| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 18 | 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) | 0.72 | 3.71 | -37.83 | 2 | 4 | 1 | 40 | 252.382 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | 2.86 | -6.83 | 1 | 4 | 0 | 36 | 251.374 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 5.36 | -37.94 | 2 | 4 | 1 | 37 | 252.382 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
