| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 35 | 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) | 4.41 | 12.06 | -57.8 | 0 | 6 | -1 | 73 | 473.593 | 8 | ↓ |
| Ref Reference (pH 7) | 4.41 | 11.73 | -62.13 | 0 | 6 | -1 | 73 | 473.593 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.41 | 13.75 | -79.13 | 1 | 6 | 0 | 74 | 474.601 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.41 | 14.07 | -76.17 | 1 | 6 | 0 | 74 | 474.601 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.41 | 13.1 | -52.47 | 2 | 6 | 1 | 71 | 475.609 | 9 | ↓ |
