| 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) | 1.12 | 4.03 | -39.28 | 2 | 3 | 1 | 23 | 220.34 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 2.66 | -3.54 | 1 | 3 | 0 | 19 | 219.332 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 4.79 | -74.79 | 3 | 3 | 0 | 24 | 221.348 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
