| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2007 | 33 | 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) | 2.76 | 6.86 | -65.21 | 1 | 7 | -1 | 103 | 441.463 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 6.8 | -13.06 | 2 | 7 | 0 | 100 | 442.471 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.21 | 7.1 | -44.62 | 3 | 7 | 1 | 101 | 443.479 | 7 | ↓ |
