| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2006 | 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) | 1.10 | 6.77 | -57.81 | 0 | 8 | -1 | 101 | 411.434 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | -0.99 | -32.54 | 1 | 8 | 0 | 98 | 412.442 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.51 | -0.77 | -23.84 | 0 | 8 | 0 | 95 | 412.442 | 9 | ↓ |
