| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2006 | 27 | 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) | 3.13 | 7.24 | -57.65 | 0 | 6 | -1 | 83 | 409.245 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 6.17 | -32.5 | 1 | 6 | 0 | 80 | 410.253 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 7.18 | -24.13 | 0 | 6 | 0 | 77 | 410.253 | 6 | ↓ |
