| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 20 | Yes |
| 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) | 0.83 | 1.07 | -45.66 | 3 | 5 | 1 | 62 | 281.376 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | -0.11 | -8.06 | 2 | 5 | 0 | 58 | 280.368 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | 2.41 | -37.52 | 3 | 5 | 1 | 59 | 281.376 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
