| 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) | 0.22 | 1.71 | -16.54 | 3 | 5 | 0 | 81 | 220.276 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 1.87 | -38.94 | 4 | 5 | 1 | 82 | 221.284 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 1.88 | -35.75 | 4 | 5 | 1 | 82 | 221.284 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
