 1 | 68 | 493.668 | 11 | ↓ |
