| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2004 | 35 | 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) | 5.17 | 16.16 | -24.64 | 1 | 7 | 0 | 81 | 467.504 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.17 | 17.17 | -17.97 | 2 | 7 | 0 | 84 | 467.504 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.17 | 16.49 | -42.65 | 2 | 7 | 1 | 83 | 468.512 | 6 | ↓ |
