| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 16 | 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) | 1.87 | 4.79 | -10.97 | 1 | 4 | 0 | 47 | 215.256 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 4.96 | -34.66 | 2 | 4 | 1 | 48 | 216.264 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 4.96 | -31.53 | 2 | 4 | 1 | 48 | 216.264 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
