| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2008 | 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) | 3.54 | 8.4 | -58.73 | 0 | 6 | -1 | 79 | 471.327 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.95 | 8.94 | -17.4 | 0 | 6 | 0 | 73 | 472.335 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.98 | 7.91 | -27.49 | 1 | 6 | 0 | 76 | 472.335 | 5 | ↓ |
