| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 40 | 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) | 7.33 | 12.18 | -21.65 | 3 | 9 | 0 | 131 | 540.572 | 9 | ↓ |
| Hi High (pH 8-9.5) | 7.33 | 13.16 | -71.75 | 2 | 9 | -1 | 134 | 539.564 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
