| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 17 | 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) | 2.28 | 7.27 | -39.1 | 2 | 2 | 1 | 29 | 227.331 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 6.18 | -4.81 | 1 | 2 | 0 | 25 | 226.323 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 7.74 | -101.6 | 3 | 2 | 2 | 31 | 228.339 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
