| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 33 | 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) | 3.20 | 7.28 | -66.9 | 0 | 8 | -1 | 97 | 454.499 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.65 | 7.62 | -18.16 | 1 | 8 | 0 | 95 | 455.507 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 1.51 | -13.63 | 0 | 8 | 0 | 91 | 455.507 | 10 | ↓ |
