| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 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) | -0.18 | 6.6 | -101.2 | 3 | 5 | 2 | 55 | 286.416 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.18 | 2.17 | -9.49 | 1 | 5 | 0 | 53 | 284.4 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.18 | 4.43 | -40.65 | 2 | 5 | 1 | 54 | 285.408 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
