| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 25th, 2009 | 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) | 4.96 | 14.07 | -40.47 | 1 | 6 | 0 | 72 | 468.553 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.96 | 11.51 | -48.13 | 0 | 6 | -1 | 71 | 467.545 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | 13.6 | -65.67 | 2 | 6 | 1 | 69 | 469.561 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | 10.75 | -13.08 | 1 | 6 | 0 | 68 | 468.553 | 7 | ↓ |
