| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 16th, 2006 | 37 | 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) | 3.48 | 10.33 | -62.71 | 0 | 8 | -1 | 97 | 502.543 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 10.61 | -18.94 | 1 | 8 | 0 | 95 | 503.551 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 10.97 | -18.93 | 0 | 8 | 0 | 91 | 503.551 | 10 | ↓ |
