| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 36 | 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) | 5.24 | 11.19 | -53.23 | 0 | 7 | -1 | 92 | 503.531 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.65 | -0.13 | -12.2 | 0 | 7 | 0 | 85 | 504.539 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.24 | 10.37 | -14.89 | 1 | 7 | 0 | 89 | 504.539 | 7 | ↓ |
