| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 12th, 2007 | 32 | 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) | 2.42 | 6.83 | -60.2 | 0 | 7 | -1 | 86 | 519.441 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.86 | -1.81 | -50.74 | 2 | 7 | 1 | 84 | 521.457 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | -2.88 | -53.22 | 1 | 7 | 1 | 81 | 521.457 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 9.17 | -71.24 | 1 | 7 | 0 | 87 | 520.449 | 7 | ↓ |
