| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2006 | 26 | 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) | 6.19 | 11.8 | -29.91 | 2 | 3 | 0 | 49 | 470.164 | 2 | ↓ |
| Hi High (pH 8-9.5) | 6.64 | 11.06 | -39.75 | 1 | 3 | -1 | 52 | 469.156 | 3 | ↓ |
| Mid Mid (pH 6-8) | 6.64 | -2.66 | -31.74 | 3 | 3 | 1 | 50 | 471.172 | 3 | ↓ |
| Mid Mid (pH 6-8) | 6.64 | 11.81 | -29.97 | 2 | 3 | 0 | 53 | 470.164 | 3 | ↓ |
| Mid Mid (pH 6-8) | 6.64 | 10.29 | -8 | 2 | 3 | 0 | 49 | 470.164 | 3 | ↓ |
