| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 18 | 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) | 3.87 | 7.61 | -43.7 | 3 | 1 | 1 | 28 | 242.317 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.87 | 7.37 | -4.86 | 2 | 1 | 0 | 26 | 241.309 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
