| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 4th, 2006 | 38 | 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) | -4.69 | -16.37 | -53.15 | 10 | 15 | -1 | 273 | 880.141 | 14 | ↓ |
| Ref Reference (pH 7) | -4.69 | -14.74 | -52.19 | 10 | 15 | -1 | 273 | 880.141 | 14 | ↓ |
| Hi High (pH 8-9.5) | -4.78 | -14.83 | -56.56 | 10 | 15 | -1 | 269 | 880.141 | 14 | ↓ |
| Hi High (pH 8-9.5) | -4.69 | -15.87 | -125.24 | 9 | 15 | -2 | 275 | 879.133 | 14 | ↓ |
| Hi High (pH 8-9.5) | -4.78 | -12.81 | -55.54 | 10 | 15 | -1 | 269 | 880.141 | 14 | ↓ |
| Hi High (pH 8-9.5) | -4.69 | -13.92 | -124.13 | 9 | 15 | -2 | 275 | 879.133 | 14 | ↓ |
| Mid Mid (pH 6-8) | -4.78 | -13.63 | -19.65 | 11 | 15 | 0 | 266 | 881.149 | 14 | ↓ |
| Mid Mid (pH 6-8) | -4.78 | -15.33 | -20.15 | 11 | 15 | 0 | 266 | 881.149 | 14 | ↓ |
No pre-computed analogs available. Try a structural similarity search.