| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 32 | 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) | 2.79 | 7.92 | -42.55 | 3 | 7 | 1 | 73 | 438.596 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 10.17 | -109.78 | 4 | 7 | 2 | 74 | 439.604 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 8.24 | -81.97 | 4 | 7 | 2 | 74 | 439.604 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.79 | 10.51 | -182.36 | 5 | 7 | 3 | 76 | 440.612 | 9 | ↓ |
