| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 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) | 1.10 | 6.11 | -119.09 | 4 | 3 | 2 | 45 | 230.311 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 4.12 | -42.42 | 3 | 3 | 1 | 44 | 229.303 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
