| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2007 | 30 | 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) | 1.36 | 5.44 | -58.46 | 0 | 7 | -1 | 86 | 426.518 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | -2.2 | -50.59 | 1 | 7 | 1 | 81 | 428.534 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 8.49 | -46.67 | 2 | 7 | 1 | 84 | 428.534 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.36 | 7.78 | -67.62 | 1 | 7 | 0 | 87 | 427.526 | 6 | ↓ |
