| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 26 | No |
| 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) | 0.63 | 0.52 | -50.84 | 6 | 7 | 1 | 116 | 411.972 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | -1.28 | -7.12 | 5 | 7 | 0 | 111 | 410.964 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
