| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 31 | 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) | 2.62 | 7.68 | -55.13 | 0 | 8 | -1 | 105 | 436.469 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 0.2 | -13.29 | 0 | 8 | 0 | 98 | 437.477 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.62 | 6.86 | -16.96 | 1 | 8 | 0 | 102 | 437.477 | 6 | ↓ |
