| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 29 | 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) | 4.23 | 11 | -58.68 | 0 | 5 | -1 | 73 | 423.901 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.64 | 11.33 | -10.56 | 0 | 5 | 0 | 67 | 424.909 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.67 | 10.29 | -15.47 | 1 | 5 | 0 | 71 | 424.909 | 3 | ↓ |
