| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 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) | 3.07 | 8.67 | -36.83 | 1 | 7 | 0 | 75 | 433.508 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 6.27 | -47.16 | 0 | 7 | -1 | 74 | 432.5 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 8.75 | -62.16 | 1 | 7 | 0 | 75 | 433.508 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 8.11 | -55.11 | 2 | 7 | 1 | 72 | 434.516 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 5.62 | -12.13 | 1 | 7 | 0 | 71 | 433.508 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 8.05 | -61.41 | 2 | 7 | 1 | 72 | 434.516 | 4 | ↓ |
