| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 14th, 2006 | 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) | 3.74 | 10.59 | -61.46 | 0 | 5 | -1 | 73 | 407.446 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 10.57 | -24.59 | 1 | 5 | 0 | 71 | 408.454 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 10.86 | -13.3 | 0 | 5 | 0 | 67 | 408.454 | 4 | ↓ |
