| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 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) | 2.75 | 4.71 | -11.41 | 2 | 5 | 0 | 82 | 292.408 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 2.58 | -46.89 | 1 | 5 | -1 | 85 | 291.4 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.75 | 5.08 | -57.17 | 3 | 5 | 1 | 86 | 293.416 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
