| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 27 | 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) | 0.49 | 7.32 | -74.94 | 1 | 8 | 0 | 96 | 372.425 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.49 | 4.79 | -59.35 | 0 | 8 | -1 | 95 | 371.417 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 5.93 | -63.02 | 2 | 8 | 1 | 93 | 373.433 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.10 | 7.11 | -62.38 | 1 | 8 | 1 | 90 | 373.433 | 6 | ↓ |
