| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 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) | 5.95 | 14.82 | -67.04 | 1 | 6 | 0 | 74 | 492.66 | 13 | ↓ |
| Hi High (pH 8-9.5) | 5.95 | 12.62 | -58.71 | 0 | 6 | -1 | 73 | 491.652 | 13 | ↓ |
| Mid Mid (pH 6-8) | 5.36 | 2.21 | -42.81 | 1 | 6 | 1 | 68 | 493.668 | 13 | ↓ |
