| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 19th, 2006 | 29 | 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) | 1.80 | 14.52 | -27.07 | 0 | 7 | 0 | 80 | 389.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 14.73 | -58.71 | 0 | 7 | -1 | 82 | 388.382 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 15.21 | -31.98 | 2 | 7 | 1 | 85 | 390.398 | 3 | ↓ |
